CandActCFTR Seed Compounds


The following 3114 structures with currently 268914 synonyms are a list compounds which have been reported in 111 CFTR related publications published in the past decade. We collected all structures regardless of an activation of CFTR function or an improvement of CFTR processing, thus also including reported negative compound references or even inhibitors.



ID: 2001

chemical graph of compound 2001



InChIKey: RRCYPDDIDYVEIW-UHFFFAOYSA-N
SMILES: COC1=CC=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3O)OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6710639
synonyms found at PubChem are:
RETUSIN 7-METHYL ETHER, KBio2_006097, Spectrum_000481, AC1O8JTF, Spectrum2_000055, Spectrum3_001266, Spectrum4_001287, Spectrum5_000013, BSPBio_002832, KBioGR_001633, KBioSS_000961, SPECTRUM240645, SPBio_000209, CHEMBL1290347, KBio2_000961, KBio2_003529, KBio3_002332, RRCYPDDIDYVEIW-UHFFFAOYSA-N, CCG-38359, SDCCGMLS-0066500.P001, NCGC00095551-01, NCGC00095551-02, NCGC00178446-01, SR-05000002550, SR-05000002550-1, 8-hydroxy-7-methoxy-3-(4-methoxyphenyl)chromen-4-one, BRD-K59294488-001-02-1, 15607-89-3


ID: 2002

chemical graph of compound 2002



InChIKey: RRGUKTPIGVIEKM-UHFFFAOYSA-N
SMILES: C1CCC(CC1)N2C(=NN=N2)CCCCOC3=CC4=C(C=C3)NC(=O)CC4

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 2754
synonyms found at PubChem are:
cilostazol, 73963-72-1, Pletal, Cilostazole, Pletaal, Cilostazolum, OPC-13013, Cilostazolum [INN-Latin], OPC 13013, OPC 21, OPC-21, Cilostazol [INN:JAN], Pletal (TN), UNII-N7Z035406B, C20H27N5O2, 6-(4-(1-Cyclohexyl-1H-tetrazol-5-yl)butoxy)-3,4-dihydro-2(1H)-quinolinone, BRN 3632107, 6-[4-(1-cyclohexyltetrazol-5-yl)butoxy]-3,4-dihydro-1H-quinolin-2-one, 3,4-Dihydro-6-(4-(1-cyclohexyl-1H-tetrazol-5-yl)butoxy)-2(1H)-quinolinone, 6-(4-(1-cyclohexyl-1H-tetrazol-5-yl)butoxy)-3,4-dihydroquinolin-2(1H)-one, MLS000028470, CHEBI:31401, 6-(4-(1-Cyclohexyl-1H-tetrazol-5-yl)butoxy)-3,4-dihydrocarbostyril, N7Z035406B, NCGC00015207-07, SMR000058428, 6-[4-(1-Cyclohexyl-1H-tetrazol-5-yl)butoxy]-3,4-dihydro-2(1H)-quinolinone, 6-[4-(1-cyclohexyl-1H-tetrazol-5-yl)butoxy]-3,4-dihydroquinolin-2(1H)-one, C 0737, DSSTox_CID_25132, DSSTox_RID_80693, DSSTox_GSID_45132, Q-200854, 6-(4-(1-Cyclohexyl-1H-tetrazol-5-yl)butoxyl)-3,4-dihydrocarobostyril, 2(1H)-Quinolinone, 3,4-dihydro-6-(4-(1-cyclohexyl-1H-tetrazol-5-yl)butoxy)-, 2(1H)-Quionlinone, 6-(4-(1-cyclohexyl-1H-tetrazol-5-yl)butoxy)-3,4-dihydro-, 6-[4-(1-cyclohexyl-1H-1,2,3,4-tetrazol-5-yl)butoxy]-1,2,3,4-tetrahydroquinolin-2-one, 6-[4-(1-Cyclohexyl-1H-tetrazol-5-yl)-butoxy]-3,4-dihydro-2(1H)-quinolinone, CPD000058428, CAS-73963-72-1, SR-01000003107, Cilostazol,(S), Pletal, Cilostazol, CILASTAZOL, RETAL, Pleta (TN), Cilostazol [USAN:USP:INN:BAN:JAN], Tocris-1692, Opera_ID_488, Spectrum2_001118, Spectrum3_001170, Spectrum4_000772, Spectrum5_001762, Lopac-C-0737, Otsuka brand of cilostazol, CHEMBL799, D03VPC, D0E7MJ, AC1L1EE2, Lopac0_000218, REGID_for_CID_2754, SCHEMBL16128, BSPBio_002759, KBioGR_001184, MLS000758281, MLS000759507, MLS001076067, MLS002153891, SPECTRUM1505230, SPBio_001256, GTPL7148, Cilostazol (JP15/USAN/INN), Cilostazol (JP17/USAN/INN), DTXSID9045132, CTK8F0315, HSDB 8312, KBio3_002259, MolPort-001-758-007, RRGUKTPIGVIEKM-UHFFFAOYSA-N, ZX-AFC000447, BCPP000279, HMS1922N15, HMS2093M14, HMS2096F16, HMS2234C06, HMS3260L17, HMS3268O09, HMS3654J13, HMS3713F16, Pharmakon1600-01505230, ACT02663, BCP03724, ZINC1552174, ZX-AT018851, Tox21_110098, Tox21_500218, BI7396, BS0279, CCG-39646, KM1582, MFCD00866780, NSC758936, s1294, AKOS015855512, Cilostazol, >=98% (HPLC), powder, OPC 13013; OPC 21; Pletaal, Tox21_110098_1, AC-4334, AM90304, API0002016, BCP9000530, CL23867, CS-1759, DB01166, KS-5154, LP00218, MCULE-8893820969, NSC-758936, OR13681, RP18108, NCGC00015207-01, NCGC00015207-02, NCGC00015207-03, NCGC00015207-04, NCGC00015207-05, NCGC00015207-06, NCGC00015207-08, NCGC00015207-09, NCGC00015207-10, NCGC00015207-11, NCGC00015207-12, NCGC00022153-02, NCGC00022153-04, NCGC00022153-05, NCGC00022153-06, NCGC00022153-07, NCGC00260903-01, AJ-26894, AN-12078, CC-25783, CJ-24365, HY-17464, SAM001246734, SAM001247085, SC-14107, BCP0726000145, SBI-0050206.P002, AB0012441, AB2000035, LS-142693, TC-063580, TL8005113, EU-0100218, FT-0602474, FT-0645036, ST24046323, D01896, J90029, AB00382988-14, AB00382988_15, AB00382988_16, 963C721, A837982, C-21103, SR-01000003107-2, SR-01000003107-4, SR-01000003107-7, BRD-K67017579-001-04-2, BRD-K67017579-001-05-9, BRD-K67017579-001-07-5, BRD-K67017579-001-13-3, BRD-K67017579-001-17-4, SR-01000003107-10, Cilastatin sodium, Antibiotic for Culture Media Use Only, Cilostazol, United States Pharmacopeia (USP) Reference Standard, 6-[4-(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)butoxy]-3,4-dihydrocarbostyril, 6-[4-(1-cyclohexyl-5-tetrazolyl)butoxy]-3,4-dihydro-1H-quinolin-2-one, 6-[4-(l-cyclohexyl-1,2,3,4-tetrazol-5-yl)butoxyl]-3,4-dihydrocarbostyril, Cilostazol, Pharmaceutical Secondary Standard; Certified Reference Material, 2(1H)-Quinolinone, 6-[4-(1-cyclohexyl-1H-tetrazol-5-yl)butoxy]-3,4-dihydro-, 6-[4-(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)butoxy]-3,4-dihydro-1H-quinolin-2-one, 6-[4-(1-Cyclohexyl-1H-tetrazol-5-yl)-butoxy]-3,4-dihydro-1H-quinolin-2-one, 6-[4-(1-Cyclohexyl-1H-tetrazol-5-yl)butoxy]-2-oxo-1,2,3,4-tetrahydroquinoline


ID: 2003

chemical graph of compound 2003



InChIKey: RRIXMDDCPQUWIO-UHFFFAOYSA-N
SMILES: C(C1=C(C)C=CS1)1C(C(=O)OCC=C)=C(C)NC(C)=C1C(=O)OCC=C

biological descriptors:

CFTR relevance: CFTR activator

Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown

reference list:

"P Fossa" "N Pedemonte" "LJ Galietta" "M Giampieri" "F Cateni" "M Mazzei" "MT Mazzei" "M Zacchigna"


CID is 10833168
synonyms found at PubChem are:
CHEMBL593638, 2,6-Dimethyl-4-(3-methyl-2-thienyl)-1,4-dihydropyridine-3,5-dicarboxylic acid diallyl ester


ID: 2004

chemical graph of compound 2004



InChIKey: RRJFVPUCXDGFJB-UHFFFAOYSA-N
SMILES: CC(C)(C1=CC=C(C=C1)C(CCCN2CCC(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O)O)C(=O)O.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 63002
synonyms found at PubChem are:
FEXOFENADINE HYDROCHLORIDE, 153439-40-8, FEXOFENADINE HCL, Allegra, Telfast, 2-(4-(1-Hydroxy-4-(4-(hydroxydiphenylmethyl)piperidin-1-yl)butyl)phenyl)-2-methylpropanoic acid hydrochloride, Fexofenidine hydrochloride, MDL 16,455A, 138452-21-8, Fexofenadine (hydrochloride), Terfenadine carboxylate hydrochloride, MDL 16455 hydrochloride, MDL-16455A, Terfenidine carboxylate hydrochloride, Allegra (TN), MDL-16455, C32H40ClNO4, DSSTox_CID_28642, DSSTox_RID_82912, DSSTox_GSID_48716, 2-(4-{1-hydroxy-4-[4-(hydroxydiphenylmethyl)piperidin-1-yl]butyl}phenyl)-2-methylpropanoic acid hydrochloride, Allegra Allergy, Allegra Hives, SMR000718798, CAS-153439-40-8, MFCD00865710, NCGC00015453-05, Children's Allegra Hives, Children's Allegra Allergy, Altiva, UNII-2S068B75ZU, Carboxyterfenadine hydrochloride, Allegra Flash, SR-01000075889, Allegra OD, Fexofenadine, HCl, fexofenadine(hclform), Fexofenadine hydrochloride [USAN:USP], MDL 16.455, TELFAST BD, FexofenadineHydrochloride, AC1L1Y6V, AC1Q3E6W, C32H39NO4.HCl, SCHEMBL40914, MLS001306422, MLS001332493, MLS001332494, FEXOFENADINE(HCL FORM), SPECTRUM1504179, CHEBI:5051, CHEMBL1200618, DTXSID5048716, CTK8B4006, HY-B0801A, MolPort-003-666-536, RRJFVPUCXDGFJB-UHFFFAOYSA-N, 2S068B75ZU, MDL 16455A, Pharmakon1600-01504179, KS-000011XN, Tox21_113125, ANW-43654, CF0042, NSC758678, s3208, AKOS015907422, Tox21_113125_1, AB07499, CCG-213275, CS-4483, KS-1057, NC00724, NSC-758678, RP17816, RTR-006346, alpha-(4-(1-carboxy-1-methylethyl)phenyl)-4-hydroxydiphenylmethyl-1-piperidinebutanol, Fexofenadine hydrochloride (JP17/USAN), NCGC00015453-02, NCGC00015453-08, NCGC00092389-01, NCGC00095906-01, NCGC00095906-02, (+-)-p-(1-Hydroxy-4-(4-(hydroxydiphenylmethyl)piperidino)butyl)-alpha-methylhydratropic acid hydrochloride, 2-[4-[1-Hydroxy-4-[4-(hydroxy-diphenyl-methyl)-1-piperidyl]-butyl]phenyl]-2-methyl-propanoicacidhydrochloride, AC-24745, BR-72915, CPD000718798, SAM002700173, Fexofenadine hydrochloride, >98% (HPLC), AB0011964, KB-222041, LS-173025, TR-006346, 4CH-009369, A3371, F0698, FT-0631183, M-016455-O, BIM-0050472.0001, CARBOXYTERFENADINE,TERFENADINECARBOXYLATE, D00671, J10191, S-5170, 452F218, J-505843, SR-01000075889-6, Z2210694607, Fexofenadine hydrochloride, European Pharmacopoeia (EP) Reference Standard, 2-[4-(1-hydroxy-4-{4-[hydroxy(diphenyl)methyl]piperidin-1-yl}butyl)phenyl]-2-methylpropans, Fexofenadine HCl, Pharmaceutical Secondary Standard; Certified Reference Material, Fexofenadine hydrochloride, United States Pharmacopeia (USP) Reference Standard, 2-(4-(1-HYDROXY-4-(4-(HYDROXYDIPHENYLMETHYL)PIPERIDIN-1-YL)BUTYL)PHENYL)-2-METHYLPROPANOIC ACID HCL, 2-(4-(1-Hydroxy-4-(4-(hydroxydiphenylmethyl)piperidin-1-yl)butyl)phenyl)-2-methylpropanoic acid hydr, 2-(4-(1-HYDROXY-4-[4-(HYDROXY-DIPHENYL-METHYL)-PIPERIDIN-1-YL]-BUTYL)-PHENYL)-2-METHYL-PROPIONIC ACID HYDROCHLORIDE, 2-(4-{1-Hydroxy-4-[4-(hydroxy-diphenyl-methyl)-piperidin-1-yl]-butyl}-phenyl)-2-methyl-propionic acid; hydrochloride, 2-[4-[1-hydroxy-4-[4-[hydroxy(diphenyl)methyl]piperidin-1-yl]butyl]phenyl]-2-methylpropanoic acid hydrochloride, 2-[4-[1-hydroxy-4-[4-[hydroxy(diphenyl)methyl]piperidin-1-yl]butyl]phenyl]-2-methylpropanoic acid;hydrochloride, 4-[(4-(hydroxydiphenylmethyl)-1-piperidinyl]-1-hydroxybutyl]-alpha,alpha-dimethylbenzeneacetic acid hydrochloride, 4-[1-HYDROXY-4-[4-(HYDROXYDIPHENYLMETHYL)-1-PIPERIDINYL]BUTYL]-ALPHA,ALPHA-DIMETHYL-BENZENEACETIC ACID, HYDROCHLORIDE (1:1), 4-[4-[4-(Hydroxydiphenylmethyl)-1-pieridinyl]-1-hydroxybutyl]-alpha,alpha-dimethylbenzeneacetic acid hydrochloride, 4-[4-[4-(hydroxydiphenylmethyl)-1-piperidinyl]-1-hydroxybutyl]-alpha,alpha-dimethylbenzeneacetic acid hydrochloride, Benzeneacetic acid, 4-(1-hydroxy-4-(4-(hydroxydiphenylmethyl)-1-piperidinyl)butyl)-alpha,alpha-dimethyl-, hydrochloride, Benzeneacetic acid, 4-(1-hydroxy-4-(4-(hydroxydiphenylmethyl)-1-piperidinyl)butyl)-alpha,alpha-dimethyl-, hydrochloride, (+-)-, MolPort-000-846-065, MCULE-5306097997, AKOS015896119, AKOS015896444, A807389, I06-1628, I06-1869, hydron; 2-[4-[1-hydroxy-4-[4-[hydroxy(diphenyl)methyl]-1-piperidinyl]butyl]phenyl]-2-methylpropanoic acid; chloride, hydron; 2-methyl-2-[4-[1-oxidanyl-4-[4-[oxidanyl(diphenyl)methyl]piperidin-1-yl]butyl]phenyl]propanoic acid; chloride


ID: 2005

chemical graph of compound 2005



InChIKey: RRJLJKRFFRZRAF-UHFFFAOYSA-N
SMILES: COC1=C(C=C2C(=C1)CCN2C(=O)NC3=CC(=CC(=C3)C4=CN=CC=C4)F)C(F)(F)F

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 443390
synonyms found at PubChem are:
SB 228357, 181629-93-6, SB-228357, UNII-5RDN2E8E97, SB228357, Tocris-1375, CHEMBL14276, 5RDN2E8E97, CHEBI:8979, N-[3-FLUORO-5-(3-PYRINDYL)PHENYL]-2,3-DIHYDRO-5-METHOXY-6-(TRIFLUOROMETHYL)-1H-INDOLE-1-CARBOXAMIDE, N-[3-Fluoro-5-(3-pyridinyl)phenyl]-5-methoxy-6-(trifluoromethyl)-1-indolinecarboxamide, N-(3-fluoro-5-pyridin-3-ylphenyl)-5-methoxy-6-(trifluoromethyl)-2,3-dihydroindole-1-carboxamide, N-[3-Fluoro-5-(3-pyridinyl)phenyl]-2,3-dihydro-5-methoxy-6-(trifluoromethyl)-1H-indole-1-carboxamide, SR-01000075936, AC1L9EKQ, Lopac-S-2318, J1.060.588A, D05NWH, GTPL192, SCHEMBL7042732, DTXSID9042621, MolPort-019-993-258, RRJLJKRFFRZRAF-UHFFFAOYSA-N, HMS3267B20, ZINC601841, BDBM50086056, AKOS024456558, CCG-204709, VI30417, N-(3-(3-Pyridinyl)-5-fluorophenyl)-5-methoxy-6-(trifluoromethyl)indoline-1-carboxamide, NCGC00015935-01, NCGC00015935-02, NCGC00015935-03, NCGC00015935-04, NCGC00015935-05, NCGC00015935-07, NCGC00025130-01, NCGC00025130-02, NCGC00025130-03, 1H-Indole-1-carboxamide, N-(3-fluoro-5-(3-pyridinyl)phenyl)-2,3-dihydro-5-methoxy-6-(trifluoromethyl)-, ZB014559, KB-300794, B6709, EU-0100620, FT-0643749, C11742, S 2318, A812626, C-22250, L001214, J-011603, SR-01000075936-1, SR-01000075936-3, BRD-K15424032-001-01-0, N-(3-Fluoro-5-(pyridin-3-yl)phenyl)-5-methoxy-6-(trifluoromethyl)indoline-1-carboxamide, N-[3-fluoro-5-(3-pyridyl)phenyl]-5-methoxy-6-(trifluoromethyl)indoline-1-carboxamide, 1H-Indole-1-carboxamide,N-[3-fluoro-5-(3-pyridinyl)phenyl]-2,3-dihydro-5-methoxy-6-(trifluoromethyl)-, 5-Methoxy-6-trifluoromethyl-2,3-dihydro-indole-1-carboxylic acid (3-fluoro-5-pyridin-3-yl-phenyl)-amide, N-(3-fluoranyl-5-pyridin-3-yl-phenyl)-5-methoxy-6-(trifluoromethyl)-2,3-dihydroindole-1-carboxamide, N-(3-fluoro-5-pyridin-3-ylphenyl)-5-methoxy-6-(trifluoromethyl)-2,3-dihydro-1H-indole-1-carboxamide, N-[3-fluoro-5-(3-pyridinyl)phenyl]-5-methoxy-6-(trifluoromethyl)-2,3-dihydroindole-1-carboxamide, N-[3-Fluoro-5-(3-pyridyl)phenyl]-2,3-dihydro-5-methoxy-6(trifluoromethyl)-1H-indole-1-carboxamide


ID: 2006

chemical graph of compound 2006



InChIKey: RRNSPXUFTKJIEZ-UHFFFAOYSA-N
SMILES: C1=CC(=CC(=C1)F)C2=C(N=CS2)C(=O)NCCN.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5311308
synonyms found at PubChem are:
Ro 41-1049 hydrochloride, UNII-19Z49HUF4G, RO-41-1049 hydrochloride, Ro 41-1049 (hydrochloride), N-(2-Aminoethyl)-5-(3-fluorophenyl)-4-thiazolecarboxamide hydrochloride, 19Z49HUF4G, 127917-66-2, AC1NSKEH, MLS000860021, SCHEMBL1665880, CHEMBL1256290, IN1987, AKOS030526380, CS-5591, HY-100027A, LP01113, Ro-411049, 4-Thiazolecarboxamide, N-(2-aminoethyl)-5-(3-fluorophenyl)-, hydrochloride (1:1), NCGC00094383-01, SMR000326879, RT-015422, EU-0101113, R-107, SR-01000075635, J-005497, SR-01000075635-2, N-(2-aminoethyl)-5-(3-fluorophenyl)thiazole-4-carboxamide hydrochloride, N-(2-aminoethyl)-5-(m-fluorophenyl)-4-thiazole carboxamide hydrochloride, N-(2-aminoethyl)-5-(3-fluorophenyl)-1,3-thiazole-4-carboxamide hydrochloride


ID: 2007

chemical graph of compound 2007



InChIKey: RRUDCFGSUDOHDG-UHFFFAOYSA-N
SMILES: CC(=O)NO

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 1990
synonyms found at PubChem are:
acetohydroxamic acid, N-Hydroxyacetamide, 546-88-3, Methylhydroxamic acid, Acetylhydroxamic acid, Acetic acid, oxime, Acetohydroximic acid, Lithostat, N-Acetylhydroxylamine, Acetamide, N-hydroxy-, Acethydroxamsaure, Acethydroxamsaeure, cetohyroxamic acid, Acethydroxamic acid, Acetohydroxamate, N-Acetyl hydroxyacetamide, AHA, Hydroxylamine, N-acetyl-, Acido acetohidroxamico, Acide acetohydroxamique, Acidum acetohydroxamicum, Acetyl hydroxyamino, Acethydroxamsaeure [German], Acide acetohydroxamique [French], Acido acetohidroxamico [Spanish], Acidum acetohydroxamicum [Latin], ACETOHYDROXAMICACID, acetic acid oxime, Lithostat (TN), UNII-4RZ82L2GY5, ethanehydroxamic acid, NSC 176136, CCRIS 1730, HSDB 3585, Acetohydroxamic acid [USAN:INN], N-hydroxyacetimidic acid, N-hydroxyethanimidic acid, EINECS 208-913-8, AI3-62232, 4RZ82L2GY5, Acetohydroxamic acid (USP/INN), CHEBI:27777, RRUDCFGSUDOHDG-UHFFFAOYSA-N, NCGC00094576-01, DSSTox_CID_2546, WLN: QMV1, DSSTox_RID_76622, DSSTox_GSID_22546, S14-0751, CAS-546-88-3, acetohydroxamsaure, Acetic acid|oxime, N-Oxylatoacetamide, acethydroximic acid, Acetohyroxamic acid, Acetyl hydroxyamine, Prestwick_38, n-hydroxy-acetamide, N-oxidanylethanamide, acetohydroxarnic acid, SJX HLdmMAH, sJX`HLdmMAH`, zlchem 200, Acetohydroxamic acid [USAN:USP:INN], methyl hydroximic acid, Spectrum_000020, ACMC-1AWJW, ACETYLHYDROXYLAMINE, AC1L1COH, Spectrum2_000109, Spectrum3_000285, Spectrum4_000138, Spectrum5_000812, CH3C(O)NHOH, CHEMBL734, D0R9BG, AC1Q1L7G, Acetohydroxamic acid, 98%, AHA (TN), BSPBio_001790, KBioGR_000556, KBioSS_000360, KSC269I4N, MLS001076662, Acetamide, N-hydroxy-(9CI), DivK1c_000821, SPECTRUM1500103, SPBio_000098, Acetamide, N-hydroxy- (9CI), DTXSID7022546, Acetohydroxamic acid, 98% 1g, CHEBI:49029, CTK1G9446, CTK8A6224, HMS502J03, KBio1_000821, KBio2_000360, KBio2_002928, KBio2_005496, KBio3_001290, KS-00000UQU, NSC5073, ZLC0003, MolPort-001-769-610, MolPort-028-751-555, NINDS_000821, ACETOHYDROXAMIC ACID (AHA), HMS1920A07, HMS2091G07, HMS2231M17, Pharmakon1600-01500103, ACN-S002461, ACT05768, HY-B1235, NSC-5073, ZINC4658603, Tox21_111301, ANW-32160, BDBM50099857, CA0112, CCG-38927, MFCD00009994, NSC176136, NSC755855, s4602, AKOS000172340, AKOS025395628, Tox21_111301_1, AB01014, CS-4881, DB00551, EBD2201963, MCULE-2682231025, NSC-176136, NSC-755855, RTR-019336, IDI1_000821, NCGC00094576-02, NCGC00094576-03, NCGC00094576-05, AJ-51852, AN-21371, BP-13320, BR-43984, CJ-12199, KB-47074, LS-13067, SC-18498, SMR000499570, SBI-0051270.P003, AB0010594, DB-052632, TR-019336, A0051, AM20100343, FT-0621796, ST24033130, EN300-36948, 46A883, C06808, D00220, M-3701, AB00051907_07, A830321, SR-01000763642, I08-0057, SR-01000763642-2, W-105609, Acetohydroxamic acid, United States Pharmacopeia (USP) Reference Standard


ID: 2008

chemical graph of compound 2008



InChIKey: RSDDHGSKLOSQFK-RVDMUPIBSA-N
SMILES: CC(=CCC/C(=C/COC1=CC2=C(C=C1)C=CC(=O)O2)/C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 1550607
synonyms found at PubChem are:
Auraptene, Aurapten, 7-Geranyloxycoumarin, 495-02-3, UNII-F79I1ZEL2E, F79I1ZEL2E, RSDDHGSKLOSQFK-RVDMUPIBSA-N, 7-[(2E)-3,7-dimethylocta-2,6-dienoxy]chromen-2-one, (E)-7-((3,7-Dimethylocta-2,6-dien-1-yl)oxy)-2H-chromen-2-one, 7-{[(2E)-3,7-dimethylocta-2,6-dien-1-yl]oxy}-2H-chromen-2-one, SR-01000758940, Feronialactone, 7-([(2E)-3,7-Dimethyl-2,6-octadienyl]oxy)-2H-chromen-2-one, 7-{[(2E)-3,7-dimethyl-2,6-octadienyl]oxy}-2H-chromen-2-one, CCRIS 8835, 2H-1-Benzopyran-2-one, 7-((3,7-dimethyl-2,6-octadienyl)oxy)-, (E)-, 2H-1-Benzopyran-2-one, 7-[(3,7-dimethyl-2,6-octadienyl)oxy]-, (E)-, 7-O-geranylumbelliferone, AC1LT3MK, UPCMLD-DP061, Coumarin, 7-(geranyloxy)-, MLS001049098, SPECTRUM1505176, CHEMBL307341, MEGxp0_000091, SCHEMBL2535029, SCHEMBL2535034, 7-[[(2E)-3,7-dimethyl-2,6-octadien-1-yl]oxy]-2H-1-benzopyran-2-one, Auraptene, >=98% (HPLC), UPCMLD-DP061:001, ACon1_000071, CHEBI:93486, CHEBI:134355, MolPort-001-740-270, HMS2270C13, NP344, 29527-66-0, BCP23751, ZINC1658901, BDBM50361373, NSC711511, STL457597, AKOS015969736, CCG-208550, MCULE-3823939164, NSC-711511, NCGC00096070-01, NCGC00096070-03, NCGC00096070-04, NCGC00096070-05, NCGC00168822-01, 4CN-1163, CJ-26819, SMR000386931, W1305, SR-01000758940-3, SR-01000758940-4, 7-(3,7-Dimethyl-octa-2,6-dienyloxy)-chromen-2-one, 7-[(3,7-Dimethyl-2,6-octadienyl)oxy]-(E)-Coumarin, BRD-K85013741-001-05-9, Coumarin, 7-[(3,7-dimethyl-2,6-octadienyl)oxy]-, (E)-, (E)-7-(3,7-dimethylocta-2,6-dienyloxy)-2H-chromen-2-one, 7-([(2E)-3,7-Dimethyl-2,6-octadienyl]oxy)-2H-chromen-2-one #, 7-(3,7-Dimethyl-2,6-octadienyl)oxy-2H-1-benzopyran-2-one, 9CI, 2H-1-Benzopyran-2-one, 7-[[(2E)-3,7-dimethyl-2,6-octadien-1-yl]oxy]-, 2H-1-Benzopyran-2-one,7-[[(2E)-3,7-dimethyl-2,6-octadien-1-yl]oxy]-, 7-{[(2E)-3,7-dimethylocta-2,6-dien-1-yl]oxy}-2H-1-benzopyran-2-one, NCGC00096070-07!7-[(2E)-3,7-dimethylocta-2,6-dienoxy]chromen-2-one


ID: 2009

chemical graph of compound 2009



InChIKey: RSEPBGGWRJCQGY-RBRWEJTLSA-N
SMILES: CCCCC(=O)O[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=C3C=CC(=C4)O)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 13791
synonyms found at PubChem are:
estradiol valerate, 979-32-8, Delestrogen, Estraval, Neofollin, Progynova, Femogex, Progynon-Depot, Estradiol 17-valerate, Oestradiol valerate, Atladiol, Climaval, Deladiol, Duratrad, Pharlon, Estate, Dura-estradiol, Exten strone, Depo estro med, Repo-Estra, Delestrogen 4X, Estraval PA, Estraval 2X, Estroval-10, Delahormone unimatic, Estradiol valerianate, Depo-Estro-Med, Femogen-L.A., Cyclocur, Gynokadin, Merimono, Nuvelle, Pelanin, Postoval, Primogyna, Ronfase, Estradiol Depot, Primogyn-Depot, Gynogen L.A. 20, Gynogen L.A. 40, Gynogen L.A. 10, Valergen, ESTRADIOL, 17-VALERATE, Estradiol 17beta-valerate, Estradiol valerate (VAN), component of Ditate, UNII-OKG364O896, CCRIS 5571, Estradioli valeras [INN-Latin], Oestradiol-17b-valerate, Valerate d'estradiol [INN-French], EINECS 213-559-2, NSC 17590, Valerato de estradiol [INN-Spanish], component of Deluteval 2X, beta-Estradiol 17-valerate, 17-BETA-ESTRADIOL 17-VALERATE, Estradiol 17.beta.-valerate, component of Mal-O-Fem L.A, MLS000028449, CHEBI:31561, RSEPBGGWRJCQGY-RBRWEJTLSA-N, OKG364O896, NSC-17590, 3-Hydroxy-17beta-valeroyloxyestra-1,3,5(10)-triene, SMR000058346, ST075188, [(8R,9S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] pentanoate, 17-pentanoyl-estra-1,3,5(10)-triene-3,17beta-diol, Estra-1,3,5(10)-triene-3,17-diol (17-beta)-, 17-pentanoate, Estra-1,3,5(10)-triene-3,17-diol(17beta)-, 17-pentanoate, Estradioli valeras, estradiol-17-valerate, (1S,11S,14S,15S,10R)-5-hydroxy-15-methyltetracyclo[8.7.0.0<2,7>.0<11,15>]hepta deca-2,4,6-trien-14-yl pentanoate, Valerate d'estradiol, Valerato de estradiol, Pelanin depot, Gynogen LA, Deladumone (TN), Femogen-L.A, NCGC00094673-01, CPD000058346, Estradiol valerate [USAN:INN:JAN], Gynogen L.A.10, Estradiol valerate [USP:INN:BAN:JAN], Opera_ID_444, Estradiol 17?-valerate, B-Estradiol 17-valerate, DSSTox_CID_3004, AC1L22HN, CHEMBL1511, DSSTox_RID_76827, DSSTox_GSID_23004, SCHEMBL40563, MLS001146931, ARONIS24416, 17|A-Estradiol-17-valerate, GTPL7655, DTXSID8023004, BBC/580, MolPort-002-507-065, HMS2232L17, HMS3259C12, HMS3715B21, (8R,9S,13S,14S,17S)-3-hydroxy-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-17-yl pentanoate, BCP11918, EBD28143, Estradiol valerate (JAN/USP/INN), HY-B0672, NSC17590, ZINC3881556, Tox21_111312, Estra-1,3,5(10)-triene-3,17-diol (17.beta.)-, 17-pentanoate, LMST02010039, MFCD00056541, s3149, SBB080821, AKOS005267158, API0002610, CCG-221130, CS-2904, KS-5213, MCULE-6732064308, NC00560, beta-Estradiol 17-valerate, 98% 1g, CAS-979-32-8, LS-64737, AB0106305, B1506, E0876, ST24046695, C12859, D01413, AB00382980_15, 124683-EP2295426A1, 124683-EP2295427A1, 979E328, A845765, SR-01000003061, Q-201506, SR-01000003061-3, 1,3,5(10)-Estratriene-3,17beta-diol 17-pentanote, BRD-K66766661-001-19-2, pentanoate d'estra-1,3,5(10)-tri ne-3-ol-17|A-yle, (17.beta.)-Estra-1,3,5(10)-triene-3,17-diol 17-valerate, (17beta)-3-hydroxyestra-1(10),2,4-trien-17-yl pentanoate, Estra-1,5(10)-triene-3,17-diol (17.beta.)-, 17-pentanoate, Estradiol-17-valerate; 1,3,5(10)-Estratriene-3,17b-diol 17-pentanote, (1S,11S,14S,15S,10R)-5-hydroxy-15-methyltetracyclo[8.7.0.0<2,7>.0<11,15>]hepta deca-2(7),3,5-trien-14-yl pentanoate, [(8R,9S,13S,14S,17S)-13-methyl-3-oxidanyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] pentanoate, 69557-95-5, 907-12-0, pentanoic acid [(8R,9S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] ester


ID: 2010

chemical graph of compound 2010



InChIKey: RSLNRVYIRDVHLY-UHFFFAOYSA-N
SMILES: CC(C)(C)NCC(C1=CC=CC=C1Cl)O.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 41991
synonyms found at PubChem are:
Hokunalin, Brelomax sirup, Chlobamol hydrochloride, C 78, 1-(o-Chlorophenyl)-2-tert-butylamino ethanol hydrochloride, alpha-(tert-Butylamino)methyl-2-chlorobenzyl alcohol hydrochloride, o-Chloro-alpha-((tert-butylamino)methyl)benzylalcohol hydrochloride, Benzyl alcohol, alpha-((tert-butylamino)methyl)-o-chloro-, hydrochloride, Benzenemethanol, 2-chloro-alpha-(((1,1-dimethylethyl)amino)methyl)-, hydrochloride, BENZYL ALCOHOL, alpha-(tert-BUTYLAMINO)METHYL-2-CHLORO-, HYDROCHLORIDE, C12H18ClNO.HCl, AC1L26VM, AN-15532, LS-42737, tert-butyl-[2-(2-chlorophenyl)-2-hydroxyethyl]azanium chloride, tert-butyl-[2-(2-chlorophenyl)-2-hydroxy-ethyl]ammonium chloride, Tulobuterol hydrochloride, 56776-01-3, 2-(tert-butylamino)-1-(2-chlorophenyl)ethanol hydrochloride, Tulobuterol HCl, Berachin, Lobuterol, 2-tert-Butylamino-1-(2-chlorophenyl)ethanol hydrochloride, C-78, CHEBI:32272, NCGC00094412-02, Hokunalin (TN), DSSTox_CID_25805, DSSTox_RID_81143, DSSTox_GSID_45805, alpha-((tert-Butylamino)methyl)-o-chlorobenzyl alcohol hydrochloride, CAS-56776-01-3, HN-078, SR-01000076165, 2-(tert-butylamino)-1-(2-chlorophenyl)ethanol;hydrochloride, Tulobuterol hydrochloride [JAN], ALPHA-[(TERT-BUTYLAMINO)METHYL]-O-CHLOROBENZYL ALCOHOL HYDROCHLORIDE, Tulobuterol, HCl, Respacal (TN), AC1NWAYM, PubChem13280, SCHEMBL123786, SPECTRUM1503954, Tulobuterol Hydrochloride,(S), CHEMBL1256478, DTXSID3045805, CTK8B4317, MolPort-003-981-175, Tulobuterol hydrochloride (JP17), HMS1922O06, Pharmakon1600-01503954, 41570-61-0 (Parent), BCP04486, KS-00000H8V, Tox21_111277, Tox21_501149, ANW-44683, CCG-39067, MFCD00214398, NSC758643, AKOS015894947, Tox21_111277_1, AB04864, API0004541, CS-W012449, HY-W011733, KS-5185, LP01149, MCULE-1663996986, NSC-758643, NCGC00016034-05, NCGC00094412-01, NCGC00094412-03, NCGC00094412-04, NCGC00261834-01, AK-54933, SC-26623, AX8156060, KB-224631, TR-019893, 4CH-007757, EU-0101149, FT-0630693, ST24027671, ST51015148, C12798, D01362, J10478, T 6050, 776T013, I06-038, I06-0038, SR-01000076165-1, SR-01000076165-5, 2-[(tert-butyl)amino]-1-(2-chlorophenyl)ethan-1-ol, chloride, Tulobuterol hydrochloride, VETRANAL(TM), analytical standard, 99798-69-3


ID: 2011

chemical graph of compound 2011



InChIKey: RSNLDCUXHLFIRF-UHFFFAOYSA-N
SMILES: CC(=O)C1=C(C=CC=C1OCC2=CC=C(C=C2)OC)OC

biological descriptors:

CFTR relevance: inactive

Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown

reference list:

"MH Nantz" "LJ Galietta" "K By" "EJ Niedzinski" "M Eda" "MF Springsteel" "MJ Haddadin" "MJ Kurth" "AS Verkman"


CID is 56973356
synonyms found at PubChem are:
1234015-61-2, 2'-Methoxy-6'-(4-methoxybenzyloxy)acetophenone, 1-(2-Methoxy-6-((4-methoxybenzyl)oxy)phenyl)ethanone, 1-(2-methoxy-6-(4-methoxybenzyloxy)phenyl)ethanone, 1-[2-Methoxy-6-(4-methoxybenzyloxy)phenyl]ethanone, SCHEMBL1971024, CTK8E1755, MolPort-023-222-619, RSNLDCUXHLFIRF-UHFFFAOYSA-N, CS-M3292, 4472AA, QC-106, ZINC72319662, AKOS016000420, ACN-001419, TRA0035849, KS-00000C51, CS-11434, SY020915, TZ001155, AB0059517, AJ-120990, AX8244245, KB-213201, TC-307120, FT-0686240, Z-4594, 2/'-Methoxy-6/'-(4-methoxybenzyloxy)acetophenone, 1-{2-methoxy-6-[(4-methoxyphenyl)methoxy]phenyl}ethanone


ID: 2012

chemical graph of compound 2012



InChIKey: RSRFPGRMZHUKON-UHFFFAOYSA-N
SMILES: CC1=C(C=C2C(=C1)C(=NC(=N2)NC3=NC(=O)C(=C(N3)C)C)C)C

biological descriptors:

CFTR relevance: CFTR corrector

Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown

reference list:

"GL Lukacs" "N Pedemonte" "O Zegarra-Moran" "LJ Galietta" "K Du" "AS Verkman" "E Caci"


CID is 695250
synonyms found at PubChem are:
AC1LEZVW, Oprea1_293092, Oprea1_437607, SCHEMBL838117, ZINC69303, MolPort-000-738-821, STK096804, AKOS000622026, MCULE-8185619622, BAS 01306736, EU-0073379, SR-01000450181, SR-01000450181-1, A2237/0094179, 5,6-Dimethyl-2-(4,6,7-trimethyl-quinazolin-2-ylamino)-1H-pyrimidin-4-one, 5,6-dimethyl-2-[(4,6,7-trimethyl-2-quinazolinyl)amino]-4(1H)-pyrimidinone, 5,6-dimethyl-2-[(4,6,7-trimethylquinazolin-2-yl)amino]-1H-pyrimidin-4-one, 5,6-dimethyl-2-[(4,6,7-trimethylquinazolin-2-yl)amino]pyrimidin-4(1H)-one


ID: 2013

chemical graph of compound 2013



InChIKey: RSRUDTPYRBLHEO-UHFFFAOYSA-N
SMILES: CN1CCC2=C(CC1)C(=CC=C2)Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 123981
synonyms found at PubChem are:
benalfocin, Skf 86466, SK&F-86466, 73943-10-9, SK&F 86466, UNII-YCN2U5UGIQ, 6-chloro-3-methyl-2,3,4,5-tetrahydro-1h-3-benzazepine, YCN2U5UGIQ, SKF-86466, 6-Chloro-2,3,4,5-tetrahydro-3-methyl-1H-3-benzazepine, CHEBI:8986, CHEMBL123349, 1H-3-Benzazepine, 6-chloro-2,3,4,5-tetrahydro-3-methyl-, SK-86466, 7713-86-2, 6-chloro-3-methyl-1,2,4,5-tetrahydro-3-benzazepine, MLS002172470, SMR001254100, Lopac-S-1563, D06UBB, AC1L3XO4, Lopac0_001056, AC1Q3P63, SCHEMBL8083358, BDBM66983, CTK8D9445, DTXSID70224650, cid_10220250, RSRUDTPYRBLHEO-UHFFFAOYSA-N, ZINC900633, PDSP1_000725, PDSP2_000715, AKOS030558322, CCG-205133, MB01559, NCGC00015930-01, NCGC00015930-02, NCGC00015930-03, NCGC00162330-01, KB-293371, LS-186796, LS-187466, C10970, 6-chloro-N-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine, 6-CHLORO-3-METHYL-2,3,4,5-TETRAHYDRO-BENZO[D]AZEPINE, 6-chloro-3-methyl-1,2,4,5-tetrahydro-3-benzazepine;hydrochloride, 6-chloranyl-3-methyl-1,2,4,5-tetrahydro-3-benzazepine;hydrochloride


ID: 2014

chemical graph of compound 2014



InChIKey: RSYUFYQTACJFML-UKRRQHHQSA-N
SMILES: C1[C@H]([C@H](OC2=CC(=CC(=C21)O)O)C3=CC=C(C=C3)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 443639
synonyms found at PubChem are:
(-)-Epiafzelechin, epiafzelechin, epi-Afzelechin, 24808-04-6, EPIAFZELECHIN (2R,3R)(-), CHEMBL159303, CHEBI:31028, (2R,3R)-2-(4-hydroxyphenyl)chromane-3,5,7-triol, 2,3-cis-epiafzelechin, (2R,3R)-epiafzelechin, AC1L9EYB, Spectrum2_001755, Spectrum3_001685, BSPBio_003210, SPECTRUM202178, SCHEMBL557061, SPBio_001890, KBio3_002430, MolPort-003-665-792, ZINC1721694, BDBM50240892, CCG-38806, LMPK12020036, AKOS032948425, SDCCGMLS-0066933.P001, NCGC00178206-01, 2-(4-hydroxyphenyl)chromane-3,5,7-triol, W1558, C12128, SR-05000002523, SR-05000002523-1, BRD-K90607708-001-02-9, BRD-K90607708-001-03-7, (2R,3R)-2-(4-Hydroxy-phenyl)-chroman-3,5,7-triol, (2R,3R)-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol, 2H-1-Benzopyran-3,5,7-triol,3,4-dihydro-2-(4-hydroxyphenyl)-, (2R,3R)-


ID: 2015

chemical graph of compound 2015



InChIKey: RTIXKCRFFJGDFG-UHFFFAOYSA-N
SMILES: C1=CC=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5281607
synonyms found at PubChem are:
chrysin, 480-40-0, 5,7-Dihydroxyflavone, Chrysine, 5,7-Dihydroxy-2-phenyl-4H-chromen-4-one, Crysin, 5,7-dihydroxy-2-phenylchromen-4-one, 4H-1-Benzopyran-4-one, 5,7-dihydroxy-2-phenyl-, UNII-3CN01F5ZJ5, NSC-407436, FLAVONE, 5,7-DIHYDROXY-, EINECS 207-549-7, NSC407436, 5,7-Dihydroxy-2-phenyl-4H-1-benzopyran-4-one, CHEMBL117, NSC 407436, 5,7-Dihydroxy-2-phenyl-chromen-4-one, BRN 0233276, 3CN01F5ZJ5, CHEBI:75095, RTIXKCRFFJGDFG-UHFFFAOYSA-N, 5,7-Dihydroxy-2-phenyl-4H-benzo(b)pyran-4-one, CAS-480-40-0, 5,7-dihydroxy-2-phenyl-4H-benzo[b]pyran-4-one, SMR000112318, SR-01000765660, Chrysinic acid, 3ebo, 4des, 57D, Chrysin,(S), 5,7-diOH-Flavone, PubChem9839, Flavone,7-dihydroxy-, Chrysin, 97%, AC1NQYPV, Ois 3, Spectrum_000245, Prestwick0_000889, Prestwick1_000889, Prestwick2_000889, Prestwick3_000889, Spectrum2_000753, Spectrum3_001399, Spectrum4_000780, Spectrum5_001503, DSSTox_CID_2396, D01UYI, Chrysin, analytical standard, DSSTox_RID_76571, DSSTox_GSID_22396, Oprea1_045160, SCHEMBL44474, BSPBio_000678, BSPBio_002514, BSPBio_003018, KBioGR_001200, KBioSS_000725, 5-18-04-00076 (Beilstein Handbook Reference), MLS000697728, MLS001074879, MLS006011841, BIDD:ER0484, DivK1c_000614, SPECTRUM1500709, SPECTRUM1505144, SPBio_000766, SPBio_002897, BDBM7461, BPBio1_000746, GTPL8789, MEGxp0_001416, DTXSID1022396, ACon1_000087, cid_5281607, CTK4J0553, HMS501O16, KBio1_000614, KBio2_000725, KBio2_003293, KBio2_005861, KBio3_002238, MolPort-001-742-013, NINDS_000614, HMS1570B20, HMS1921E20, HMS2097B20, HMS2268I23, HMS3468N08, HMS3655L20, 5,7-Dihydroxyflavone, 98% 5g, ALBB-015581, BCP22863, KS-00000HC3, ZINC3872070, Tox21_302335, ANW-43827, BBL010449, CC-079, CCG-40148, LMPK12110189, MFCD00006834, s2281, SBB012459, STK801609, AKOS000275936, BCP9000172, CS-7531, GS-0927, MCULE-7719714939, RTR-017608, SDCCGMLS-0066586.P001, IDI1_000614, SMP1_000070, NCGC00016456-01, NCGC00016456-02, NCGC00016456-03, NCGC00016456-04, NCGC00016456-05, NCGC00016456-06, NCGC00016456-07, NCGC00016456-08, NCGC00016456-09, NCGC00016456-10, NCGC00016456-12, NCGC00094842-01, NCGC00094842-02, NCGC00094842-03, NCGC00094842-04, NCGC00094842-05, NCGC00168807-01, NCGC00168807-02, NCGC00168807-03, NCGC00168807-04, NCGC00255307-01, AC-10052, AN-45183, BC200220, HY-14589, KB-76197, LS-68972, NCI60_003886, SC-04753, SC-57642, ST069324, 5,7-bis(oxidanyl)-2-phenyl-chromen-4-one, AB0006577, AB1003937, NP-005901, TR-017608, 5,7-dihydroxy-2-phenyl-1-benzopyran-4-one, AB00513947, C1652, FT-0082809, FT-0619846, FT-0686390, N1336, 5,7-Dihydroxy-2-phenyl-4H-chromen-4-one #, 4H-1-Benzopyran-4-one,7-dihydroxy-2-phenyl-, 80C400, A-8723, C10028, S00112, A827426, I06-0226, SR-01000765660-3, SR-01000765660-4, 34B3B4AD-EEDD-4943-A1C6-8857D2FAA8E0, 5,7-Dihydroxy-2-phenyl-4H-1-benzopyran-4-one, 9CI, BRD-K22861715-001-07-5, BRD-K22861715-001-12-5, 4H-1-Benzopyran-4-one, 5,7-dihydroxy-2-phenyl- (9CI), 4H-1,3-BENZODIOXIN-8-CARBONYL CHLORIDE,6-FLUORO-,M


ID: 2016

chemical graph of compound 2016



InChIKey: RTKIYNMVFMVABJ-UHFFFAOYSA-L
SMILES: CC[Hg]SC1=CC=CC=C1C(=O)[O-].[Na+]

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5908
synonyms found at PubChem are:
thimerosal, Thiomersal, Thiomersalate, Mercurothiolate, 54-64-8, Sodium merthiolate, Sodium ethylmercurithiosalicylate, MERTHIOLATE, Thimerosalate, Thimerosalum, Thimersalate, Thiomersalat, Thiomersalum, Thimerosol, Tiomersal, Ethylmercurithiosalicylate sodium, Ethylmercurithiosalicylic acid sodium salt, Elicide, Estivin, Merfamin, Merphol, Mertorgan, Merzonin, Nosemack, Tiomersale, Mercurothiolatum, Merzonin sodium, Aeroaid spray, Merthiolate salt, Merthiolate sodium, Vitaseptol Loesung, Merseptyl (VAN), Ethyl(2-mercaptobenzoato-S)mercury sodium salt, Elcide 73, Elcide 75, Tiomersale [DCIT], Caswell No. 766, o-(Ethylmercurithio)benzoic acid sodium salt, C9H9HgO2S.Na, Sodium ethylmercuric thiosalicylate, Tiomersal [INN-Spanish], Thiomersalum [INN-Latin], Sodium o-(ethylmercurithio)benzoate, Sodium 2-(ethylmercurithio)benzoate, Ethylmercurithiosalicylate sodium salt, UNII-2225PI3MOV, ((o-Carboxyphenyl)thio)ethylmercury sodium salt, Ethylmerkurithiosalicilan sodny, CCRIS 4839, HSDB 7151, NSC 4794, EINECS 200-210-4, [(o-Carboxyphenyl)thio]ethylmercury sodium salt, EPA Pesticide Chemical Code 078901, Ethylmerkurithiosalicilan sodny [Czech], Ethyl (sodium o-mercaptobenzoato)mercury, Ethylmercurithiosalicyclic acid, sodium salt, 2225PI3MOV, CHEBI:9546, Mercurate(1-), ethyl(2-mercaptobenzoato(2-)-O,S)-, sodium, Thiomersal (INN), Thiomersal [INN], Mercury, ethyl(2-mercaptobenzoate-S)-, sodium salt, Mercury, ethyl(2-mercaptobenzoato-S)-, sodium salt, Mercury, ((o-carboxyphenyl)thio)ethyl-, sodium salt, Mercurate(1-), ethyl(o-mercaptobenzoato(2-))-, sodium, NCGC00094791-01, Vitaseptol, Mercurate(1-), ethyl(2-mercaptobenzoate(2-)-O,S)-, sodium salt, DSSTox_CID_5540, Ethyl(2-mercaptobenzoato-S)mercury, sodium salt, Mercury-([o-carboxyphenyl]thio)ethyl sodium salt, DSSTox_RID_77823, DSSTox_GSID_25540, sodium (2-carboxylatophenyl)sulfanyl-ethyl-mercury, SET, Mercury, ethyl (2-mercaptobenzoato-S)-, sodium salt, MLS001336050, Mercurate(1-), ethyl(2-(mercapto-kappaS)benzoato(2-)-kappaO)-, sodium, CAS-54-64-8, (2-(Ethylmercuriomercapto)benzoic acid sodium salt, Thimerosal [USP:JAN], SMR000875330, Thimerosal [USAN:JAN], sodium;(2-carboxylatophenyl)sulfanyl-ethylmercury, Merthiolate (TN), Prestwick_1021, Thimerosal (JAN/USP), Epitope ID:119682, SCHEMBL3525, MLS001336049, SPECTRUM1500572, Thimerosal, EP/BP/USP grade, Thimerosal, analytical standard, DTXSID3025540, Thimerosal, >=97% (HPLC), HMS501O19, BIT0151, Thimerosal, >=95.0% (Hg), RTKIYNMVFMVABJ-UHFFFAOYSA-L, ZX-AFC000481, HMS1921E07, HMS2092M09, HMS2230I04, HMS3371N19, Thimerosal, BioXtra, 97-101%, Tox21_111331, Tox21_302176, 8171AF, CCG-39725, CT0192, GA6948, MFCD00013062, AKOS004910446, Tox21_111331_1, API0004391, DB11590, LS-1337, NCGC00094791-02, NCGC00164425-01, NCGC00178879-04, NCGC00255169-01, AN-41660, BP-30041, CC-34985, Ethylmercurithiosalicyclic acid sodium salt, FT-0603231, ST51015159, Thimerosal, meets USP testing specifications, sodium (2-carboxylatophenylthio)(ethyl)mercury, 2-(mercurapropylthio)benzoic acid, sodium salt, D00864, Mercury((o-carboxyphenyl)thio)ethyl sodium salt, sodium [(2-carboxylatophenyl)thio]-ethylmercury, T-3600, 2-(Ethylmercuriomercapto)benzoic acid sodium salt, A830286, C-21801, ((O-CARBOXYPHENYL)THIO) ETHYLMERCURY SODIUM SALT, sodium ethyl[2-(mercapto-kS)benzoato(2-)]mercurate(1-), Mercury, ethyl(hydrogen o-mercaptobenzoato)-, sodium salt, sodium [(2-carboxylatophenyl)sulfanyl](ethyl)mercurate(1-), Thimerosal, European Pharmacopoeia (EP) Reference Standard, sodium ethyl[2-(sulfanyl-kappaS)benzoato(2-)]mercurate(1-), Thimerosal, United States Pharmacopeia (USP) Reference Standard, Mercury, ethyl(hydrogen o-mercaptobenzoato)-, sodium salt (8CI), Thimerosal Ready Made Solution, 100 mg/mL in water, 0.2 mum filtered, Thimerosal, Pharmaceutical Secondary Standard; Certified Reference Material, Mercurate(1-), ethyl(2-(mercapto-kappaS)benzoato(2-)-kappaO)-, sodium (1:1), Mercurate(1-), ethyl[2-(mercapto-.kappa.S)benzoato(2-)-.kappa.O]-, sodium (1:1), 11004-81-2, 113170-85-7, 130995-49-2, 2141-27-7, 23065-35-2, 25948-50-9, 362653-08-5, 77536-61-9, 8030-32-8, 878791-13-0


ID: 2017

chemical graph of compound 2017



InChIKey: RTYBGDQNUBLFSW-XIJGOZNCSA-N
SMILES: C[C@]1(CCC[C@@H](C1)C(C)(C)NC(=O)CBr)NCC(COC2=CC=CC=C2CC=C)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 11957482
synonyms found at PubChem are:
Bromoacetyl alprenolol menthane, Lopac0_000215, CHEMBL1398096, HMS3260L11, Tox21_500215, CCG-204310, LP00215, NCGC00162095-02, NCGC00260900-01, EU-0100215, SR-01000075728, SR-01000075728-1


ID: 2018

chemical graph of compound 2018



InChIKey: RTYJTGSCYUUYAL-YCAHSCEMSA-L
SMILES: CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)C(C3=CC=CC=C3)C(=O)[O-])C(=O)[O-])C.[Na+].[Na+]

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 20933
synonyms found at PubChem are:
Carbenicillin disodium, 4800-94-6, carbenicillin sodium, Carbenicillin disodium salt, Carbecin, Sodium carbenicillin, Microcillin, Pyocianil, Hyoper, Geopen, Pyopen, Fugacillin, Gripenin, Pyoclox, Disodium carbenicillin, Piopen, Carbenicilline disodium, Anabactyl, BRL-2064, alpha-Carboxybenzylpenicillin disodium salt, Carboxybenzylpenicillin sodium, Carbenicillin (disodium), alpha-Carboxybenzylpenicillin sodium salt, GS 3159 disodium salt, Disodium alpha-carboxybenzylpenicillin, CP-15-639-2, BRL 2064, EINECS 225-360-8, NSC 111071, NSC-111071, CP 15639-2, CHEBI:34609, N-(2-Carboxy-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)-hept-6-yl)-2-phenylmalonamic acid disodium salt, Carbencillin Sodium, DSSTox_CID_25820, DSSTox_RID_81153, DSSTox_GSID_45820, 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-((carboxyphenylacetyl)amino)-3,3-dimethyl-7-oxo, disodium salt, (2S-(2alpha,5alpha,6beta))-, 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-((carboxyphenylacetyl)amino)-3,3-dimethyl-7-oxo, disodium salt, (6S-(2alpha,5alpha,6beta))-, Disodium (2S-(2alpha,5alpha,6beta))-6-(carboxylatophenylacetamido)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylate, Malonamic acid, N-(2-carboxy-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)hept-6-yl)-2-phenyl-, disodium salt, CAS-4800-94-6, alpha-Carboxybenzylpenicillin, C17H16N2Na2O6S, Carbenicillin disodium [USAN], Prestwick_29, NCGC00094607-01, Carbenicillin disodium [USAN:USP], Carbencillin disodium, Geopen (TN), disodium carbenicillin(2-), AC1L2HA6, Carbenicillin sodium (JAN), SCHEMBL54797, Carbenicillin disodium (USP), SPECTRUM1500160, CHEMBL606260, DTXSID6045820, HMS502E17, HY-B0525A, KS-00000XUO, 4697-36-3 (Parent), BIC0109, 4697-36-3 (non-salt), MolPort-002-508-836, ZX-AFC000678, HMS1920I19, HMS2091O21, Tox21_111304, CCG-38928, MFCD00077683, s3179, AKOS016001461, Tox21_111304_1, API0001846, CS-2746, 4800-94-6 (Carbenicillin Disodium), NCGC00022579-05, AK-49821, AS-11636, LS-88732, oEUEthCaA(1)EO paragraph signthornAAENI, AX8041718, FT-0602935, ST24046282, C13967, D02190, Carbenicillin disodium, meets USP testing specifications, Carbenicillin disodium salt, 89.0-100.5% anhydrous basis, Carbenicillin disodium salt, BioReagent, plant cell culture tested, Carbenicillin sodium, European Pharmacopoeia (EP) Reference Standard, disodium 6beta-(2-carboxylato-2-phenylacetamido)-2,2-dimethylpenam-3alpha-carboxylate, disodium (2S,5R,6R)-3,3-dimethyl-6-[(3-oxido-3-oxo-2-phenylpropanoyl)amino]-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate, disodium (2S,5R,6R)-6-{[carboxylato(phenyl)acetyl]amino}-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate, disodium;(2S,5R,6R)-6-[(2-carboxylato-2-phenylacetyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate, sodium (2S,5R,6R)-6-(2-carboxylato-2-phenylacetamido)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate, Carbenicillin, Disodium Salt, 6-[(Carboxyphenylacetyl)-amino]-3,3-dimethyl-7-oxo-4-thia-1-aza-bicyclo[3.2.0]heptane-2-carboxylic Acid, 2Na, AKOS025293506, Carbenicillin sodium salt, Antibiotic for Culture Media Use Only, (2S,5R,6R)-6-[(2-Carboxy-2-phenylacetyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid disodium salt


ID: 2019

chemical graph of compound 2019



InChIKey: RTYOLBQXFXYMKY-UHFFFAOYSA-N
SMILES: C1=CC=C(C(=C1)CN(CC2=CC=CC=C2O)C3=CC(=C(C=C3)O)C(=O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3895
synonyms found at PubChem are:
lavendustin b, 125697-91-8, UNII-7T53EGQ52Z, 7T53EGQ52Z, IN1273, Benzoic acid,5-[bis[(2-hydroxyphenyl)methyl]amino]-2-hydroxy-, 5-[bis(2-hydroxybenzyl)amino]-2-hydroxybenzoic acid, 5-(Bis((2-hydroxyphenyl)methyl)amino)-2-hydroxybenzoic acid, 5-(bis(2-hydroxybenzyl)amino)-2-hydroxybenzoic acid, 5-[bis[(2-hydroxyphenyl)methyl]amino]-2-hydroxybenzoic acid, 5-{bis[(2-hydroxyphenyl)methyl]amino}-2-hydroxybenzoic acid, ACMC-20c8gz, AC1L1GY8, AC1Q5V0Y, CHEMBL485258, SCHEMBL13228056, CTK4B4737, DTXSID40154854, MolPort-003-848-368, BCP20779, ZINC2504634, BDBM50025606, HSCI1_000118, AKOS030239802, CCG-208626, SMP2_000233, NCGC00163670-01, RT-013562, FT-0627735, 5-Amino-(N,N'-bis-2-hydroxybenzyl)salicylic acid, SR-05000002160, J-005264, SR-05000002160-2, BRD-K33781562-001-02-7, 5-[bis[(2-hydroxyphenyl)methyl]amino]-2-hydroxy-benzoic acid, Benzoic acid, 5-(bis((2-hydroxyphenyl)methyl)amino)-2-hydroxy-


ID: 2020

chemical graph of compound 2020



InChIKey: RUBSCPARMVJNKX-UHFFFAOYSA-N
SMILES: CC1=NN=C(C2=CC3=C(C=C2C1)OCO3)C4=CC=C(C=C4)N.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 10042240
synonyms found at PubChem are:
GYKI 52466 hydrochloride, 192065-56-8, 4-(8-Methyl-9H-[1,3]dioxolo[4',5':4,5]benzo[1,2-d][1,2]diazepin-5-yl)aniline hydrochloride, 1-(4-Aminophenyl)-4-methyl-7,8-methylenedioxy-5H-2,3-benzodiazepine hydrochloride, GYKI 52466 dihydrochloride, SR-01000075453, EU-0100631, GYKI52466 hydrochloride, MLS002153395, SCHEMBL249675, CHEMBL1370663, DTXSID70434691, GYKI 52466 hydrochloride, solid, Tox21_500631, MFCD00153803, AKOS015891418, CCG-221935, LP00631, NCGC00093998-01, NCGC00261316-01, KB-52320, SMR000326939, RT-013152, 4-(8-Methyl-9H-[1,3]dioxolo[4',5', FT-0714197, G-119, ST24042997, I01-9502, J-000783, SR-01000075453-1, SR-01000075453-3


ID: 2021

chemical graph of compound 2021



InChIKey: RUDATBOHQWOJDD-BSWAIDMHSA-N
SMILES: C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 10133
synonyms found at PubChem are:
chenodeoxycholic acid, Chenodiol, Chenix, Chenic acid, 474-25-9, Chenodeoxycholate, Chendol, Chenodesoxycholic acid, Gallodesoxycholic acid, Cdca, Anthropodeoxycholic acid, Chenofalk, Anthropodesoxycholic acid, Anthropododesoxycholic acid, Chenodesoxycholsaeure, Henohol, Xenbilox, Chenique Acid, Chenodiol [USAN], 3alpha,7alpha-Dihydroxy-5beta-cholan-24-oic acid, Sodium chenodeoxycholate, Acido chenodeoxicholico, Chenodesoxycholsaeure [German], Acide chenodeoxycholique, 7-alpha-Hydroxylithocholic acid, Acidum chenodeoxycholicum, Chenocholic acid, UNII-0GEI24LG0J, 3alpha,7alpha-Dihydroxy-5beta-cholanic acid, Acide chenodeoxycholique [INN-French], Acido chenodeoxicholico [INN-Spanish], Acidum chenodeoxycholicum [INN-Latin], Chendeoxycholic Acid, 3-alpha,7-alpha-Dihydroxycholanic acid, CCRIS 2195, EINECS 207-481-8, 3-alpha,7-alpha-Dihydroxycholansaeure [German], 3-alpha,7-alpha-Dihydroxycholansaeure, NSC 657949, 0GEI24LG0J, 3-alpha,7-alpha-Dihydroxy-5-beta-cholan-24-oic acid, 7alpha-hydroxylithocholic acid, CHEBI:16755, Cholan-24-oic acid, 3,7-dihydroxy-, (3alpha,5beta,7alpha)-, RUDATBOHQWOJDD-BSWAIDMHSA-N, Chenodiol (USAN), (4R)-4-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid, 5-beta-Cholan-24-oic acid, 3-alpha,7-alpha-dihydroxy-, (3alpha,5beta,7alpha,8xi)-3,7-dihydroxycholan-24-oic acid, DSSTox_CID_260, DSSTox_RID_75469, DSSTox_GSID_20260, Cholan-24-oic acid, 3,7-dihydroxy-, (3a,5b,7a)-, (3beta,7beta,8xi,9xi,14xi,17alpha)-3,7-dihydroxycholan-24-oic acid, Cholan-24-oic acid, 3,7-dihydroxy-, (3-alpha,5-beta,7-alpha)-, Cholan-24-oic acid, 3,7-dihydroxy-, (3-alpha,5-beta,7-alpha)- (9CI), 5beta-Cholanic acid-3alpha,7alpha-diol, (4R)-4-((1S,2S,7S,11S,5R,9R,10R,14R,15R)-5,9-dihydroxy-2,15-dimethyltetracyclo [8.7.0.0<2,7>.0<11,15>]heptadec-14-yl)pentanoic acid, (4R)-4-[(1S,2S,5R,7S,9R,10R,11S,14R,15R)-5,9-dihydroxy-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-14-yl]pentanoic acid, (R)-4-((3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid, 5 beta-Cholanic acid-3,7-diol, Chenocedon, Chendal, Chenocol, Chenodal, Chenodex, Chenorm, Chenossil, Cholanorm, Fluibil, Hekbilin, Kebilis, Cholan-24-oic acid, 3,7-dihydroxy-, (3.alpha.,5.beta.,7.alpha.)-, NSC657949, NCGC00016387-02, CAS-474-25-9, JN3, (+)-chenodeoxycholate, Prestwick0_000285, Prestwick1_000285, Prestwick2_000285, Prestwick3_000285, Spectrum5_002009, CHENIX (TN), (3|A,5|A,7|A)-3,7-Dihydroxycholan-24-oic Acid, (+)-chenodeoxycholic acid, bmse000908, D03ZTE, D0Y1RT, 7a-Hydroxy-desoxycholsaeure, EC 207-481-8, AC1L1UK8, BIDD:PXR0056, Chenodeoxycholic acid [INN], SCHEMBL25055, BSPBio_000190, GTPL608, MLS002154253, 3a,7a-dihydroxy-5b-cholanate, SPBio_002409, BPBio1_000210, CHEMBL240597, Chenodeoxycholic acid, >=97%, DTXSID2020260, 7.alpha.-Hydroxylithocholic acid, BDBM21674, MolPort-001-794-647, 3a,7a-dihydroxy-5b-cholanic acid, HMS1568J12, HMS2095J12, HMS2234I22, HMS3712J12, Chenodeoxycholic acid (JP16/INN), Chenodeoxycholic acid (JP17/INN), ZINC3914808, Tox21_110412, Tox21_200491, 3a,7a-dihydroxy-5b-cholan-24-oate, HSCI1_000210, LMST04010032, SBB002935, AKOS024280614, CCG-220285, CS-0834, DB06777, LS-7259, MCULE-3421183878, SMP1_000064, 3.alpha.,7.alpha.-Dihydroxycholansaeure, 3a,7a-dihydroxy-5b,14a,17b-cholanate, 3a,7a-dihydroxy-5b-cholan-24-oic acid, NCGC00142400-03, NCGC00142400-04, NCGC00258045-01, 3.alpha.,7.alpha.-Dihydroxycholanic acid, AN-23481, AS-13636, HY-76847, SMR000857194, ST033520, AB2000327, TR-017501, 3a,7a-dihydroxy-5b,14a,17b-cholanic acid, AB00513822, S1843, (3a,5b,7a)-3,7-dihydroxy-cholan-24-oate, 3alpha, 7alpha-dihydroxy-5beta-cholanoic acid, 3alpha, 7alpha,-dihydroxy-5beta-cholanic acid, C-2900, C02528, D00163, J10019, W-5059, (3a,5b,7a)-3,7-dihydroxy-cholan-24-oic acid, 25795-EP2289883A1, 25795-EP2295411A1, 25795-EP2315303A1, AB00513822-06, AB00513822_07, Chenodiol;Chenodesoxycholic acid;Chenocholic acid, 3.alpha.,7.alpha.-Dihydroxy-5.beta.-cholanic acid, Dihydroxy-3.alpha.,7.alpha.(5.beta.)Cholanic acid, 3.alpha.,7.alpha.-Dihydroxy-5.beta.-cholanoic acid, BRD-K18135438-001-16-7, 0DBBBC66-0CFA-4DB9-97F4-5B1492756A02, Z1270387252, 3.alpha.,7.alpha.-Dihydroxy-5.beta.-cholan-24-oic acid, UNII-JIY1ILR284 component RUDATBOHQWOJDD-BSWAIDMHSA-N, 5.beta.-Cholan-24-oic acid, 3.alpha.,7.alpha.-dihydroxy-, 3,7-Dihydroxycholan-24-oic acid, (3.alpha.,5.beta.,7.alpha.)- #, Chenodeoxycholic acid, 500 mug/mL in methanol, certified reference material, Chenodeoxycholic acid, European Pharmacopoeia (EP) Reference Standard, Cholan-24-oic acid, 3,7-dihydroxy-, (3-.alpha., 5-.beta., 7-.alpha.)-, (4R)-4-[(1S,2S,5R,7S,9R,10R,11S,14R,15R)-5,9-dihydroxy-2,15-dimethyltetracyclo[8.7.0.0(2),.0(1)(1),(1)]heptadecan-14-yl]pentanoic acid, (4R)-4-[(1S,2S,5R,7S,9R,10R,11S,14R,15R)-5,9-dihydroxy-2,15-dimethyltetracyclo[8.7.0.0?,?.0??,??]heptadecan-14-yl]pentanoic acid


ID: 2022

chemical graph of compound 2022



InChIKey: RUDATBOHQWOJDD-UZVSRGJWSA-N
SMILES: C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 31401
synonyms found at PubChem are:
URSODEOXYCHOLIC ACID, ursodiol, 128-13-2, Actigall, Ursofalk, Ursolvan, Delursan, ursodeoxycholate, UDCA, UrSO, Urso Forte, Ursodesoxycholic acid, Destolit, Ursochol, Cholit-ursan, Litursol, Solutrat, Ursobilin, Ursodamor, Arsacol, Deursil, Lyeton, Ursacol, Peptarom, Urso DS, 3alpha,7beta-Dihydroxy-5beta-cholan-24-oic acid, Ursosan, UDCS, Ursacholic Acid, Ursodexycholic Acid, Urso 250, Deoxyursocholic Acid, Acido ursodeoxicolico, Antigall, Urosiol, Acido ursodeossicolico, 3-alpha,7-beta-Dioxycholanic acid, Acide ursodesoxycholique, Acidum ursodeoxycholicum, 7-beta-Hydroxylithocholic acid, Ursocholic acid, deoxy-, 3-alpha,7-beta-Dihydroxycholanic acid, Acido ursodeossicolico [Italian], Ursodiol [USAN], Acido ursodeoxicolico [INN-Spanish], Acidum ursodeoxycholicum [INN-Latin], Acide ursodesoxycholique [INN-French], ISO-URSODEOXYCHOLIC ACID, NSC 683769, 3-alpha,7-beta-Dihydroxy-5-beta-cholanoic acid, Dom-ursodiol c, PHL-ursodiol c, PMS-ursodiol c, Ursodeoxycholicacid, (3alpha,5beta,7beta)-3,7-dihydroxycholan-24-oic acid, 7beta-Hydroxylithocholic acid, Actigall (TN), Ursodiol (USP), NSC 657950, UNII-724L30Y2QR, BRN 3219888, 3,7-Dihydroxycholan-24-oic acid, CCRIS 5502, Urso (TN), EINECS 204-879-3, CHEMBL1551, Ursodesoxycholic acid (UDCA), MLS000028461, CHEBI:9907, 5beta-Cholan-24-oic acid-3alpha,7beta-diol, RUDATBOHQWOJDD-UZVSRGJWSA-N, 17-beta-(1-Methyl-3-carboxypropyl)etiocholane-3-alpha,7-beta-diol, 724L30Y2QR, 3 alpha,7 beta-Dihydroxy-5 beta-cholan-24-oic Acid, (4R)-4-[(3R,5S,7S,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid, 5beta-Cholanic Acid-3alpha,7beta-diol, SMR000058403, Cholan-24-oic acid, 3,7-dihydroxy-, (3alpha,5beta,7beta)-, 3alpha,7beta-Dihydroxy-5beta-cholanic acid, U0030, U-9000, (R)-4-((3R,5S,7S,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid, IU5, Cholan-24-oic acid, 3,7-dihydroxy-, (3a,5b,7b)-, 5-beta-Cholan-24-oic acid, 3-alpha,7-beta-dihydroxy-, (3alpha,5beta,7beta,8xi)-3,7-dihydroxycholan-24-oic acid, Ursodeoxy cholic acid, (4R)-4-[(1S,2S,5R,7S,9S,10R,11S,14R,15R)-5,9-dihydroxy-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-14-yl]pentanoic acid, SR-01000737091, Ursodiol [USAN:USP], 7 beta-Hydroxylithocholic acid, ursocol, Ursodexycholate, Paptarom, Udiliv, Desol, Urdes, Urosdesoxycholate, Ursodesoxycholicacid, CPD000058403, Ursodeoxycholoc acid, Deursil (TN), Ursosan (TN), Urosdesoxycholic acid, Urso Forte (TN), 5 beta-Cholan-24-oic acid-3alpha,7 beta-diol, AC1L1LJH, Ursodiol (Actigal Urso), 3alpha,7 beta-Dihydroxy-5 beta-cholan-24-oic acid, Prestwick0_000958, Prestwick1_000958, Prestwick2_000958, Prestwick3_000958, 7 -Hydroxylithocholic acid, D0G3SH, EC 204-879-3, Ursodeoxycholic acid [INN], SCHEMBL27200, BSPBio_000956, 4-10-00-01604 (Beilstein Handbook Reference), 7bet.-Hydroxylithocholic acid, cid_31401, MLS001066373, MLS002548885, SPBio_003105, Ursodeoxycholic acid, >=99%, BPBio1_001052, GTPL7104, 7.beta.-Hydroxylithocholic acid, Ursodiol (Ursodeoxycholic Acid), DTXSID6023731, BDBM53721, Ursodeoxycholic acid, 99% 1g, AOB5075, MolPort-001-794-630, HMS1570P18, HMS2097P18, HMS2233L14, HMS3259A13, HMS3714P18, Ursodeoxycholic acid (JP15/INN), Ursodeoxycholic acid (JP17/INN), 3alpha,7beta-dihydroxycholanic acid, ACT02676, ZINC3914809, 3a,7b-dihydroxy-5b-cholan-24-oate, Cholan-24-oic acid, 3,7-dihydroxy-, (3.alpha.,5.beta.,7.beta.)-, LMST04010033, MFCD00003680, s1643, AKOS015955898, API0004557, CCG-220958, CS-1932, DB01586, KS-5243, MCULE-4374611501, NC00487, 5 -Cholan-24-oic acid-3 ,7 -diol, SMP2_000012, 3.alpha.,7.beta.-Dihydroxycholanic acid, 3a,7b-dihydroxy-5b-cholan-24-oic acid, NCGC00179363-01, AC-18919, CAS#128-13-2, CC-35557, HY-13771, LS-53033, NCI60_028904, 3 ,7 -Dihydroxy-5 -holan-24-oic acid, AB2000188, KB-276923, AB00513977, ST24050336, (3a,5b,7b)-3,7-dihydroxy-cholan-24-oate, 3alpha, 7beta-dihydroxy-5beta-cholanoic acid, 5bet.-Cholan-24-oic acid-3alp.,7bet.-diol, (3a,5b,7b)-3,7-dihydroxycholan-24-oic acid, A-7799, C07880, D00734, J10139, (3a,5b,7b)-3,7-dihydroxy-cholan-24-oic acid, AB00513977-09, AB00513977_10, 3alp.,7bet.-Dihydroxy-5bet.-cholan-24-oic acid, C-21580, 3.alpha.,7.beta.-Dihydroxy-5.beta.-cholanic acid, J-005566, J-650210, SR-01000737091-3, SR-01000737091-4, BRD-K15697815-001-16-2, 3.alpha.,7.beta.-Dihydroxy-5.beta.-cholan-24-oic acid, Z2786051717, 5.beta.-Cholan-24-oic acid, 3.alpha.,7.beta.-dihydroxy-, Ursodiol, United States Pharmacopeia (USP) Reference Standard, Cholan-24-oic acid, 3,7-dihydroxy-, (3-alpha,5-beta,7-beta)-, Ursodeoxycholic acid, British Pharmacopoeia (BP) Reference Standard, Ursodeoxycholic acid, European Pharmacopoeia (EP) Reference Standard, 17.beta.-(1-Methyl-3-carboxypropyl)etiocholane-3.alpha.,7.beta.-diol, 3,7-Dihydroxycholan-24-oic acid-, (3.alpha.,5.beta.,7.beta.)- #, Cholan-24-oic acid, 3,7-dihydroxy-, (3-alpha,5-beta,7-beta)- (9CI), Cholan-24-oic acid, 3,7-dihydroxy-, (3-alpha,5-beta,7-beta)-(9CI), Ursodeoxycholic acid, 500 mug/mL in methanol, certified reference material, Ursodiol, Pharmaceutical Secondary Standard; Certified Reference Material, Ursodeoxycholic acid for system suitability, European Pharmacopoeia (EP) Reference Standard, Ursodeoxycholic acid, UDCA, Ursosan, Ursofalk, Urso Forte, Udiliv, Ursodiol, (4R)-4-[(1S,2S,5R,7S,9S,10R,11S,14R,15R)-5,9-Dihydroxy-2,15-dimethyltetracyclo[8.7.0.02,1.011,1]heptadecan-14-yl]pentanoic acid, (4R)-4-[(3R,5S,7S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-3,7-bis(oxidanyl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid, (4R)-4-[(3R,5S,7S,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]valeric acid, 50809-41-1, 80225-86-1


ID: 2023

chemical graph of compound 2023



InChIKey: RUVINXPYWBROJD-ONEGZZNKSA-N
SMILES: C/C=C/C1=CC=C(C=C1)OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 637563
synonyms found at PubChem are:
ANETHOLE, trans-Anethole, 4180-23-8, 104-46-1, (E)-Anethole, 4-Propenylanisole, Anise camphor, Isoestragole, (E)-1-Methoxy-4-(prop-1-en-1-yl)benzene, Anethol, trans-Anethol, p-Anethole, Oil of aniseed, p-Propenylanisole, (E)-Anethol, Aniskampfer, Monasirup, trans-p-Propenylanisole, (E)-p-Propenylanisole, p-1-Propenylanisole, (E)-1-(4-Methoxyphenyl)propene, 1-Methoxy-4-(prop-1-en-1-yl)benzene, Nauli gum, trans-4-(1-Propenyl)anisole, trans-p-Anethole, (E)-1-Methoxy-4-(1-propenyl)benzene, 1-methoxy-4-[(1E)-prop-1-en-1-yl]benzene, trans-p-Methoxy-beta-methylstyrene, 1-Methoxy-4-(1-propenyl)benzene, cis-Anethol, Propene, 1-(p-methoxyphenyl)-, t-anethole, 1-methoxy-4-[(E)-prop-1-enyl]benzene, trans-Anethole (natural), UNII-Q3JEK5DO4K, Anethole, trans-, 1-Propene, 1-(4-methoxyphenyl)-, Propenylanisole, p-, (E)-, (E)-1-p-Methoxyphenylpropene, Anisole, p-propenyl-, Anisole, p-propenyl-, trans-, 1-Methoxy-4-propenylbenzene, FEMA No. 2086, trans-1-Methoxy-4-(1-propenyl)benzene, Anisole, p-propenyl-, (E)-, CCRIS 2481, 4-Methoxypropenylbenzene, Benzene, 1-methoxy-4-(1E)-1-propenyl-, 1-p-Methoxyphenylpropene, trans-, Benzene, 1-methoxy-4-(1-propenyl)-, (E)-, EINECS 224-052-0, Methoxy-beta-methylstyrene, trans-p-, Q3JEK5DO4K, 4-Methoxy-1-propenylbenzene, trans-1-(p-Methoxyphenyl)-1-propene, trans-1-(4-Methoxyphenyl)-1-propene, NSC 209529, p-Propenylphenyl methyl ether, BRN 0636190, 1-Methoxy-4-((1E)-1-propenyl)benzene, Benzene, 1-methoxy-4-(1-propenyl)-, 1-Methoxy-4-(1-propenyl)benzene, (E)-, trans-1-p-Anisylpropene, p-Methoxy-.beta.-methylstyrene, Acintene O, CHEBI:35616, NSC4018, Anethole (NF), Anethole [NF], Anethol (synthetic), Caswell No. 051B, p-Propenylmethoxybenzene, DSSTox_CID_87, FEMA Number 2086, NSC 4018, Methoxy-4-propenylbenzene, p-Methoxy-beta-methylstyrene, DSSTox_RID_75356, DSSTox_GSID_20087, 1-(methyloxy)-4-[(1E)-prop-1-en-1-yl]benzene, E-anethole, CCRIS 6211, HSDB 1427, trans-Anise camphor, Benzene, 1-methoxy-4-(propenyl)-, EINECS 203-205-5, Anethole, trans, 1-(4-Methoxyphenyl)-1(3)-propene, Nauli ''gum'', EPA Pesticide Chemical Code 015604, BRN 0774229, (E)-1-methoxy-4-(prop-1-enyl)benzene, p-(1-Propenyl)anisole, Anethole [USAN], 4-(1-propenyl)anisole, CAS-4180-23-8, AI3-00380, Benzene, 1-methoxy-4-(1-propen-1-yl)-, 1-(p-Methoxyphenyl)propene, SR-05000001866, 4-06-00-03796 (Beilstein Handbook Reference), CHEBI:2716, trans-1-(p-Methoxyphenyl)propene, isoestragol>, 1-Methoxy-4-[1-propenyl]benzene #, anethole-trithione, Anisole, trans-, p-propenylanisol>, Nauli 'gum', 50770-19-9, EINECS 256-753-2, AC1LCUHK, Benzene, 1-methoxy-4-(1E)-1-propen-1-yl-, trans-Anethole, 99%, para-methoxyphenylpropene', Spectrum5_000727, EC 224-052-0, ghl.PD_Mitscher_leg0.12, SCHEMBL48599, BSPBio_002818, trans-p-Methoxypropenylbenzene, 2-06-00-00523 (Beilstein Handbook Reference), SPECTRUM1503705, WLN: 2U1R DO1, Anethol, natural, 99%, FG, AC1Q56Q9, CHEMBL452630, Jsp000441, DTXSID9020087, WLN: 2U1R DO1 -T, MolPort-002-507-189, MolPort-004-288-385, RUVINXPYWBROJD-ONEGZZNKSA-N, HMS1922I20, HMS2089P20, HMS2093I09, Pharmakon1600-01503705, ZINC967630, trans-Anethole, analytical standard, HY-B0900, NSC-4018, Tox21_202282, Tox21_300132, BBL027751, CCG-38720, MFCD00009284, NSC209529, NSC758626, STK801277, trans-p-Methoxy-.beta.-methylstyrene, trans-Anethole, >=99%, FCC, FG, AKOS000121299, DS-2756, LS-2410, NE10646, NSC-209529, NSC-758626, RTR-030614, 1-((1E)prop-1-enyl)-4-methoxybenzene, methyl 4-(prop-1-en-1-yl)phenyl ether, NCGC00091493-02, NCGC00091493-03, NCGC00091493-04, NCGC00091493-05, NCGC00091493-06, NCGC00091493-07, NCGC00254015-01, NCGC00259831-01, AJ-24537, AN-18858, CJ-04629, KB-81234, SC-47202, ZB015469, SBI-0052758.P002, trans-Anethole, purum, >=98.0% (GC), KB-219117, ST2408089, TC-138812, TR-030614, trans''-1-methoxy-4-(prop-1-enyl)benzene, Benzene,1-Methoxy-4-(1-Propenyl)-,(E)-, P0494, ST50330583, X8716, Z4733, C10428, D02377, AB00053256-02, AB00053256_03, Q-201853, SR-05000001866-1, SR-05000001866-2, W-108812, BRD-K49060658-001-01-5, I14-111054, trans-Anethole, primary pharmaceutical reference standard, UNII-A79C64YD3Q component RUVINXPYWBROJD-ONEGZZNKSA-N, Anethole, United States Pharmacopeia (USP) Reference Standard, BENZENE,1-METHOXY,4-PROPENYL(TRANS) TRANS ANETHOL, InChI=1/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3-8H,1-2H3/b4-3, trans-Anethole, Pharmaceutical Secondary Standard; Certified Reference Material, 109957-71-3, 12002-40-3, 57131-42-7, 8022-08-0


ID: 2024

chemical graph of compound 2024



InChIKey: RVFUNJWWXKCWNS-UHFFFAOYSA-N
SMILES: CCN(CC)CCNC(=O)C1=CC(=C(C=C1OC)N)Cl.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 23659
synonyms found at PubChem are:
Metoclopramide hydrochloride, 7232-21-5, Maxolon, Metoclopramide monohydrochloride, METOCLOPRAMIDE HCL, Rimetin, Primperan (tablet), Cerucal, Paspertin, Metoclopramide Intensol, UNII-7B1QZY5SWZ, Metozolv, CCRIS 7142, EINECS 230-634-5, 7B1QZY5SWZ, NSC 354467, C14H22ClN3O2.HCl, AHR-3070-C, MLS000069667, 4-Amino-5-chloro-N-(2-(diethylamino)ethyl)-2-methoxybenzamide hydrochloride, Metoclopramide hydrochloride anhydrous, SMR000058471, 4-Amino-5-chloro-N-(2-(diethylamino)ethyl)-o-anisamide hydrochloride, Metoclopramide monohydrochloride monohydrate, 4-Amino-5-Chloro-N-(2-(Diethylamino)Ethyl)-N-Anisamide, 4-amino-5-chloro-N-(2-diethylaminoethyl)-2-methoxybenzamide hydrochloride, Metozolv ODT, o-Anisamide, 4-amino-5-chloro-N-(2-(diethylamino)ethyl)-, monohydrochloride, 364-62-5 (Parent), Reglan ODT, 4-Amino-5-chloro-N-(2-(diethylamino)ethyl)-2-methoxybenzamide monohydrochloride, SR-01000000165, C14H22ClN3O2.ClH, 4-Amino-5-chloro-N-[2-(diethylamino)ethyl]-o-anisamide hydrochloride, (4-amino-5-chloro-2-methoxyphenyl)-N-[2-(diethylamino)ethyl]carboxamide, chlor ide, 4-amino-5-chloro-N-[2-(diethylamino)ethyl]-2-methoxy-benzamide hydrochloride, Prestwick_332, 4-amino-5-chloro-N-[2-(diethylamino)ethyl]-2-methoxybenzamide;hydrochloride, Metoclopramide hydrochloride [USAN:JAN], Benzamide, 4-amino-5-chloro-N-(2-(diethylamino)ethyl)-2-methoxy-, monohydrochloride, monohydrate, Opera_ID_1671, AC1L2MT3, AC1Q3LU2, MLS001074186, MLS002222202, o-Anisamide, monohydrochloride, SCHEMBL205200, SPECTRUM1500410, CHEMBL1256771, CTK8G1096, MolPort-003-666-233, HMS1568J19, HMS1920N15, Metoclopramide hydrochloride, solid, Pharmakon1600-01500410, BCP28471, KS-000018AM, Tox21_500762, 2542AH, BG0253, MFCD00058011, MFCD00150634, NSC354467, NSC757117, SBB058161, AKOS015889947, API0003351, API0006827, CCG-212697, HS-0006, LP00762, MCULE-8548227068, NC00519, NSC-354467, NSC-757117, Benzamide, 4-amino-5-chloro-N-(2-(diethylamino)ethyl)-2-methoxy-, monohydrochloride, Metoclopramide Hydrochloride (anhydrous), NCGC00094102-01, NCGC00094102-02, NCGC00094102-03, NCGC00094102-04, NCGC00094102-05, NCGC00261447-01, AN-16617, AN-40630, CPD000058471, H780, LS-20040, SAM002554911, WLN: 2N2&2MVR DZ CG FO1 &GH, AB1009373, AX8140039, KB-240082, KB-304048, LS-175536, EU-0100762, FT-0657870, FT-0672375, S4289, ST24028881, ST51015042, VU0239518-5, J10269, M 0763, I01-4517, SR-01000000165-2, SR-01000000165-7, 4-Amino-5-chloro-N-(2-(diethylamino)ethyl)-2-methoxybenzamidehydrochloride, Benzamide, 4-amino-5-chloro-N-(2-(diethylamino)ethyl)-2-methoxy-, monohydrochloride (9CI), Benzamide, 4-amino-5-chloro-N-[2-(diethylamino)ethyl]-2-methoxy-, hydrochloride (1:1), 49625-23-2, Metoclopramide Base, AC1LCWGG, AKOS015890642, A823256, I01-7044, 4-amino-5-chloro-N-(2-diethylaminoethyl)-2-methoxy-benzamide, 4-amino-5-chloro-N-(2-diethylaminoethyl)-2-methoxybenzamide; hydron; chloride, 4-amino-5-chloro-N-[2-(diethylamino)ethyl]-2-methoxybenzamide; hydron; chloride, 4-azanyl-5-chloranyl-N-[2-(diethylamino)ethyl]-2-methoxy-benzamide; hydron; chloride


ID: 2025

chemical graph of compound 2025



InChIKey: RVIUMPLAOXSSGN-UHFFFAOYSA-N
SMILES: CC(C)CN(C)C1=NC(=C(N=C1Cl)C(=O)N=C(N)N)N

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 73314
synonyms found at PubChem are:
5-(N-Methyl-N-isobutyl)amiloride, 96861-65-3, Methylisobutylamiloride, 5-Nmnia, AC1Q3POP, Lopac-A-5585, AC1L2JN1, Lopac0_000048, MLS002153509, SCHEMBL2432777, SCHEMBL9852472, CHEMBL1256180, CTK8F6555, DTXSID50242594, ZINC4467875, 5-(N-Methyl-N-isobutyl)??amiloride, CCG-204144, 3-amino-6-chloro-n-(diaminomethylene)-5-[isobutyl(methyl)amino]pyrazine-2-carboxamide, NCGC00015068-01, NCGC00015068-02, NCGC00015068-03, NCGC00015068-04, NCGC00093562-01, NCGC00093562-02, SMR001230841, EU-0100048, A 5585, SR-01000075678, SR-01000075678-1, 3-amino-6-chloro-N-(diaminomethylidene)-5-[methyl(2-methylpr, 5-(N-Methyl-N-isobutyl)??amiloride, >=98% (TLC), powder, 3-Amino-5-(N-methyl-N-isobutylamino)-N-(aminoiminomethyl)-6-chloropyrazinecarboxamide, 3-amino-N-carbamimidoyl-6-chloro-5-[isobutyl(methyl)amino]pyrazine-2-carboxamide, Pyrazinecarboxamide, 3-amino-N-(aminoiminomethyl)-6-chloro-5-(methyl(2-methylpropyl)amino)-, 3-amino-6-chloro-N-(diaminomethylidene)-5-[methyl(2-methylpropyl)amino]pyrazine-2-carboxamide


ID: 2026

chemical graph of compound 2026



InChIKey: RVMGXWBCQGAWBR-UHFFFAOYSA-N
SMILES: C1=CC=C2C(=C1)C(=O)C=C(O2)C(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 2741
synonyms found at PubChem are:
chromocarb, 4940-39-0, Chromone-2-carboxylic acid, 4-Oxo-4H-chromene-2-carboxylic acid, 4-Oxo-4H-1-benzopyran-2-carboxylic acid, Atremon, 4-Oxochromene-2-carboxylic acid, Chromonecarboxylic acid, LP-1, Chromocarb [INN:DCF], 2-Chromonecarboxylic Acid, Chromocarbe [INN-French], Chromocarbum [INN-Latin], Cromocarbo [INN-Spanish], 4H-1-BENZOPYRAN-2-CARBOXYLIC ACID, 4-OXO-, Campel, UNII-FY38S0790W, EINECS 225-583-0, BRN 0146442, CHEMBL83628, 4H-1-Benzopyran-2-carboxylicacid, 4-oxo-, RVMGXWBCQGAWBR-UHFFFAOYSA-N, FY38S0790W, NCGC00094989-01, DSSTox_CID_25878, DSSTox_RID_81194, DSSTox_GSID_45878, Chromocarbe, Chromocarbum, Cromocarbo, SMR000685795, CAS-4940-39-0, Chromocarb (INN), PubChem9709, Chromone-2-carboxylic acid (4-Oxo-4H-1-benzopyran-2-carboxylic acid), Fludarene (Salt/Mix), Angiophtal (Salt/Mix), Spectrum3_000708, Spectrum4_000953, ACMC-1APW2, AC1L1ED2, Oprea1_123976, BSPBio_002495, KBioGR_001566, MLS000881205, MLS000881215, DivK1c_000471, SCHEMBL432304, SPECTRUM1503044, AC1Q72Y0, AC1Q72Y1, DTXSID6045878, CTK1D6380, HMS501H13, KBio1_000471, KBio3_001715, KS-00000CHY, ZINC57734, CHEBI:113552, MolPort-000-499-561, NINDS_000471, HMS1922A15, HMS2966O18, HMS3652D13, Pharmakon1600-01503044, ACN-S004166, HY-B1182, 4-Oxo4H-chromene-2-carboxylic acid, Tox21_111376, ANW-30767, BBL011801, BDBM50131079, CC-822, MFCD00006838, NSC758218, s4208, SBB003660, STK727279, 4-oxo-1-benzopyran-2-carboxylic acid, AKOS000119396, Tox21_111376_1, AC-7283, AN-9165, CCG-213852, Chromocarb; Chromone-2-carboxylic acid, CS-4791, MCULE-9387531298, NSC-758218, RTR-017797, IDI1_000471, 4-Oxo-4H-chromene-2-carboxylic acid #, NCGC00094989-02, NCGC00094989-03, NCGC00094989-04, NCGC00178630-01, 4-Oxo-4H-1-benzopyran-2-carboxylicAcid, AJ-09782, AS-15657, BR-73072, KB-48910, LS-39223, Q157, SY005480, SBI-0051754.P002, AB0017434, AB1003140, DB-051627, TR-017797, AM20060637, FT-0623799, O0290, ST24032829, ST50146730, EN300-17343, D07695, S-2494, 4-Oxo-4H-1-benzopyran-2-carboxylic acid, 97%, AB00052303_07, AB00052303_08, 940C390, SR-01000781903, SR-01000781903-2, W-106024, BRD-K94720315-001-01-3, BRD-K94720315-001-05-4, Z56922101, F0850-6795, 72275-48-0, AO7, ethyl 2-{[({4-methyl-5-[1-methyl-3-(4-methylphenyl)-1H-pyrazol-4-yl]-4H-1,2,4-triazol-3-yl}thio)acetyl]amino}benzoate


ID: 2027

chemical graph of compound 2027



InChIKey: RWCVSDKDFSVZNF-KRYGIPSASA-N
SMILES: CC[C@]1(C[C@@H](C2=C([C@H]1C(=O)OC)C=C3C(=C2O)C(=O)C4=C(C=CC(=C4C3=O)O)O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 159908
synonyms found at PubChem are:
Rutilantinone, Epsilon-pyrromycinone, Rutilantinon, Eta-Pyrromycinon, Antibiotic MA 144D2, PYRROMYCINONE, EPSILON, 21288-61-9, MA 144D2, NSC 114778, .epsilon.-Pyrromycinone, 1-Naphthacenecarboxylic acid, 1,2,3,4,6,11-hexahydro-2-ethyl-2,4,5,7,10-pentahydroxy-6,11-dioxo-, methyl ester, (1R,2R,4S)-, epsilon-pyrromy-cinone, Spectrum_000795, AC1L4MPH, Spectrum2_000452, Spectrum3_001155, Spectrum4_001432, Spectrum5_000284, BSPBio_002709, KBioGR_001904, KBioSS_001275, SPECTRUM201606, SPBio_000524, CHEMBL3039086, CTK4E6366, KBio2_001275, KBio2_003843, KBio2_006411, KBio3_002209, CHEBI:108590, RWCVSDKDFSVZNF-KRYGIPSASA-N, HMS1923A07, CCG-38694, SDCCGMLS-0066382.P001, NCGC00178516-01, LS-93964, SR-05000002666, SR-05000002666-1, BRD-K11258719-001-03-2, 1-Naphthacenecarboxylic acid, 2-ethyl-1,2,3,4,6,11-hexahydro-2,4,5,7,10-pentahydroxy-6,11-dioxo-, methyl ester, (1R,2R,4S)-, 1-Naphthacenecarboxylic acid, 2-ethyl-1,2,3,4,6,11-hexahydro-2,4,5,7,10-pentahydroxy-6,11-dioxo-, methyl ester, (1R,2R,4S)- (8CI), 1-Naphthacenecarboxylicacid, 2-ethyl-1,2,3,4,6,11-hexahydro-2,4,5,7,10-pentahydroxy-6,11-dioxo-,methyl ester, (1R,2R,4S)-, methyl (1R,2R,4S)-2-ethyl-2,4,5,7,10-pentahydroxy-6,11-dioxo-3,4-dihydro-1H-tetracene-1-carboxylate


ID: 2028

chemical graph of compound 2028



InChIKey: RWQKHEORZBHNRI-BMIGLBTASA-N
SMILES: C[C@@H]1CC2=C(C=C(C(=C2C(=O)O1)O)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)O)Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 442530
synonyms found at PubChem are:
OCHRATOXIN A, 303-47-9, Antibiotic 9663, Phenylalanine - ochratoxin A, 3R14S-Ochratoxin A, NCI-C56586, C20H18ClNO6, CHEBI:7719, RWQKHEORZBHNRI-BMIGLBTASA-N, Ochratoxin A, aspergillus ochraceus, Ochratoxin A-BSA conjugate from Aspergillus ochraceus, (-)-N-((5-Chloro-8-hydroxy-3-methyl-1-oxo-7-isochromanyl)carbonyl)-3-phenylalanine, N-(((3R)-5-Chloro-8-hydroxy-3-methyl-1-oxo-7-isochromanyl)carbonyl)-3-phenyl-L-alanine, NSC 201422, UNII-1779SX6LUY, L-Phenylalanine, N-((5-chloro-3,4-dihydro-8-hydroxy-3-methyl-1-oxo-1H-2-benzopyran-7-yl)carbonyl)-, (R)-, N-{[(3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydro-1H-isochromen-7-yl]carbonyl}-L-phenylalanine, OTA, CCRIS 2382, HSDB 4305, EINECS 206-143-7, Alanine, N-((5-chloro-8-hydroxy-3-methyl-1-oxo-7-isochromanyl)carbonyl)-3-phenyl-, (-)-, BRN 1301486, N-[(3R)-(5-Chloro-8-hydroxy-3-methyl-1-oxo-7-isochromanyl)carbonyl]-L-phenylalanine, (2S)-2-{[(3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-7-yl]formamido}-3-phenylpropanoic acid, 1779SX6LUY, Alanine, N-[(5-chloro-8-hydroxy-3-methyl-1-oxo-7-isochromanyl)carbonyl]-3-phenyl-, (-)-, (R)-N-((5-Chloro-3,4-dihydro-8-hydroxy-3-methyl-1-oxo-1 H-2-benzopyran-7-yl)carbonyl)phenylalanine, (R)-N-((5-Chloro-3,4-dihydro-8-hydroxy-3-methyl-1-oxo-1H-benzo(c)pyran-7-yl)carbonyl)-3-phenylalanine, L-Phenylalanine, N-[(5-chloro-3,4-dihydro-8-hydroxy-3-methyl-1-oxo-1H-2-benzopyran-7-yl)carbonyl]-, (R)-, Ochratoxin A(OTA), Ochratoxin A solution, D08UIB, D0KN6Q, AC1L9D0T, CBiol_002012, SCHEMBL15105, CHEMBL589366, GTPL4672, MEGxm0_000357, DTXSID7021073, ACon0_000200, ACon1_001268, BIO1001, MolPort-001-739-782, ZX-AFC000190, ZX-AFC000204, Bio1_000298, Bio1_000787, Bio1_001276, N-[[(3R)-5-Chloro-3,4-dihydro-8-hydroxy-3-methyl-1-oxo-1H-2-benzopyran-7-yl]carbonyl]-L-phenylalanine, ZINC3861782, MFCD00078079, AKOS024456512, LS-1157, MCULE-3363875457, SMP2_000132, NCGC00162403-01, NCGC00162403-02, NCGC00162403-03, NCGC00162403-04, NCGC00162403-05, ST50826330, C09955, J-017922, BRD-K39944607-001-01-4, Ochratoxin A, from Petromyces albertensis, >=98% (HPLC), Ochratoxin A, reference material, from Aspergillus ochraceus, Ochratoxin A, purum, >=98.0% (TLC), from Aspergillus ochraceus, Ochratoxin A solution, 10 mug/mL in acetonitrile, analytical standard, (-)-N-((5-Chloro-8-hydroxy-3-methyl-1-oxo-7-isochromanyl)carbonyl-3-phenylalanine, (-)-N- [(5-Chloro- 8-hydroxy- 3-methyl- 1-oxo- 7-isochromanyl) carbonyl]- 3-phenylalanine, (2S)-2-[[(3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydroisochromene-7-carbonyl]amino]-3-phenylpropanoic acid, (2S)-2-{[(3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-7-carbonyl]amino}-3-phenylpropanoic acid, (R)-N- [(5-Chloro- 3,4-dihydro- 8-hydroxy- 3-methyl- 1-oxo- 1H-2-benzopyran-7-yl) -carbonyl]- L- phenylalanine, (R)-N-((5-Chloro-3,4-dihydro-8-hydroxy-3-methyl-1-oxo-1H-2-benzopyran-7-yl)-carbonyl)-L-phenylalanine, (R)-N-((5-Chloro-3,4-dihydro-8-hydroxy-3-methyl-1-oxo-1H-2-benzopyran-7-yl)carbonyl)phenylalanine, (S)-2-((R)-5-chloro-8-hydroxy-3-methyl-1-oxoisochroman-7-carboxamido)-3-phenylpropanoic acid, 2-[((3R)-5-chloro-8-hydroxy-3-methyl-1-oxoisochroman-7-yl)carbonylamino](2S)-3 -phenylpropanoic acid, InChI=1/C20H18ClNO6/c1-10-7-12-14(21)9-13(17(23)16(12)20(27)28-10)18(24)22-15(19(25)26)8-11-5-3-2-4-6-11/h2-6,9-10,15,23H,7-8H2,1H3,(H,22,24)(H,25,26, N-[(3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-7-carbonyl]-L-phenylalanine, N-[(5-Chloro-3,4-dihydro-8-hydroxy-3-methyl-1-oxo-1H-2-benzopyran-7-yl)carbonyl]phenylalanine, 9CI, N-{[(3R)-5-chloro-8-hydroxy-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-7-yl]carbonyl}-L-phenylalanine, NCGC00162403-05_C20H18ClNO6_L-Phenylalanine, N-[[(3R)-5-chloro-3,4-dihydro-8-hydroxy-3-methyl-1-oxo-1H-2-benzopyran-7-yl]carbonyl]-, Ochratoxin A solution, certified reference material, 50 mug/mL in benzene: acetic acid (99:1), ampule of 1 mL


ID: 2029

chemical graph of compound 2029



InChIKey: RWSXRVCMGQZWBV-WDSKDSINSA-N
SMILES: C(CC(=O)N[C@@H](CS)C(=O)NCC(=O)O)[C@@H](C(=O)O)N

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 124886
synonyms found at PubChem are:
glutathione, 70-18-8, L-Glutathione, Glutathion, Isethion, Tathion, Glutathione-SH, Glutinal, reduced glutathione, Deltathione, Neuthion, Copren, L-Glutathione reduced, Glutide, Tathione, Triptide, Ledac, Glutatione, GSH, Glutatiol, Panaron, Glutathione SH, L-Glutatione, Agifutol S, Glutathione (reduced), gamma-L-Glutamyl-L-cysteinylglycine, gamma-L-glutamyl-L-cysteinyl-glycine, 5-L-Glutamyl-L-cysteinylglycine, Glutathione [JAN], L-gamma-glutamyl-L-cysteinylglycine, gamma-L-Glutamylcysteinylglycine, glutathione red, red. glutathione, Bakezyme RX, UNII-GAN16C9B8O, (S)-2-Amino-5-(((R)-1-((carboxymethyl)amino)-3-mercapto-1-oxopropan-2-yl)amino)-5-oxopentanoic acid, L-Glutathione reduce, Glycine, L-gamma-glutamyl-L-cysteinyl-, CCRIS 2094, N-(N-gamma-L-Glutamyl-L-cysteinyl)glycine, N-(N-L-gamma-Glutamyl-L-cysteinyl)glycine, L-Glutathione, reduced, glutathione reduced, glycine, N-(N-L-gamma-glutamyl-L-cysteinyl)-, EINECS 200-725-4, NSC 400639, GAN16C9B8O, L-glutamyl-L-cysteinylglycine, CHEBI:16856, RWSXRVCMGQZWBV-WDSKDSINSA-N, (2S)-2-amino-5-[[(2R)-1-(carboxymethylamino)-1-oxo-3-sulfanylpropan-2-yl]amino]-5-oxopentanoic acid, DSSTox_CID_3101, DSSTox_RID_76875, DSSTox_GSID_23101, [Glu(-Cys)]n-Gly, phytochelatins, Phytochelatin, (2S)-2-amino-4-{[(1R)-1-[(carboxymethyl)carbamoyl]-2-sulfanylethyl]carbamoyl}butanoic acid, CAS-70-18-8, (S)-2-Amino-5-((R)-1-(carboxymethylamino)-3-mercapto-1-oxopropan-2-ylamino)-5-oxopentanoic acid, Glycine, L-.gamma.-glutamyl-L-cysteinyl-, SR-05000002567, Glutathione [BAN:JAN], ReadiSorb, Glutathione;, NSC400639, 1lbk, NCGC00094976-01, Tathion (TN), GLUTHATHIONE, Glutathione (JP17), PubChem20020, Spectrum_000419, 1oe7, 1oe8, 1r4w, C(N-.gamma.Glu-)G, Reduced Glutathione,(S), Spectrum2_001500, Spectrum3_000946, Spectrum4_001056, Spectrum5_000940, Glutathione, Reduced Form, bmse000185, bmse000952, bmse000956, D02HFD, Glutathione (Reduced type), AC1L3Z9S, Cys(N-.gamma.Glu-)-Gly, SCHEMBL9167, CHEMBL1543, KBioGR_001352, KBioSS_000899, KSC377E2T, MLS001333069, DivK1c_000075, SPECTRUM1502248, SPBio_001519, GTPL6737, DTXSID6023101, L-?-glutamyl-L-cysteinylglycine, L-Glutathione reduced, 97.0%, CHEBI:60836, CTK2H7229, HMS500D17, KBio1_000075, KBio2_000899, KBio2_003467, KBio2_006035, KBio3_002012, KS-00000GCC, (gamma-Glutamylcysteine)n-glycine, L-g-glutamyl-L-cysteinyl-glycine, L-?-glutamyl-L-cysteinyl-glycine, MolPort-000-003-913, NINDS_000075, HMS1921N22, Pharmakon1600-01502248, Poly(gamma-glutamylcysteine)glycine, HY-D0187, L-Glutathione reduced, >=98.0%, ZINC3830891, gam.-L-Glutamyl-L-cysteinyl-glycine, Tox21_111371, ANW-43980, BDBM50422268, CCG-38876, L-gamma-glutamyl-L-cysteinyl-glycine, NSC758199, s4606, AKOS015999135, Tox21_111371_1, CS-7948, DB00143, MCULE-3371744018, NSC-758199, RP17794, SDCCGMLS-0066687.P001, .gamma.-L-Glutamyl-L-cysteinyl-glycine, IDI1_000075, N-(N-L-?-Glutamyl-L-cysteinyl)glycine, Pharm Biol 11: 539 (1968), SMP1_000247, NCGC00264046-02, AJ-45768, AK-48453, BC209606, DS-14675, LS-72665, SC-18300, SMR000857220, ST097777, SBI-0051743.P002, AB2000729, AX8132398, KB-296979, L-Glutathione reduced, BioXtra, >=98.0%, B7775, FT-0627837, G0074, ST24026560, 98726-08-0, Glycine, N-(N-L-gamma-glutamyl-L-cysteinyl), N-(N-L-.gamma.-Glutamyl-L-cysteinyl)glycine, C00051, C02471, D00014, G-3980, Y-8983, AB00443568_03, C-33528, SR-05000002567-1, SR-05000002567-2, L-Glutathione reduced, Vetec(TM) reagent grade, >=98%, Z2183947556, Glutathione, European Pharmacopoeia (EP) Reference Standard, Glutathione, United States Pharmacopeia (USP) Reference Standard, Glutathione, Pharmaceutical Secondary Standard; Certified Reference Material, L-Glutathione reduced, cell culture tested, BioReagent, >=98.0%, powder, N5-((R)-1-((carboxymethyl)amino)-3-mercapto-1-oxopropan-2-yl)-L-glutamine, (2S)-2-Amino-5-[[(2R)-1-(carboxymethylamino)-1-oxo- 3-sulfanylpropan-2-yl]amino]-5-oxopentanoic acid, 106272-20-2, 1109226-07-4, 4-(N-{(1R)-1-[N-(carboxymethyl)carbamoyl]-2-sulfanylethyl}carbamoyl)(2S)-2-ami nobutanoic acid, 95687-20-0


ID: 2030

chemical graph of compound 2030



InChIKey: RWTGFMPOODRXIM-UHFFFAOYSA-N
SMILES: C(CCN=C(N)N)CN=C(N)N.OS(=O)(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 26968
synonyms found at PubChem are:
USAF A-5080, 1,4-Diguanidinobutane sulfate, Tetramethylene bis-guanidinium sulfate, 1,1'-Tetramethylenediguanidine sulfate (1:1), GUANIDINE, 1,1'-TETRAMETHYLENEDI-, SULFATE (1:1), 544-05-8 (Parent), MFCD00050545, AC1L1C95, LS-73905, Guanidine, N,N'''-1,4-butanediylbis-, sulfate (1:1) (9CI), [N'-[4-[[amino(azaniumyl)methylidene]amino]butyl]carbamimidoyl]azanium sulfate, Arcaine sulfate, 14923-17-2, 1,4-Diguanidinobutane, Arcaine sulfate salt, 36587-93-6, 1-(4-guanidinobutyl)guanidine sulfate, Guanidine, N,N'''-1,4-butanediylbis-, sulfate (1:1), NCGC00093576-02, Guanidine, N,N'''-1,4-butanediylbis-, sulfate, SR-01000075422, C6H16N6.H2O4S, EINECS 253-118-1, Prestwick_1059, 1,1'-Tetramethylenediguanidine sulphate, arcaine; sulfuric acid, ARCAINE SULPHATE, AC1L3O1W, DSSTox_CID_28664, DSSTox_RID_82934, DSSTox_GSID_48738, SPECTRUM1500706, SCHEMBL1999196, CHEMBL1256017, CTK1A9971, CTK8F7820, HMS501B17, DTXSID80872308, MolPort-044-723-519, RWTGFMPOODRXIM-UHFFFAOYSA-N, HMS1570P13, HMS2097P13, HMS3260M05, 1,4-Diguanidinobutane sulfate salt, Tox21_113186, Tox21_500062, 6152AH, CCG-38521, AKOS028109560, AKOS030228005, 1,1'-Tetramethylenediguanidine sulfate, LP00062, KS-000002E2, N-(4-Guanidino-butyl)-guanidine sulfate, NCGC00093576-01, NCGC00093576-03, NCGC00093576-04, NCGC00260747-01, 1,1-(Butane-1,4-diyl)diguanidine sulfate, CAS-36587-93-6, N,N'''-butane-1,4-diyldiguanidine sulfate, N,N'-1,4-Butanediylbis(guanidine) sulfate, 1,1'-(Butane-1,4-diyl)diguanidine sulfate, B6287, EU-0100062, FT-0622466, A 0384, K-4741, SR-01000075422-1, SR-01000075422-3, SR-01000075422-5, 2-[4-(diaminomethylideneamino)butyl]guanidine; sulfuric acid


ID: 2031

chemical graph of compound 2031



InChIKey: RWVIMCIPOAXUDG-UHFFFAOYSA-N
SMILES: C1=C2C(=CC(=C1[N+](=O)[O-])[N+](=O)[O-])NC(=O)C(=O)N2

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3899541
synonyms found at PubChem are:
dnqx, 2379-57-9, 6,7-dinitro-1,4-dihydroquinoxaline-2,3-dione, FG 9041, FG-9041, UNII-62T278S1MX, 6,7-Dinitroquinoxaline-2,3-dione (DNQX), 2,3-Quinoxalinedione, 1,4-dihydro-6,7-dinitro-, 6,7-Dinitroquinoxaline-2,3(1H,4H)-dione, 6,7-Dinitro-1,4-dihydro-quinoxaline-2,3-dione, 62T278S1MX, SR-01000075442, 1ftl, Tocris-0189, AC1MZKE9, Lopac-D-0540, Biomol-NT_000182, D05KQC, Lopac0_000345, Oprea1_127694, MLS000705107, SCHEMBL594575, BPBio1_001176, C8H4N4O6, CHEMBL155265, SCHEMBL8128055, CHEBI:93492, CTK8F7031, DTXSID60178476, MolPort-003-846-931, 6,7-dinitro-2,3-quinoxalinediol, 6,7-dinitroquinoxaline-2,3-diol, HMS2599K21, HMS3261E11, HMS3266C03, DNQX, >=98% (TLC), Tox21_500345, BN0195, MFCD00069257, STL431184, STL507389, ZINC18118278, AKOS000448016, AKOS005066561, CCG-204440, CS-5935, DB03759, LP00345, MCULE-3076221110, NCGC00015319-01, NCGC00015319-02, NCGC00015319-03, NCGC00015319-04, NCGC00015319-05, NCGC00015319-06, NCGC00024490-01, NCGC00024490-02, NCGC00024490-03, NCGC00024490-04, NCGC00261030-01, BC600131, HY-15067, KB-76693, SMR000230466, ST044512, LS-143032, EU-0100345, FT-0620868, KS-00001876, D 0540, 1,4-Dihydro-6,7-Dinitro-2,3-Quinoxalinedione, AE-641/00586054, SR-01000313889, J-015214, SR-01000075442-1, SR-01000075442-3, SR-01000313889-1, BRD-K64400208-001-01-8, BRD-K64400208-001-02-6, BRD-K85266041-304-01-7


ID: 2032

chemical graph of compound 2032



InChIKey: RXBKMJIPNDOHFR-UHFFFAOYSA-N
SMILES: C1=CC=C(C=C1)CCNN.OS(=O)(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 61100
synonyms found at PubChem are:
Phenelzine sulfate, 156-51-4, PHENELZINE SULFATE SALT, Estinerval, Nardelzine, Kalgan, Phenethylhydrazin, Mao-Rem, Phenelzine bisulfate, Alacine, Phenelzine (sulfate), Alazin, Phenethylhydrazine sulfate, Phenelzine sulphate, Phenelzine hydrogen sulfate, Phenelzine bisulphate, Phenalzine dihydrogen sulfate, Phenelzine dihydrogen sulfate, Phenelzine acid sulfate, WL 7, Phenethylhydrazine sulphate, N-1544a, Phenylethylhydrazine sulfate, Phenylethylhydrazine sulphate, CCRIS 498, 2-Phenylethylhydrazine sulphate, 2-Phenylethylhydrazine dihydrogen sulfate, beta-Phenylethylhydrazine sulfate, (2-phenylethyl)hydrazine sulfate, Phenethylhydrazine sulfate (1:1), UNII-2681D7P965, EINECS 205-856-0, EP-411, S 1544, Phenelzine sulfate [USP], NSC 170957, Phenylethylhydrazine dihydrogen sulphate, Phenelzine hydrogen sulphate, 2-Phenylethylhydrazine hydrogen sulphate, 2-Phenylethylhydrazine dihydrogen sulphate, beta-Phenylethylhydrazine hydrogen sulphate, beta-Phenylethylhydrazine dihydrogen sulfate, CHEBI:8061, 1-Hydrazino-2-phenylethane hydrogen sulphate, Hydrazine, (2-phenylethyl)-, sulfate (1:1), P 1531, Hydrazine, (2-phenylethyl)-, sulfate, Hydrazine, phenethyl-, sulfate (1:1), 2681D7P965, DSSTox_CID_1144, Phenelzine sulfate (USP), DSSTox_RID_75973, DSSTox_GSID_21144, 2-phenylethylhydrazine;sulfuric acid, SMR000058500, SR-01000076074, Phenelzine sulfate [USAN], Felazine, Phelazin, Phenline, C8H12N2.H2O4S, Phenelzine(sulfate), Prestwick_595, Phenylaethyl-Hydrazin, W 1544A, AC1L1UIX, phenelzine; sulfuric acid, phenethyl hydrazine sulfate, SCHEMBL40652, 2-phenethyl-hydrazine sulfate, MLS000069778, MLS000758253, MLS001423996, SPECTRUM1500476, CHEMBL1200895, DTXSID3021144, phenethylhydrazine; sulfuric acid, 2-phenethylhydrazine sulfate salt, CTK8G2350, HMS500D04, HY-B1018A, MolPort-000-150-294, RXBKMJIPNDOHFR-UHFFFAOYSA-N, HMS1568B21, HMS1920J08, HMS2051I11, HMS2091N20, HMS2095B21, HMS2233N22, HMS3263C03, HMS3393I11, HMS3712B21, Pharmakon1600-01500476, .beta.-Phenylethylhydrazine sulfate, KS-00001FA3, Tox21_110236, Tox21_200134, Tox21_500971, CCG-40227, MFCD00050687, NSC170957, NSC757268, (2-phenylethyl)hydrazine sulfuric acid, AKOS015914085, Tox21_110236_1, API0003806, CS-4533, LP00971, LS-7653, MCULE-1121090101, NC00037, NSC-170957, NSC-757268, NCGC00015830-08, NCGC00094271-01, NCGC00094271-02, NCGC00094271-03, NCGC00094271-04, NCGC00094271-05, NCGC00257688-01, NCGC00261656-01, CPD000058500, FS000846, SAM001247037, EU-0100971, FT-0673678, .beta.-Phenylethylhydrazine dihydrogen sulfate, C07431, D00505, P 6777, J-009308, SR-01000076074-1, SR-01000076074-6, SR-01000076074-8, I14-44668, Phenelzine sulfate, United States Pharmacopeia (USP) Reference Standard, 75513-79-0, WLN: ZM2R & WSQQALACINEALAZINEEP-411ESTINERVALFENELSINFENETSINFENELZINAFENIZINKALGANMAO-REMMONOFENMONOPHENMONOTEN


ID: 2033

chemical graph of compound 2033



InChIKey: RXJXEVKNSVYHAS-UHFFFAOYSA-N
SMILES: CCOC1=CC=CC=C1NC2=NC(=CS2)C3=CC(=C(C=C3)OC)OC

biological descriptors:

CFTR relevance: CFTR corrector

Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown

reference list:

"GL Lukacs" "N Pedemonte" "O Zegarra-Moran" "LJ Galietta" "K Du" "AS Verkman" "E Caci"


CID is 2901912
synonyms found at PubChem are:
4-(3,4-dimethoxyphenyl)-N-(2-ethoxyphenyl)-1,3-thiazol-2-amine, AC1MEE05, Oprea1_076959, SCHEMBL837871, MolPort-002-207-231, ZINC4123323, AKOS001665688, MCULE-1836070818, EU-0078226, SR-01000492597, SR-01000492597-1


ID: 2034

chemical graph of compound 2034



InChIKey: RXKMOPXNWTYEHI-RDRKJGRWSA-N
SMILES: C1CN(CCN1C/C=C/C2=CC=CC=C2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F.Cl.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5282407
synonyms found at PubChem are:
Flunarizine dihydrochloride, 30484-77-6, flunarizine hydrochloride, Flunarizine 2HCl, Flunarizine HCl, Flunarizine diHCl, Flunarizine (dihydrochloride), UNII-C11102TO53, EINECS 250-216-6, Flunarizine hydrochloride [USAN:JAN], 1-(Bis(4-fluorophenyl)methyl)-4-cinnamylpiperazine dihydrochloride, KW-3149, R 14950, C11102TO53, (E)-1-(Bis-(p-fluorophenyl)methyl)-4-cinnamylpiperazine dihydrochloride, 1-[Bis(4-fluorophenyl)methyl]-4-(3-phenyl-2-propenyl)piperazine dihydrochloride, (E)-1-(Bis(4-fluorophenyl)methyl)-4-(3-phenyl-2-propenyl)piperazine dihydrochloride, R-14950, (E)-1-(Bis(4-fluorophenyl)methyl)-4-cinnamylpiperazine dihydrochloride, Piperazine, 1-(bis(p-fluorophenyl)methyl)-4-cinnamyl-, dihydrochloride, (E)-, 1-[bis(4-fluorophenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine dihydrochloride, Piperazine, 1-(bis(4-fluorophenyl)methyl)-4-(3-phenyl-2-propenyl)-, dihydrochloride, (E)-, SR-01000000006, 27064-95-5, Flugeral, (E)-1-[Bis(4-fluorophenyl)methyl]-4-(3-phenyl-2-propenyl)piperazine dihydrochloride, 1-[bis(4-fluorophenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine;dihydrochloride, Prestwick_222, EINECS 248-203-5, AC1NR00J, Flunarizine hydrochloride,(S), SPECTRUM1500993, C26H26F2N2.2HCl, C26H28Cl2F2N2, CHEMBL552659, SCHEMBL1009444, SCHEMBL1321708, CHEBI:31621, HY-B0358A, DTXSID80184554, 1-[bis (4-fluorophenyl)methyl]-4-(3-phenyl-2-propenyl)-piperazine dihydrochloride, MolPort-000-825-358, HMS1568P06, HMS1921O12, 52468-60-7 (Parent), BCP02932, Tox21_500527, CCG-39000, MFCD00058198, s2030, Flunarizine hydrochloride (JAN/USAN), AKOS015895373, AC-2152, BCP9000695, CS-2412, KS-5125, LP00527, NCGC00093920-01, NCGC00093920-02, NCGC00093920-03, NCGC00261212-01, AN-14275, BC201114, KB-51879, BCP0726000286, AB0012900, AB1009511, Flunarizine dihydrochloride, >=98% (TLC), LS-110458, EU-0100527, ST24047212, ST51015006, D01303, F 8257, K-7304, 484F776, A820398, C-22772, I06-0614, Q-100983, R 14,950, SR-01000000006-2, SR-01000000006-4, SR-01000000006-9, Flunarizine Dihydrochloride 1.0 mg/ml in Methanol (as free base), 1-[bis(4-fluorophenyl)methyl]-4-[(E)-cinnamyl]piperazine dihydrochloride, Flunarizine dihydrochloride, European Pharmacopoeia (EP) Reference Standard, 1-[bis(4-fluorophenyl)methyl]-4-(3-phenyl-2-propenyl)-piperazine dihydrochloride, 1-[bis(4-fluorophenyl)methyl]-4-(3-phenylprop-2-en-1-yl)piperazine dihydrochloride, 4-((2E)-3-phenylprop-2-enyl)-1-[bis(4-fluorophenyl)methyl]piperazine, chloride , chloride, Flunarizine dihydrochloride for system suitability, European Pharmacopoeia (EP) Reference Standard, AKOS026749953


ID: 2035

chemical graph of compound 2035



InChIKey: RXPRRQLKFXBCSJ-GIVPXCGWSA-N
SMILES: CC[C@@]12CCCN3[C@@H]1C4=C(CC3)C5=CC=CC=C5N4[C@](C2)(C(=O)OC)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 15376
synonyms found at PubChem are:
vincamine, 1617-90-9, Pervincamine, Devincan, Minorine, Vincamidol, Monorin, Novicet, Methyl vincaminate, Arteriovinca, Vincasaunier, (+)-Vincamine, Anasclerol, Angiopac, Decincan, Devinkan, Tripervan, Vincadar, Vincafolina, Vincapront, Vinkametrin, Equipur, Oxygeron, Pervone, Vincafor, Perval, Ocu-vinc, Vincamina [DCIT], Vincimax, Vincamine base, Vincaminum [INN-Latin], UNII-996XVD0JHT, Vincamine [INN:BAN:DCF], Minorin, Vincachron, Vincagil, Vincamin, Vincapan, Vinca, Vinodrel retard, Vinca-Ecobi, Vinca-Minor, HSDB 7150, Anasclerol (base), EINECS 216-576-3, NSC 91998, 996XVD0JHT, CHEBI:9985, RXPRRQLKFXBCSJ-GIVPXCGWSA-N, Alkaloid obtained from Vinca minor, Eburnamenine-14-carboxylic acid, 14,15-dihydro-14-hydroxy-, methyl ester, (3alpha,14beta,16alpha)-, 14,15-Dihydro-14-hydroxyeburnamenine-14-carboxylic acid methyl ester, DSSTox_CID_20134, DSSTox_RID_79448, Eburnamenine-14-carboxylic acid, 14,15-dihydro-14-hydroxy-, methyl ester, (3alpha,14beta,16.), DSSTox_GSID_40134, Cerebroxine, Vincaminum, Vincamina, methyl 14beta-hydroxy-14,15-dihydro-3alpha,16alpha-eburnamenine-14alpha-carboxylate, Teprosilic Acid, (3?,14?,16?)-14,15-Dihydro-14-hydroxyeburnamenine-14-carboxylic acid methyl ester, Vincamine (FP), NCGC00094824-01, Vincamine (INN), Prestwick_495, CAS-1617-90-9, Cetal retard (TN), Vincamine, 98%, Prestwick0_000271, Prestwick1_000271, Prestwick2_000271, Prestwick3_000271, Vincamine, 98% 1g, D08UGJ, AC1L25RL, BSPBio_000142, GTPL349, MLS002154249, SCHEMBL147179, SPBio_002361, BPBio1_000158, CHEMBL1165342, DTXSID9040134, BCBcMAP01_000080, MolPort-002-510-941, HMS1568H04, HMS2095H04, HMS2268C20, HMS3712H04, BCP05837, HY-B1021, ZINC1069082, Tox21_111342, Tox21_301968, MFCD00078054, AKOS015896471, Tox21_111342_1, API0004593, CCG-208544, CS-4536, DB13374, EBD2197880, KS-5179, SMP1_000314, Vincamine, analytical reference material, NCGC00184983-01, NCGC00184983-03, NCGC00255542-01, AC-22625, AK163212, AN-49543, BC681377, SC-19228, SMR000112509, AX8156430, LS-162175, ST24050348, C09251, D08677, J10447, 617V909, I06-1879, Q-100193, BRD-K40902647-001-03-7, methyl (3alpha,14beta,16alpha)-14-hydroxy-14,15-dihydroeburnamenine-14-carboxylate, Eburnamenine-14-carboxylic acid, 14,15-dihydro-14-hydroxy-,methyl ester, (3alpha,14beta,16alpha)-, methyl (15S,17S,19S)-15-ethyl-17-hydroxy-1,11-diazapentacyclo[9.6.2.0?,?.0?,??.0??,??]nonadeca-2,4,6,8(18)-tetraene-17-carboxylate, methyl (15S,17S,19S)-15-ethyl-17-hydroxy-1,11-diazapentacyclo[9.6.2.0^{2,7}.0^{8,18}.0^{15,19}]nonadeca-2,4,6,8(18)-tetraene-17-carboxylate


ID: 2036

chemical graph of compound 2036



InChIKey: RXPRRQLKFXBCSJ-HLAWJBBLSA-N
SMILES: CC[C@@]12CCCN3[C@@H]1C4=C(CC3)C5=CC=CC=C5N4[C@@](C2)(C(=O)OC)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 637570
synonyms found at PubChem are:
Epivincamine, CHEBI:70504, 6835-99-0, Prestwick_873, (+)-Vincamin, AC1LCUI5, Prestwick0_000636, Prestwick1_000636, Prestwick2_000636, Prestwick3_000636, Spectrum2_001338, Spectrum3_001381, Spectrum4_000996, Spectrum5_000664, BSPBio_000632, BSPBio_002962, KBioGR_001431, MLS002153925, DivK1c_000167, SPECTRUM1500647, SPBio_001495, SPBio_002851, BPBio1_000696, CHEMBL1728279, SCHEMBL14095103, HMS500I09, KBio1_000167, KBio3_002182, NINDS_000167, HMS1569P14, HMS1921O09, HMS2096P14, HMS2234I20, Pharmakon1600-01500647, ZINC3875273, CCG-38834, NSC757405, NSC-757405, SDCCGMLS-0066588.P001, IDI1_000167, SMR001233269, SBI-0051576.P002, AB00052139_02, BRD-K89704198-001-05-7, BRD-K89704198-001-08-1


ID: 2037

chemical graph of compound 2037



InChIKey: RYAMDQKWNKKFHD-JXMROGBWSA-N
SMILES: COC1=CC=CC(=C1)NC(=O)/C=C/C2=CC=C(C=C2)Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 667594
synonyms found at PubChem are:
SB-366791, 472981-92-3, SB 366791, SB366791, (2E)-3-(4-chlorophenyl)-N-(3-methoxyphenyl)prop-2-enamide, N-(3-Methoxyphenyl)-4-chlorocinnamide, N-(3-methoxyphenyl)-4-chlorocinnamanilide, 1649486-65-6, SB-366,791, AC1LDIF9, 3-(4-chlorophenyl)-N-(3-methoxyphenyl)prop-2-enamide, 2-Propenamide, 3-(4-chlorophenyl)-N-(3-methoxyphenyl)-, CHEMBL122413, GTPL4309, ZINC9321, BDBM20488, CHEBI:93038, MolPort-001-491-057, BCP17766, EX-A1109, GL6242, MFCD01033818, s8238, STK202522, AKOS002529706, CS-5658, ES-0017, NCGC00025231-02, HY-12245, ZB000678, B6804, ST50688751, SB-366791, >=98% (HPLC), powder, SB366791 (SB-366791), SR-01000597592, SR-01000597592-1, (e)-3-(4-chlorophenyl)-n-(3-methoxyphenyl)acrylamide, BRD-K59331372-001-01-2, (E)-3-(4-chlorophenyl)-N-(3-methoxyphenyl)prop-2-enamide


ID: 2038

chemical graph of compound 2038



InChIKey: RYAXABNGWYEGTO-UHFFFAOYSA-N
SMILES: C1=CC=C(C=C1)C2=CN=C(N2)SCC(=O)NC3=NC(=CS3)C4=CC=C(C=C4)Br

biological descriptors:

CFTR relevance: CFTR corrector

Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown

reference list:

"GL Lukacs" "N Pedemonte" "O Zegarra-Moran" "LJ Galietta" "K Du" "AS Verkman" "E Caci"


CID is 1008236
synonyms found at PubChem are:
N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-[(5-phenyl-1H-imidazol-2-yl)sulfanyl]acetamide, AC1LJXGB, Oprea1_477754, Oprea1_602653, SCHEMBL837694, MolPort-002-704-370, MolPort-003-819-155, ZINC1062392, STK793160, AKOS001014760, AKOS001741629, MCULE-8210024769, EU-0052043, A1954/0082128, N~1~-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-[(4-phenyl-1H-imidazol-2-yl)sulfanyl]acetamide


ID: 2039

chemical graph of compound 2039



InChIKey: RYEFFICCPKWYML-QCGISDTRSA-N
SMILES: C[C@@]12[C@H]3[C@H]4[C@H]([C@@H]([C@@]1(C[C@@H]5[C@]2(O5)C(=O)O3)O)C(=O)O4)C(C)(C)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 442291
synonyms found at PubChem are:
picrotin, 21416-53-5, DSSTox_CID_25605, DSSTox_RID_80998, UNII-U06Z6QD7N2, DSSTox_GSID_45605, CHEBI:8205, CHEMBL478523, U06Z6QD7N2, CAS-124-87-8, ST057242, (5S,8S,12S,14S,1R,3R,9R,13R)-1-hydroxy-14-(1-hydroxy-isopropyl)-13-methyl-4,7, 10-trioxapentacyclo[6.4.1.1<9,12>.0<3,5>.0<5,13>]tetradecane-6,11-dione, Pikrotin, NSC 129536, Picrotin (from Anamirta cocculus seed), BRN 5302552, NCGC00017246-02, 3,6-Methano-8H-1,5,7-trioxacyclopenta(ij)cycloprop(a)azulene-4,8(3H)-dione, hexahydro-2a-hydroxy-9-(1-hydroxy-1-methylethyl)-8b-methyl-, (1aR,2aR,3S,6R,6aS,8aS,8bR,9S)-, AI3-41570, Spectrum_000413, AC1L9CJW, Spectrum2_000279, Spectrum3_000073, Spectrum4_001781, Spectrum5_000421, D0V9XF, Picrotin (VAN) (8CI), BSPBio_001885, KBioGR_002323, KBioSS_000893, SPECTRUM100346, DivK1c_000756, SPBio_000158, GTPL4286, SCHEMBL1688919, HMS502F18, KBio1_000756, KBio2_000893, KBio2_003461, KBio2_006029, KBio3_001105, DTXSID80274161, NINDS_000756, HMS1922N10, 3,6-Methano-8H-1,5,7-trioxacyclopenta(ij)cycloprop(a)azulene-4,8(3H)-dione, hexahydro-2a-hydroxy-9-(1-hydroxy-1-methylethyl)-8b-methyl-, (1aR-(1a alpha,2a beta,3beta,6beta,6a beta,8aS*,8b beta,9S*))-, ZINC3995861, Tox21_110806, Tox21_111261, BDBM50269961, CCG-39837, AKOS024282616, SDCCGMLS-0066351.P001, IDI1_000756, SMP1_000239, NCGC00142523-02, CC-33785, FT-0630472, C09528, C-19226, Q-100267, UNII-ZLT174DL7U component RYEFFICCPKWYML-QCGISDTRSA-N, (1R,3R,5S,8S,9R,12S,13R,14S)-1-hydroxy-14-(2-hydroxypropan-2-yl)-13-methyl-4,7,10-trioxapentacyclo[6.4.1.1(9,12).0(3,5).0(5,13)]tetradecane-6,11-dione


ID: 2040

chemical graph of compound 2040



InChIKey: RYFKTZXULZNOCC-UHFFFAOYSA-N
SMILES: CNNC.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 134414
synonyms found at PubChem are:
1,2-dimethylhydrazine hydrochloride, 1,2-dimethylhydrazine hydrochloride(1:1), sym-Dimethylhydrazine hydrochloride, Hydrazine, 1,2-dimethyl-, hydrochloride, Dimethylhydrazine dihydrochloride, AC1Q3CHZ, AC1L34JU, EBD750, CHEMBL3039322, CTK8D7681, RYFKTZXULZNOCC-UHFFFAOYSA-N, WLN: 1MM1 & GH 2, NSC60518, 1,2-Dimethyl-hydrazine Hydrochloride, CCG-39892, NSC-60518, AKOS004907805, Hydrazine,2-dimethyl-, dihydrochloride, LS-76760, N,N'-dimethylhydrazine hydrochloride salt, SC-92981


ID: 2041

chemical graph of compound 2041



InChIKey: RYHCACJBKCOBTJ-UHFFFAOYSA-N
SMILES: CCN(CCCC1=CC=CC=C1)CCCC2=CC=CC=C2.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 21718
synonyms found at PubChem are:
ALVERINE CITRATE, 5560-59-8, Alverine (citrate), ALVERINE CITRATE SALT, NCI 85x, UNII-9JFB58YK1E, NSC 35459, 9JFB58YK1E, MLS000069524, CHEBI:53785, N-Ethyl-3,3'-diphenyldipropylamine citrate (1:1), NCGC00017047-01, SMR000058631, CAS-5560-59-8, DSSTox_CID_25562, DSSTox_RID_80959, DSSTox_GSID_45562, N-ethyl-3-phenyl-N-(3-phenylpropyl)propan-1-amine 2-hydroxypropane-1,2,3-tricarboxylate, SR-01000003029, Alverine dihydrogen citrate, Alverine citrate [USAN:NF], alverine; citro, Alverrine citrate, Alverine(citrate), Prestwick_912, EINECS 226-929-3, AC1L2IXM, Opera_ID_1477, Alverine citrate (USAN), PHENPROPAMINE CITRATE, Dipropylamine, N-ethyl-3,3'-diphenyl-, citrate, N-Ethyl-bis(3-phenylpropyl)amin-dihydrogencitrat, MLS001148462, MLS002207301, MLS002222279, MLS004712036, SCHEMBL352008, SPECTRUM1500109, REGID_for_CID_21718, CHEMBL1408594, DTXSID3045562, MolPort-003-666-118, HMS1568D09, HMS1920A17, HMS2091G17, HMS2095D09, HMS2232D03, HMS3371I14, HMS3651F18, HMS3712D09, Pharmakon1600-01500109, HY-B0500, KS-00001F7G, Tox21_110757, CA0130, Dipropylamine,3'-diphenyl-, citrate, N-Ethyl-3,3 -diphenlyldipropylamine, N-Ethyl-3,3'-diphenlyldipropylamine, NSC-35459, NSC755859, s3054, AKOS015895657, Tox21_110757_1, API0001434, CCG-212472, CS-2694, MCULE-5221384643, NSC-755859, VA10244, NCGC00017047-02, NCGC00017047-03, NCGC00021122-08, NCGC00094581-01, NCGC00094581-02, AK110378, AX8009252, N-Ethyl-3,3'-diphenyldipropylamine citrate, Dipropylamine,3'-diphenyl-, citrate (1:1), FT-0622247, V0594, D02877, A830720, SR-01000003029-2, SR-01000003029-4, bis-gamma-PHENYLPROPYLETHYLAMINE DIHYDROGEN CITRATE, Dipropylamine, N-ethyl-3,3'-diphenyl-, citrate (1:1) (8CI), Benzenepropanamine, 2-hydroxy-1,2,3-propanetricarboxylate (1:1), Alverine citrate salt, European Pharmacopoeia (EP) Reference Standard, Alverine for peak identification, European Pharmacopoeia (EP) Reference Standard, Benzenepropanamine, N-ethyl-N-(3-phenylpropyl)-, 2-hydroxy-1,2,3-propanetricarboxylate (1:1) (9CI), N-ethyl-3-phenyl-N-(3-phenylpropyl)-1-propanamine; 2-hydroxypropane-1,2,3-tricarboxylic acid, N-ethyl-3-phenyl-N-(3-phenylpropyl)propan-1-amine; 2-hydroxypropane-1,2,3-tricarboxylic acid, N-ethyl-3-phenyl-N-(3-phenylpropyl)propan-1-amine; 2-oxidanylpropane-1,2,3-tricarboxylic acid, N-OO>>u-3,3 inverted exclamation marka- paragraph signthorn+/-(1/2) paragraph signthorn+/-u degrees .


ID: 2042

chemical graph of compound 2042



InChIKey: RYMZZMVNJRMUDD-HGQWONQESA-N
SMILES: CCC(C)(C)C(=O)O[C@H]1C[C@H](C=C2[C@H]1[C@H]([C@H](C=C2)C)CC[C@@H]3C[C@H](CC(=O)O3)O)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 54454
synonyms found at PubChem are:
simvastatin, 79902-63-9, Zocor, Synvinolin, Sinvacor, Denan, Lipex, MK-733, Simvastatine, Sivastin, Lodales, Simvastatina, Simvastatinum, Cholestat, Colemin, Simovil, Medipo, Pantok, Simvastatin lactone, Labistatin, Nivelipol, Rendapid, Vasotenal, Velostatin, Coledis, Corolin, Zocord, Simvastatin (Zocor), Lipovas, Rechol, Zorced, Simvastatine [French], Simvastatinum [Latin], Simvastatina [Spanish], Simcard, Simvacor, Simvoget, Simlup, UNII-AGG2FN16EV, Simvast CR, DRG-0320, (1S,3R,7S,8S,8aR)-8-(2-((2R,4R)-4-Hydroxy-6-oxotetrahydro-2H-pyran-2-yl)ethyl)-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl 2,2-dimethylbutanoate, MK 0733, MK-0733, Simvastatin [USAN:INN:BAN], CCRIS 7558, Zocor (TN), Simvastatin, Compactin, HSDB 7208, Simvastatin & Primycin, AGG2FN16EV, 2,2-Dimethylbutyric acid, 8-ester with (4R,6R)-6-(2-((1S,2S,6R,8S,8aR)-1,2,6,7,8,8a-hexahydro-8-hydroxy-2,6-dimethyl-1-naphthyl)ethyl)tetrahydro-4-hydroxy-2H-pyran-2-one, L 644128-000U, BRN 4768037, Statin, CHEBI:9150, (1S,3R,7S,8S,8aR)-8-{2-[(2R,4R)-4-hydroxy-6-oxotetrahydro-2H-pyran-2-yl]ethyl}-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl 2,2-dimethylbutanoate, RYMZZMVNJRMUDD-HGQWONQESA-N, C25H38O5, TNP00259, [(1S,3R,7S,8S,8aR)-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2,2-dimethylbutanoate, Butanoic acid, 2,2-dimethyl-, (1S,3R,7S,8S,8aR)-1,2,3,7,8,8a-hexahydro-3,7-dimethyl-8-[2-[(2R,4R)-tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl]ethyl]-1-naphthalenyl ester, KS-1113, DSSTox_CID_3581, DSSTox_RID_77090, DSSTox_GSID_23581, (1S,3R,7S,8S,8aR)-8-{2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl}-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl 2,2-dimethylbutanoate, Butanoic acid, 2,2-dimethyl-, (1S,3R,7S,8S,8aR)-1,2,3,7,8,8a-hexahydro-3,7-dimethyl-8-(2-((2R,4R)-tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl)ethyl)-1-naphthalenyl ester, Zosta, [(1S,3R,7S,8S,8aR)-8-[2-[(2R,4R)-4-hydroxy-6-oxo-tetrahydropyran-2-yl]ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2,2-dimethylbutanoate, 2,2-Dimethylbutanoic acid (1S,3R,7S,8S,8aR)-1,2,3,7,8,8a-hexahydro-3,7-dimethyl-8-[2-[(2R,4R)-tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl]ethyl]-1-naphthalenyl ester, Butanoic acid, 2,2-dimethyl-, (1S,3R,7S,8S,*aR)-1,2,3,7,8,8a-hexahydro-3,7-dimethyl-8-(2-((2R,4R)-tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl)ethyl)-1-naphthalenyl ester, Butanoic acid, 2,2-dimethyl-, 1,2,3,7,8,8a-hexahydro-3,7-dimethyl-8-(2-(tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl)ethyl)-1-naphthalenyl ester, (1S-(1alpha,3alpha,7beta,8beta(2S*,4S*),8abeta))-, butanoic acid, 2,2-dimethyl-,1,2,3,7,8,8a-hexahydro-3,7-dimethyl-8-[2-(tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl)-ethyl]-1-naphthalenyl ester, [1S-[1 alpha,3 alpha,7 beta,8 beta(2S*,4S*),-8a beta, SMR000718785, SR-05000001894, simvastol, Kolestevan, Lipinorm, Modutrol, Simvotin, Sinvascor, Valemia, Eucor, Nor-Vastina, Simvastatin,(S), simvastatin predrug, (+)-Simvastatin, MK733, NCGC00016940-01, inactive simvastatin, Simvacor (TN), 8-[2-((2R,4R)-4-hydroxy-6-oxo(2H-3,4,5-trihydropyran-2-yl))ethyl](1S,7S,8S,3R, 8aR)-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthyl 2,2-dimethylbutanoate, Simvastatin [USAN:USP:INN:BAN], Prestwick_171, Simcard (TN), CAS-79902-63-9, MK 733, Simlup (TN), Spectrum_001717, SpecPlus_000895, Prestwick0_000865, Prestwick1_000865, Prestwick2_000865, Prestwick3_000865, Spectrum2_001671, Spectrum3_000669, Spectrum4_000632, Spectrum5_001428, D0H0ND, AC1L1H1F, SCHEMBL2471, CHEMBL1064, BSPBio_000909, BSPBio_002337, KBioGR_001244, KBioSS_002197, MLS001304029, MLS001333077, MLS001333078, MLS002154038, MLS006011866, ARONIS24119, BIDD:GT0769, DivK1c_006991, Simvastatin (JAN/USP/INN), SPECTRUM1504236, SPBio_001881, SPBio_002830, BPBio1_001001, GTPL2955, Simvastatin (JP17/USP/INN), Simvastatin, analytical standard, DTXSID0023581, BCBcMAP01_000007, KBio1_001935, KBio2_002197, KBio2_004765, KBio2_007333, KBio3_001557, RYMZZMVNJRMUDD-HGQWONQESA-, MolPort-002-507-345, HMS1570N11, HMS1922H13, HMS2089D12, HMS2093E06, HMS2097N11, HMS2231N22, HMS3259B12, HMS3714N11, Pharmakon1600-01504236, ZINC3780893, Tox21_110696, Tox21_300400, BBL024390, BDBM50139181, CCG-39069, MFCD00072007, NSC633782, NSC758706, s1792, SBB080618, STK801938, AKOS005111006, AKOS015842733, Simvastatin, >=97% (HPLC), solid, Tox21_110696_1, AC-1530, AN-7250, AT-7048, CS-2269, DB00641, MCULE-8390617062, NC00719, NSC-633782, NSC-758706, MRF-0000729, NCGC00017324-01, NCGC00017324-02, NCGC00017324-03, NCGC00017324-04, NCGC00017324-05, NCGC00017324-07, NCGC00017324-08, NCGC00254418-01, AJ-45588, BC203244, CPD000718785, HY-17502, LS-46264, SAM002589969, SC-12666, ST057168, SBI-0206773.P001, AB0069097, ST2407853, D00434, J10128, W-3044, 28049-EP2269989A1, 28049-EP2269990A1, 28049-EP2270011A1, 28049-EP2270505A1, 28049-EP2272825A2, 28049-EP2272841A1, 28049-EP2277865A1, 28049-EP2280001A1, 28049-EP2280006A1, 28049-EP2281813A1, 28049-EP2284158A1, 28049-EP2287165A2, 28049-EP2287166A2, 28049-EP2292620A2, 28049-EP2295406A1, 28049-EP2295409A1, 28049-EP2295417A1, 28049-EP2295422A2, 28049-EP2298731A1, 28049-EP2298742A1, 28049-EP2298745A1, 28049-EP2298769A1, 28049-EP2298772A1, 28049-EP2298776A1, 28049-EP2298779A1, 28049-EP2301923A1, 28049-EP2301931A1, 28049-EP2301936A1, 28049-EP2305219A1, 28049-EP2305648A1, 28049-EP2308839A1, 28049-EP2308878A2, 28049-EP2314588A1, 96639-EP2287163A1, 96639-EP2305678A1, 99548-EP2270011A1, 99548-EP2298779A1, 99548-EP2301923A1, 99548-EP2301931A1, AB00053395-07, AB00053395-08, AB00053395-10, AB00053395_11, AB00053395_13, 902S639, SR-05000001894-1, SR-05000001894-2, BRD-K22134346-001-05-8, BRD-K22134346-001-11-6, BRD-K22134346-001-15-7, Z1741982918, Simvastatin, British Pharmacopoeia (BP) Reference Standard, Simvastatin, European Pharmacopoeia (EP) Reference Standard, Simvastatin, United States Pharmacopeia (USP) Reference Standard, Zocor, Simlup, Simcard, Simvacor, Simvoget, Zorced, Simvastatin, Simvastatin, Pharmaceutical Secondary Standard; Certified Reference Material, Simvastatin for peak identification, European Pharmacopoeia (EP) Reference Standard, (1S,3R,7S,8S,8aR)-1,2,3,7,8,8a-Hexahydro-3,7-dimethyl-8-[2-[(2R,4R)-tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl]ethyl]-1-naphthalenyly-2,2-dimethyl butanoate, (1S,3R,7S,8S,8aR)-8-(2-((2R,4R)-4-Hydroxy-6-oxotetrahydro-2H-pyran-2-yl)ethyl)-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl 2,2-dimethylbu, (1S,7S,8S,8aR)-8-{2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl}-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl 2,2-dimethylbutanoate, InChI=1/C25H38O5/c1-6-25(4,5)24(28)30-21-12-15(2)11-17-8-7-16(3)20(23(17)21)10-9-19-13-18(26)14-22(27)29-19/h7-8,11,15-16,18-21,23,26H,6,9-10,12-14H2,1-5H3/t15-,16-,18+,19+,20-,21-,23-/m0/s1


ID: 2043

chemical graph of compound 2043



InChIKey: RZAMWZFIYNLWRM-UHFFFAOYSA-N
SMILES: C(C1=C(C)C=CS1)1C(C(=O)OCC)=C(C)NC(C)=C1C(=O)OCC

biological descriptors:

CFTR relevance: CFTR activator

Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown

reference list:

"P Fossa" "N Pedemonte" "LJ Galietta" "M Giampieri" "F Cateni" "M Mazzei" "MT Mazzei" "M Zacchigna"


CID is 741915
synonyms found at PubChem are:
SMR000176561, AC1LEU12, Oprea1_492418, Oprea1_623849, MLS000551988, CHEMBL594099, CHEMBL1506056, MolPort-001-956-785, HMS2366P22, AKOS000531381, ZINC100098559, MCULE-7304301475, BAS 01152205, ST50562895, SR-01000425624, SR-01000425624-1, diethyl 2,6-dimethyl-4-(3-methyl-2-thienyl)-1,4-dihydro-3,5-pyridinedicarboxylate, diethyl 2,6-dimethyl-4-(3-methylthiophen-2-yl)-1,4-dihydropyridine-3,5-dicarboxylate, 2,6-Dimethyl-4-(3-methyl-2-thienyl)-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester, 2,6-Dimethyl-4-(3-methyl-thiophen-2-yl)-1,4-dihydro-pyridine-3,5-dicarboxylic acid diethyl ester, ethyl 5-(ethoxycarbonyl)-2,6-dimethyl-4-(3-methyl(2-thienyl))-1,4-dihydropyrid ine-3-carboxylate


ID: 2044

chemical graph of compound 2044



InChIKey: RZCJLMTXBMNRAD-UHFFFAOYSA-N
SMILES: CC(CC1=CC=C(C=C1)O)N.Br

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 9377
synonyms found at PubChem are:
HYDROXYAMPHETAMINE HYDROBROMIDE, Predrolon, Mycadrine, Paredrine hydrobromide, p-Hydroxyamphetamine hydrobromide, 4-(2-Aminopropyl)phenol hydrobromide, 306-21-8, Hydroxyamfetamin hydrobromid, (+-)-Paredrine hydrobromide, EINECS 206-181-4, NSC 61065, 2-Amino-1-(4-hydroxyphenyl)propane hydrobromide, 3-(p-Hydroxyphenyl)-2-aminopropane hydrobromide, dl-p-(2-Aminopropyl)phenol hydrobromide, Phenol, 4-(2-aminopropyl)-, hydrobromide, (+-)-p-(2-Aminopropyl)phenol hydrobromide, 1-p-Hydroxyphenyl-2-aminopropane hydrobromide, beta-(p-Hydroxyphenyl)isopropylamine hydrobromide, Phenol, p-(2-aminopropyl)-, hydrobromide, (+-)-, Hydroxyamphetamine hydrobromide [USP], NCGC00095233-01, Phenol, p-(2-aminopropyl)-, hydrobromide, hydroxyamfetamine hydrobromide, Hydroxyamphetamine hydrobromide (USP), Paredrine (TN), Phenol, hydrobromide, 4-(2-aminopropyl)ph |nol bromhydrate, component of Paredrine, AC1L1SWY, C9H13NO.HBr, D0W1RY, AC1Q23OC, cid_9377, Hyroxyamfetamine hydrobromide, DSSTox_CID_25961, DSSTox_RID_81257, DSSTox_GSID_45961, SPECTRUM211425, MLS002320672, MLS002320674, SCHEMBL221647, 103-86-6 (Parent), CHEMBL1200705, DTXSID0045961, OXAMPHETAMINE HYDROBROMIDE, CTK4G5491, WLN: ZY1&1R DQ &EH, RZCJLMTXBMNRAD-UHFFFAOYSA-N, HMS1923C15, Pharmakon1600-00211425, NSC61065, Tox21_111487, NSC-61065, NSC760066, p-(2-Aminopropyl)phenol hydrobromide, p-(2-Aminopropyl)phenyl hydrobromide, (+)-4-Hydroxyamphetamine hydrobromide, CCG-213716, NSC-760066, (+/-)-4-Hydroxyamphetamine hydrobromide, NCGC00095233-02, 140-36-3, CAS-306-21-8, SMR001338818, SMR001338820, LS-103951, LS-103952, D04473, Phenol,4-(2-aminopropyl)-, hydrobromide (1:1), .beta.-(p-Hydroxyphenyl)isopropylamine hydrobromide, rac. 4-hydroxy-alpha-methylphenethylamine hydrobromide, AC1LAP2W, 2-Propanamine, 1-(4-hydroxyphenyl)-, hydrobromide, 1-(4-hydroxyphenyl)propan-2-ylazanium bromide


ID: 2045

chemical graph of compound 2045



InChIKey: RZEKVGVHFLEQIL-UHFFFAOYSA-N
SMILES: CC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 2662
synonyms found at PubChem are:
celecoxib, Celebrex, 169590-42-5, Celebra, Onsenal, Celocoxib, Celecox, SC 58635, Xilebao, YM177, SC-58635, 4-[5-(4-METHYLPHENYL)-3-(TRIFLUOROMETHYL)-1H-PYRAZOL-1-YL]BENZENESULFONAMIDE, Celecoxib [USAN], Celecoxib [Old RN], YM 177, Celecoxibum, Celecoxi, Solexa, 184007-95-2, HSDB 7038, UNII-JCX84Q7J1L, Celebrex (TN), C17H14F3N3O2S, p-(5-p-Tolyl-3-(trifluoromethyl)pyrazol-1-yl)benzenesulfonamide, 4-[5-(4-methylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide, 4-(5-(4-Methylphenyl)-3-(trifluoromethyl)-1H-pyrazol-1-yl)benzenesulfonamide, YM-177, CHEMBL118, SC58635, JCX84Q7J1L, Celecoxib (SC-58635), Celecoxib (JAN/USAN/INN), 4-[5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyrazol-1-yl]benzene-1-sulfonamide, CHEBI:41423, TPI-336, RZEKVGVHFLEQIL-UHFFFAOYSA-N, AI-525, CEP-33222, NCGC00091455-01, DSSTox_CID_2777, SC-58553, SC-58635, 4-[5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyrazol-1-yl]-benzenesulfonamide, benzenesulfonamide, 4-[5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyrazol-1-yl]-, DSSTox_RID_76725, DSSTox_GSID_22777, 194044-54-7, 4-[5-(p-tolyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide, 4-(5-(p-tolyl)-3-(trifluoromethyl)-1H-pyrazol-1-yl)benzenesulfonamide, 4-[5-(4-methylphenyl)-3-(trifluoromethyl)-1Hpyrazol-1-yl] benzenesulfonamide, Benzenesulfonamide, 4-(5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyrazol-1-yl)-, Benzenesulfonamide,4-(5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyrazol-1-yl), SMR000550473, CAS-169590-42-5, SR-01000837528, Eurocox, Medicoxib, Celecoxib [USAN:INN:BAN], CCRIS 8679, CCRIS 9330, Celebra (TN), Onsenal (TN), CELEBCOXIB, Spectrum_000432, 1oq5, Pfizer brand of celecoxib, Spectrum2_001576, Spectrum3_001996, Spectrum4_000182, Spectrum5_001324, D03RTS, AC1L1E6K, Celecoxib/Celebrex, Celebra, cid_2662, SCHEMBL3708, BSPBio_003596, Celebrex, Celebra, Celecoxib, KBioGR_000723, KBioGR_002351, KBioSS_000912, KBioSS_002354, MLS001165684, MLS001195656, MLS001304708, MLS006011862, BIDD:GT0408, DivK1c_000893, SPECTRUM1503678, SPBio_001512, GTPL2892, Celecoxib, >=98% (HPLC), DTXSID0022777, BDBM11639, CTK8H4475, HMS502M15, KBio1_000893, KBio2_000912, KBio2_002351, KBio2_003480, KBio2_004919, KBio2_006048, KBio2_007487, KBio3_002830, KBio3_003037, EX-A175, SYN3015, cMAP_000027, MolPort-002-885-815, NINDS_000893, BCPP000290, HMS1922G14, HMS2089L18, HMS2093I07, HMS2234N18, HMS3259L08, HMS3261A14, HMS3373A09, HMS3654H09, HMS3715F11, Pharmakon1600-01503678, ACT02648, BCP02156, EBD24636, KS-00000FW2, ZINC2570895, Tox21_111135, Tox21_201964, Tox21_300599, Tox21_500406, US8741944, Comparative Compound, ABP000291, BBL029086, CCG-39354, MFCD00941298, NSC719627, NSC758624, s1261, STL373576, Celecoxib 1.0 mg/ml in Acetonitrile, AKOS015842517, Tox21_111135_1, AC-4228, AM84588, AT-3762, BCP9000507, Celebrex, Celebra, 169590-42-5, CS-0570, DB00482, KS-1041, MCULE-4750749400, NC00708, NSC-719627, NSC-758624, RL02184, IDI1_000893, NCGC00091455-02, NCGC00091455-03, NCGC00091455-04, NCGC00091455-05, NCGC00091455-06, NCGC00091455-07, NCGC00091455-08, NCGC00091455-09, NCGC00091455-13, NCGC00254540-01, NCGC00259513-01, NCGC00261091-01, AN-12211, BC209720, BP-30217, CPD000550473, HY-14398, KB-76000, LS-31667, NCI60_041049, PHA-00846533, SAM002589995, SC-50829, SBI-0051875.P002, AB0012055, CJ-016377, CP-598107, TL8001323, UNM-0000305813, FT-0080064, FT-0601628, FT-0623536, FT-0700357, PF-00345549, A25046, C-6317, C07589, D00567, J10035, AB00052396-07, AB00052396-08, AB00052396-09, AB00052396_10, AB00052396_11, Celecoxib|169590-42-5|Celebrex|SC 58635, 590C425, I01-1033, J-010566, J-520011, Q-200816, SR-01000837528-2, SR-01000837528-3, BRD-K02637541-001-02-4, BRD-K02637541-001-06-5, Z2210694606, Celecoxib, European Pharmacopoeia (EP) Reference Standard, Celecoxib, United States Pharmacopeia (USP) Reference Standard, 4-[5-(4-Methylphenyl)-3-(trifluoromethyl)-pyrazol-1-yl]benzenesulfonamide, 5-(4-Methylphenyl)-1-(4-sulfamoylphenyl)-3-(trifluoromethyl)pyrazole, Celecoxib, Pharmaceutical Secondary Standard; Certified Reference Material, Benzenesulfonamide,4-[5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyrazol-1-yl]-


ID: 2046

chemical graph of compound 2046



InChIKey: RZFNKJVCPDLQQA-UHFFFAOYSA-N
SMILES: CCN(CC)CCCC(C)NC1=C2C=C(C=CC2=NC3=C1C=CC(=C3)Cl)OC.O.O.Cl.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 2725002
synonyms found at PubChem are:
Quinacrine dihydrochloride dihydrate, 6151-30-0, Chemiochin, Malaricida, Methoquine, Mecryl, Erion, Quinacrine HCl, Quinacrine hydrochloride, Mepacrine hydrochloride, acrichine, Atabrine dihydrochloride, Atabrine hydrochloride dihydrate, Mepacrine hydrochloride dihydrate, Quinacrine hydrochloride dihydrate, Mepacrine HCl, 6-Chloro-9-((4-(diethylamino)-1-methylbutyl)amino)-2-methoxyacridine dihydrochloride dihydrate, DSSTox_CID_25565, DSSTox_RID_80962, DSSTox_GSID_45565, 83-89-6 (Parent), 6-Chloro-9-((4-(diethylamino)-1-methylbutyl) amino)-2-methoxyacridine dihydrochloride, 1,4-Pentanediamine, N(sup 4)-(6-chloro-2-methoxy-9-acridinyl)-N(sup 1),N(sup 1)-diethyl-, dihydrochloride, dihydrate, Acridine, 6-chloro-9-((4-(diethylamino)-1-methylbutyl)amino)-2-methoxy-, dihydrochloride, dihydrate, CCRIS 8684, Quinacrine hydrochloride [USP], NCGC00017057-01, Prestwick_650, CAS-6151-30-0, AC1MBFYF, C23H36Cl3N3O3, CHEMBL2105615, DTXSID8045565, MolPort-018-655-037, C23H30ClN3O.2HCl.2H2O, HMS1568P18, quinacrine dihydrate dihydrochloride, Tox21_110762, Quinacrine Dihydrochloride, Dihydrate, AKOS004910405, Tox21_110762_1, API0004011, CCG-220318, NCGC00015874-05, AC-22752, LS-14294, FT-0698684, 4-N-(6-chloro-2-methoxyacridin-9-yl)-1-N,1-N-diethylpentane-1,4-diamine dihydrate dihydrochloride, Acridine, 6-chloro-9-((4-(diethylamino)-1-methylbutyl)amino)-2-methoxy-, dihydrochloride,dihydrate, AKOS015901751, I14-14286


ID: 2047

chemical graph of compound 2047



InChIKey: RZFVLEJOHSLEFR-UHFFFAOYSA-N
SMILES: C1=CC=C2C(=C1)C3=CC=CC=C3NC2=O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 1853
synonyms found at PubChem are:
6(5H)-Phenanthridinone, 1015-89-0, Phenanthridin-6(5H)-one, Phenanthridone, 6-Phenanthridinol, 6-(5H)-phenanthridinone, 6-Phenanthridinone, 6-Phenanthridone, 5H-phenanthridin-6-one, 6(5H)-Phenanthridone, Phenantridone, phenanthridin-6-ol, Phenanthridone (misnomer), 5,6-dihydrophenanthridin-6-one, 6(5H)-Phenantridinone, UNII-AVQ13AUB5J, NSC 11021, NSC 40943, NSC 61083, CCRIS 2978, EINECS 213-804-3, AVQ13AUB5J, CHEMBL45245, AI3-16988, CHEBI:75292, RZFVLEJOHSLEFR-UHFFFAOYSA-N, F3193-0003, SR-01000076089, 4avu, 6-hydroxyphenanthridine, ACMC-1BQKN, AC1L1CDU, AC1Q1HKG, AC1Q6GQP, Maybridge1_005473, Lopac-P-8852, 6 (5H)-Phenanthridinone, 5-hydrophenanthridin-6-one, Lopac0_000994, Oprea1_280753, Oprea1_801444, SCHEMBL17293, BSPBio_001022, KBioGR_000362, KBioSS_000362, KSC153O0N, MLS000681669, DivK1c_001761, DTXSID0074423, 5H-Phenanthridin-6-one (PTD), BCBcMAP01_000038, BDBM27500, HMS557A17, KBio2_000362, KBio2_002930, KBio2_005498, KBio3_000703, KBio3_000704, MolPort-000-876-028, MolPort-001-016-024, Bio1_000401, Bio1_000890, Bio1_001379, Bio2_000351, Bio2_000831, HMS1362D03, HMS1792D03, HMS1990D03, HMS2588H14, HMS3263G09, HMS3403D03, ACT09372, ALBB-023266, EBD51560, KS-00000FC5, NSC11021, NSC40943, NSC61083, ZINC8580818, Tox21_500994, ANW-14492, BBL034640, CCG-15140, MFCD00004988, NSC-11021, NSC-40943, NSC-61083, SBB076279, STL426846, STL426852, 6(5H)-Phenanthridinone, 96% 1g, AKOS002287896, AKOS003245230, DS-0778, LP00994, MCULE-7620392745, RP25373, CDS1_000721, IDI1_002106, NCGC00015852-01, NCGC00015852-02, NCGC00015852-03, NCGC00015852-04, NCGC00015852-05, NCGC00015852-06, NCGC00094290-01, NCGC00094290-02, NCGC00094290-03, NCGC00261679-01, AJ-57665, AN-48322, BR-32173, CJ-13252, EN002717, SC-29255, SMR000312353, 6-(5H)-Phenanthridinone, technical grade, AB0034412, DB-007109, LS-102982, 4CH-006771, AM20070167, CS-0019648, EU-0100994, FT-0081345, FT-0620806, P1998, ST45024582, X8565, EN300-36056, P 8852, S-1687, 015P890, CU-00000000136-1, J-518037, SR-01000076089-1, SR-01000076089-2, BRD-K11163873-001-02-8, I14-51197, Z275368072


ID: 2048

chemical graph of compound 2048



InChIKey: RZJQGNCSTQAWON-UHFFFAOYSA-N
SMILES: CS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)OC2)C3=CC=CC=C3

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5090
synonyms found at PubChem are:
rofecoxib, 162011-90-7, Vioxx, Ceoxx, MK 966, 4-[4-(methylsulfonyl)phenyl]-3-phenylfuran-2(5H)-one, 4-(4-(Methylsulfonyl)phenyl)-3-phenylfuran-2(5H)-one, MK 0966, 4-[4-(methylsulfonyl)phenyl]-3-phenyl-2(5H)-furanone, MK-966, MK-0966, UNII-0QTW8Z7MCR, 3-(4-methylsulfonylphenyl)-4-phenyl-2H-furan-5-one, Vioxx (trademark), MK0966, Rofecoxib (Vioxx), CCRIS 8967, Vioxx (TN), HSDB 7262, MK 996, 0QTW8Z7MCR, CHEMBL122, 4-(4-methylsulfonylphenyl)-3-phenyl-5H-furan-2-one, Rofecoxib (JAN/USAN/INN), 3-phenyl-4-[4-(methylsulfonyl)phenyl]-2(5H)-furanone, 4-(4-(Methylsulfonyl)phenyl)-3-phenyl-2(5H)-furanone, 3-Phenyl-4-(4-(methylsulfonyl)phenyl))-2(5H)-furanone, CHEBI:8887, C17H14O4S, RZJQGNCSTQAWON-UHFFFAOYSA-N, 4-(p-(Methylsulfonyl)phenyl)-3-phenyl-2(5H)-furanone, KS-1107, MK 0996, NCGC00095118-01, 2(5H)-Furanone, 4-(4-(methylsulfonyl)phenyl)-3-phenyl-, 2(5H)-Furanone, 4-[4-(methylsulfonyl)phenyl]-3-phenyl-, refecoxib, 4-(4-METHANESULFONYL-PHENYL)-3-PHENYL-5H-FURAN-2-ONE, Vioxx Dolor, 186912-82-3, SMR000466331, SR-01000762904, ceeoxx, rofecoxibum, Rofecoxib [USAN:INN:BAN], Ceeoxx (TN), Ceoxx (TN), 544684-93-7, MSD brand of rofecoxib, PubChem15028, Spectrum_000119, SpecPlus_000669, Merck brand of rofecoxib, Spectrum2_000446, Spectrum3_001153, Spectrum4_000631, Spectrum5_001598, DSSTox_CID_3567, D05VLS, AC1L1JL6, SCHEMBL3050, DSSTox_RID_77084, DSSTox_GSID_23567, BSPBio_002705, KBioGR_001242, KBioGR_002345, KBioSS_000559, KBioSS_002348, MLS000759440, MLS001165770, MLS001195623, MLS001424113, MLS006010091, BIDD:GT0399, DivK1c_006765, Merck Frosst brandof rofecoxib, SPECTRUM1504235, SPBio_000492, 3-(4-methanesulfonylphenyl)-2-phenyl-2-buten-4-olide, GTPL2893, ZINC7455, Jsp003237, DTXSID2023567, BDBM22369, KBio1_001709, KBio2_000559, KBio2_002345, KBio2_003127, KBio2_004913, KBio2_005695, KBio2_007481, KBio3_002205, KBio3_002825, KS-00000XKS, AOB6956, EX-A708, TRM-201, cMAP_000024, MolPort-000-883-878, MolPort-006-817-786, HMS1922H11, HMS2051G16, HMS2089H20, HMS2093E04, HMS2232G21, HMS3371P11, HMS3393G16, HMS3651F16, HMS3713B07, MK966, Pharmakon1600-01504235, BCP03619, EBD34785, Tox21_111430, ANW-71936, CCG-40253, NSC720256, NSC758705, s3043, STK635144, Cahill May Roberts brand of rofecoxib, AKOS000280931, AB07701, CS-0997, DB00533, MCULE-4806636118, NC00132, NSC-720256, NSC-758705, VA11689, Merck Sharp & Dhome brand of rofecoxib, NCGC00095118-02, NCGC00095118-03, NCGC00095118-04, NCGC00095118-05, NCGC00095118-08, AC-28318, AJ-08299, AN-25306, CPD000466331, HY-17372, LS-70511, NCI60_041175, SAM001246617, SC-17320, ZB000656, SBI-0206774.P001, AB0012045, RT-016235, ST2410970, CAS-162011-90-7, FT-0081390, FT-0631192, R0206, C07590, D00568, J10420, K-5064, AB00052090-06, AB00052090-08, AB00052090_09, AB00052090_10, 011R907, A810324, L000912, I01-1042, Q-201676, SR-01000762904-3, SR-01000762904-5, BRD-K21733600-001-02-6, BRD-K21733600-001-06-7, 3-(4-methanesulfonyl-phenyl)-2-phenyl-2-buten-4-olide, 2(5H)-Furanone, 4-[4-(methyl-sulfonyl)phenyl]-3-phenyl-, 3-(Phenyl)-4-(4-(methylsulfonyl)phenyl)-2-(5H)-furanone, 3-Phenyl-4-(4-(Methylsulfonyl)Phenyl)-2-(5H)-Furanone, 4-(4-methanesulfonylphenyl)-3-phenyl-2,5-dihydrofuran-2-one, Vioxx; 4-[4-(Methylsulfonyl)phenyl]-3-phenylfuran-2(5H)-one


ID: 2049

chemical graph of compound 2049



InChIKey: RZRPTBIGEANTGU-IRIMSJTPSA-N
SMILES: C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2C(=O)C[C@]4([C@H]3CCC4=O)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 223997
synonyms found at PubChem are:
ADRENOSTERONE, 382-45-6, Androst-4-ene-3,11,17-trione, Reichstein's substance G, Andrenosterone, 11-Oxy-4-androstenedione, 11-Oxoandrostenedione, 4-Androstene-3,11,17-trione, 11-Ketoandrostenedione, 11-Keto-androstenedione, UNII-AE4E9102GY, 11-OXO, NSC 12166, MLS000028712, AE4E9102GY, CHEBI:2495, RZRPTBIGEANTGU-IRIMSJTPSA-N, 11-oxoandrost-4-ene-3,17-dione, SMR000059216, 17-Ketosteroid, 4-Androsten-3,11,17-trione, adrenoterone, Adrenosteron, EINECS 206-843-2, Adrenosterone, 98%, AC1L5CYX, Opera_ID_1090, Prestwick0_000899, Prestwick1_000899, Prestwick2_000899, Prestwick3_000899, bmse000522, BSPBio_000718, MLS001146874, Androst-4-ene-3,17-trione, SCHEMBL329751, SPBio_002927, BPBio1_000790, CHEMBL485683, CTK1C2623, MolPort-002-070-296, 11-oxo4-androstene-3,17-dione, HMS1570D20, HMS2097D20, HMS2231O24, HMS3714D20, NSC12166, ZINC4096672, ANW-43469, NSC-12166, AKOS015919184, ACN-032044, CCG-220899, CS-1756, NCGC00179466-01, 911474-75-4, HY-17462, TL8002799, TR-031599, AB00513953, C05285, SR-01000721947, Q-200602, SR-01000721947-3, BRD-K17368287-001-03-5, 793B9701-82B7-46F0-BDC7-04C33B82723A, (1S,2R,10S,11S,15S)-2,15-dimethyltetracyclo[8.7.0.0;{2,7}.0;{11,15}]heptadec-6-ene-5,14,17-trione, (8S,9S,10R,13S,14S)-10,13-dimethyl-1,2,6,7,8,9,12,14,15,16-decahydrocyclopenta[a]phenanthrene-3,11,17-trione, 2,5,8(6H)-Chrysenetrione, 7-((acetyloxy)methyl)-3,4,4a,4b,6a,7,9,10,10a,10b,11,12-dodecahydro-7-hydroxy-4a,6a-dimethyl-, (4aR,4bS,6aS,7R,10aS,10bS)-, 293738-14-4


ID: 2050

chemical graph of compound 2050



InChIKey: RZTAMFZIAATZDJ-UHFFFAOYSA-N
SMILES: CCOC(=O)C1=C(NC(=C(C1C2=C(C(=CC=C2)Cl)Cl)C(=O)OC)C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3333
synonyms found at PubChem are:
felodipine, 72509-76-3, Plendil, Flodil, Renedil, Feloday, Munobal, Splendil, dl-Felodipine, Perfudal, Prevex, Hydac, Modip, Agon, Felodipina, Plendil ER, Felodipinum, Felogard, Penedil, Preslow, Munobal Retard, Plendil Retard, Plendil Depottab, Lexxel, Felodipinum [INN-Latin], Felodipina [INN-Spanish], Felodur ER, AGON SR, Plandil, 3-ethyl 5-methyl 4-(2,3-dichlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate, Felodipine [USAN:BAN:INN], Logimax, 86189-69-7, C18H19Cl2NO4, Plendil (TN), Felodipine [USAN:INN:BAN], Felodipine (Plendil), H 154/82, BRN 4331472, H-154/82, Felodipine (JAN/USP/INN), (+-)-Ethyl methyl 4-(2,3-dichlorophenyl)-1,4-dihydro-2,6-dimethyl-3,5-pyridinedicarboxylate, MLS000069629, CGH-869, CHEBI:585948, RZTAMFZIAATZDJ-UHFFFAOYSA-N, H 154-82, 4-(2,3-dichlorophenyl)-1,4-dihydro-2,6-dimethyl-3,5-pyridinedicarboxylic acid ethyl methyl ester, 5-O-ethyl 3-O-methyl 4-(2,3-dichlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate, 3,5-Pyridinedicarboxylic acid, 4-(2,3-dichlorophenyl)-1,4-dihydro-2,6-dimethyl-, ethyl methyl ester, NCGC00015455-03, SMR000058204, DSSTox_CID_3042, F 9677, 3-Ethyl 5-methyl 4-(2,3-dichlorophenyl)-2,6-dimethyl-1,4-dihydro-3,5-pyridinedicarboxylate, 4-(2,3-Dichlorophenyl)-1,4-dihydro-2,6-dimethyl-3,5-pyridinecarboxylic acid ethyl methyl ester, DSSTox_RID_76848, ethyl methyl 4-(2,3-dichlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate, DSSTox_GSID_23042, AE-641/11429675, Felobeta, Felocor, Felodur, Felogamma, Fensel, Felodipin dura, Felo Biochemie, Felodipin Stada, Felodipin AbZ, Felo Puren, Felo-Puren, felodipin von ct, Felodipin AZU, Felodipin Heumann, Ethyl methyl 4-(2,3-dichlorophenyl)-1,4-dihydro-2,6-dimethyl-3,5-pyridinedicarboxylate, O5-ethyl O3-methyl 4-(2,3-dichlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate, Heumann, Felodipin, 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-4-(2,3-dichlorophenyl)-2,6-dimethyl-, ethyl methyl ester, 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-4-(2,3-dichlorophenyl)-2,6-dimethyl-,ethyl methyl ester, 3,5-Pyridinedicarboxylic acid, 4-(2,3-dichlorophenyl)-1,4-dihydro-2,6-dimethyl-, ethyl methyl ester, (+-)-, 4-(2,3-dichloro-phenyl)-2,6-dimethyl-1,4-dihydro-pyridine-3,5-dicarboxylic acid 3-ethyl ester 5-methyl ester, Felodipin ratiopharm, Felodipin-ratiopharm, (R)-(+)-Felodipine, (S)-(-)-Felodipine, Felodipin 1A Pharma, SR-01000075890, FelodurER, Felodipine, solid, Felodipine,(S), (RS)-Felodipine, Felodipine [USAN:USP:INN:BAN], 3,5-dicarboxylate, Prestwick_797, CAS-72509-76-3, (+/-)-felodipine, Felodipine (dl form), PubChem15919, Renedil;Feloday;Plendil, BC Brand of Felodipine, 1A Brand of Felodipine, AbZ Brand of Felodipine, Opera_ID_1873, Prestwick0_000478, Prestwick1_000478, Prestwick2_000478, Prestwick3_000478, (.+/-.)-Felodipine, Aliud Brand of Felodipine, Astra Brand of Felodipine, Hexal Brand of Felodipine, D0WN0U, Promed Brand of Felodipine, Worwag Brand of Felodipine, AC1L1FP2, AC1Q32PZ, Aventis Brand of Felodipine, Heumann Brand of Felodipine, Hoechst Brand of Felodipine, Alpharma Brand of Felodipine, CHEMBL1480, H 15482, Lopac0_000508, SCHEMBL26398, betapharm Brand of Felodipine, BSPBio_000616, Azupharma Brand of Felodipine, MLS001077361, MLS001333735, MLS002153409, MLS002153832, MLS003876820, BIDD:GT0733, ratiopharm Brand of Felodipine, Alphapharm Brand of Felodipine, H 154 82, SPBio_002555, Stadapharm Brand of Felodipine, TheraPharm Brand of Felodipine, Merck dura Brand of Felodipine, AstraZeneca Brand of Felodipine, BPBio1_000678, GTPL4190, CHEMBL3196476, DTXSID4023042, SCHEMBL13460298, CTK8B3303, MolPort-002-801-136, BDBM189379, HMS1569O18, HMS2089J05, HMS2096O18, HMS2232D24, HMS3259F12, HMS3261F17, HMS3651O21, HMS3713O18, Pharmacia Spain Brandof Felodipine, Pharmakon1600-01505887, 105618-03-9, 119945-59-4, BCP02192, ct Arzneimittel Brand of Felodipine, ct-Arzneimittel Brand of Felodipine, HY-B0309, KS-000001QR, 2,6-dimethyl-1,4-dihydropyridine-, Tox21_110155, Tox21_500508, ANW-42236, MFCD00868316, NSC760343, s1885, AKOS015891545, Plendil, Renedil, Feloday, Felodipine, Tox21_110155_1, AC-2124, BCP9000680, CCG-204599, CS-2348, DB01023, KS-1264, LP00508, MCULE-8253440089, NC00721, NSC-760343, Pharmaceutica Astra Brand of Felodipine, ( inverted exclamation markA)-Felodipine, NCGC00015455-04, NCGC00015455-05, NCGC00015455-06, NCGC00015455-07, NCGC00015455-08, NCGC00015455-10, NCGC00024087-02, NCGC00093906-01, NCGC00093906-02, NCGC00261193-01, AC-24403, AN-14248, AN-35618, BC203911, CPD002529504, K235, KB-51851, SAM002589971, SC-12116, SMR002529504, AB0014113, AB2000349, LS-131202, 3-ethyl 5-methyl 4-(2,3-dichlorophenyl)-, EU-0100508, F0814, FT-0626393, FT-0660933, EN300-70726, D00319, S-8162, 509F763, 72509-76-3 pound>>86189-69-7, I14-9560, SR-01000075890-1, SR-01000075890-4, BRD-A30815329-001-03-0, Z239864852, Felodipine, European Pharmacopoeia (EP) Reference Standard, Felodipine, United States Pharmacopeia (USP) Reference Standard, (+/-) ethyl methyl 4-(2,3-dichlorophenyl)-1,4-dihydro-2,6-dimethyl-3,5-pyridinedicarboxylate, (+/-)-ethylmethyl 4-(2,3-dichlorophenyl)-1,4-dihydro-2,6-dimethyl-3,5-pyridinedicarboxylate, (.+/-.) Ethyl methyl 4-(2,3-dichlorophenyl)-1,4-dihydro-2,6-dimethyl-3,5-pyridinedicarboxylate, 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-4-(2,3-dichlorophenyl)-2,6-dimethyl-, ethyl methylester, 3,5-pyridinedicarboxylic acid, 4-(2,3-dichlorophenyl)-1,4-dihydro-2,6-dimethyl-,ethyl methyl ester, (+-)-, 3-Ethyl 5-methyl 4-(2,3-dichlorophenyl)-2,6-dimethyl-1,4-dihydro-3,5-pyridinedicarboxylate #, 4-(2,3-DICHLOROPHENYL)-1,4-DIHYDRO- 2,6-DIMETHYL-3,5-PYRIDINEDICARBOXYLIC ACID ETHYL METHYL ESTER, Ethyl methyl (4RS)-4-(2,3-dichlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate


ID: 2051

chemical graph of compound 2051



InChIKey: RZVAJINKPMORJF-UHFFFAOYSA-N
SMILES: CC(=O)NC1=CC=C(C=C1)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 1983
synonyms found at PubChem are:
acetaminophen, Paracetamol, 4-Acetamidophenol, 103-90-2, Tylenol, N-(4-Hydroxyphenyl)acetamide, APAP, Acetaminofen, Panadol, Datril, p-Acetamidophenol, p-Hydroxyacetanilide, Algotropyl, N-Acetyl-p-aminophenol, Lonarid, Naprinol, 4'-Hydroxyacetanilide, p-Acetaminophenol, Acamol, Acenol, Anelix, Multin, Abensanil, Acetagesic, Acetalgin, Clixodyne, Gelocatil, Injectapap, Liquagesic, Pyrinazine, Servigesic, Alvedon, Anaflon, Apamide, Dymadon, Febridol, Febrilix, Febrolin, Finimal, Homoolan, Lestemp, Paracet, Tabalgin, Tralgon, Tussapap, Valadol, Valgesic, Alpiny, Amadil, Anhiba, Calpol, Dirox, Eneril, Fendon, Hedex, Lyteca, Pacemo, Panets, Parmol, Tapar, Tempra, Paracetamolo, Doliprane, Dolprone, Momentum, Ortensan, Paldesic, Acephen, Banesin, Captin, Disprol, Enelfa, Neopap, Salzone, Exdol, p-Acetylaminophenol, Febro-Gesic, NEBS, Acetamide, N-(4-hydroxyphenyl)-, Paracetamolum, Biocetamol, Dafalgan, Dolgesic, Elixodyne, Febrectal, Tempanal, Vermidon, Abenol, Apacet, Apadon, Cetadol, Fensum, Janupap, Minoset, Napafen, Neodol, Nobedon, Pacemol, Panodil, Parapan, Pedric, Phendon, Rounox, Suppap, Korum, Pinex, Temlo, 4-(Acetylamino)phenol, Ben-u-ron, Dial-A-Gesic, Anacin-3, Calmanticold, Codoliprane, Demogripal, Dolegrippin, Doloreduct, Dristancito, Duracetamol, Eu-Med, Grippostad, Gynospasmine, Medocodene, Paedialgon, Paracetanol, Parakapton, Pediapirin, Phenipirin, Phogoglandin, Predualito, Sanicopyrine, Scentalgyl, Sunetheton, Tachiprina, Termalgine, Treuphadol, Abrolet, Acertol, Acetaco, Acetamol, Acetofen, Afebrin, Afebryl, Aferadol, Algesidal, Algomol, Alpinyl, Analter, Antidol, Apitrelal, Atralidon, Babikan, Bacetamol, Cadafen, Calapol, Causalon, Cefalex, Codabrol, Codalgin, Codapane, Codicet, Codisal, Cofamol, Cosutone, Cuponol, Curadon, Custodial, Darocet, Daygrip, Deminofen, Democyl, Desfebre, Dimindol, Dolefin, Dolofugin, Dolorfug, Dolorstop, Dolotec, Dorocoff, Dularin, Durapan, Ecosetol, Excipain, Fanalgic, Farmadol, Febranine, Febrectol, Febricet, Febrinol, Fepanil, Finiweh, Fluparmol, Geluprane, Ildamol, Inalgex, Infadrops, Kataprin, Labamol, Lekadol, Lemgrip, Lupocet, Magnidol, Malidens, Maxadol, Mexalen, Minafen, Miralgin, Nealgyl, Neodolito, Neotrend, Neuridon, Nodolex, Oralgan, Oxycocet, Pacimol, Panacete, Panadeine, Panadiene, Panaleve, Panamax, Panasorbe, Panofen, Pantalgin, Paracemol, Paracenol, Paracetol, Paracin, Paracod, Paracodol, Parador, Paradrops, Paralen, Paralief, Paralink, Paralyoc, Paramol, Paramolan, Paranox, Parasedol, Parasin, Paraspen, Parcetol, Parogal, Pediatrix, Phenaphen, Piramin, Pirinasol, Polmofen, Predimol, Prontina, Puernol, Pulmofen, Pyrigesic, Pyromed, Remedol, Rivalgyl, Rubophen, Rupemol, Sanicet, Schmerzex, Sedalito, Semolacin, Seskamol, Setakop, Setamol, Sifenol, Sinaspril, Sinedol, Stanback, Stopain, Supofen, Tazamol, Termacet, Termalgin, Termofren, Titralgan, Tricoton, Upsanol, Utragin, Veralgina, Viruflu, Vivimed, Zatinol, Abrol, Algina, Anapap, Andox, Arfen, Asetam, Asomal, Aspac, Asplin, Benmyo, Curpol, Dhamol, Dolcor, Dolko, Dresan, Dypap, Febrex, Febrin, Lemsip, Malgis, Noral, Oltyl, Paceco, Pacet, Paedol, Painex, Pamol, Panex, Parake, Paroma, Plicet, Prodol, Reliv, Scanol, Setol, Sinmol, Tiffy, Tylex, Tylol, Tymol, Verpol, Volpan, Zolben, NeoCitran, NilnOcen, Nina, RubieMol, Vips, Supadol mono, Treupel mon, Bickie-mol, Fortalidon P, Gattaphen T, Gripin Bebe, Influbene N, Lonarid Mono, Lyteca Syrup, Panadeine Co, Dymadon Co, Toximer P, Treupel N, Accu-Tap, 4-Acetaminophenol, Helon N, Malex N, Spalt N, Tylex CD, acetaminophene, N-Acetyl-4-aminophenol, SK-Apap, Paracetamole, Aminofen, Conacetol, Darvocet, Empracet, Panasorb, Perfalgan, A-Per, Apamid, Atasol, Duaneo, Duorol, Ofirmev, Parelan, Prompt, Vicodin, 4-Hydroxyacetanilide, Fevor, Freka-cetamol, NAPAP, Codisal Forte, Croix Blanche, Dolorol Forte, Dymadon Forte, Junior Disprol, Kinder Finimal, Liquigesic Co, Mono Praecimed, Percocet-Demi, Perdolan Mono, Rockamol Plus, Viclor Richet, Actifed Plus, Kratofin simplex, Neo-Fepramol, Paracetamol AL, Paracetamol BC, Paracetamol DC, Paracetamol PB, Acetanilide, 4'-hydroxy-, Claradol Codeine, Geralgine-P, Melabon Infantil, Migraleve Yellow, Paracetamol Saar, Pyregesic-C, Anti-Algos, Para-Suppo, Pasolind N, Supramol-M, Fever All, No-Febril, Panado-Co, Para-Tabs, Paracetamol Hexal, Paracetamol Raffo, Paracetamol Rosch, Paracetamol Stada, Dol-Stop, Anadin dla dzieci, p-Hydroxyphenolacetamide, Percocet-5, Cod-Acamol Forte, Contra-Schmerz P, Hy-Phen, Medinol Paediatric, Paracetamol Basics, Panado-Co Caplets, Paracetamol von ct, Pe-Tam, Paracetamol Fecofar, Paracetamol Harkley, Paracetamol Heumann, Paracetamol Nycomed, Codral Pain Relief, Paracetamol Hanseler, Paracetamol Winthrop, Phenaphen W/Codeine, Spalt fur die nacht, A.F. Anacin, Capital with Codeine, Acetominophen, Paracetamol Genericon, Actamin, Anexsia, Butapap, Demilets, Endecon, Intensin, Naldegesic, Pasolind, Phrenilin, Redutemp, Resfenol, Robigesic, Sedapap, Theraflu, Triaprin, Tycolet, Valorin, Wygesic, Tencon, Allay, Bucet, Norco, Paracetamol Ratiopharm, Coricidin Sinus, Phrenilin Forte, Paracetamol Italfarmaco, Sudafed Sinus, Aceta Elixir, Coricidin D, Dafalgan Codeine, Quiet World, Paracetamol Antipanin P, St Joseph Aspirin-Free, Co-Gesic, Jin Gang, New Cortal for Children, INFANTS' FEVERALL, Synalgos-Dc-A, 4-acetylaminophenol, St. Joseph Fever Reducer, Midol Teen Formula, Paracetamol Dr. Schmidgall, Acetamide, N-(p-hydroxyphenyl)-, Aspirin-Free Anacin, Propacet 100, Children's Tylenol Chewable, NCI-C55801, Proval #3, PCM Paracetamol Lichtenstein, Dolene AP-65, Tylenol Allergy Sinus, p-(Acetylamino)phenol, Rhinex D-Lay Tablets, acetaminophenol, Midol Regular Strength, Paracetamol SmithKline Beecham, Scherzatabletten Rezeptur 534, Acetavance, Arthralgen, Paracetamolo [Italian], Percogesic with Codeine, Actimol, Anuphen, Calonal, Capital, Excedrin, Genapap, Liqiprine, Robitussin Night Relief, Tapanol, 4-Hydroxyanilid kyseliny octove, Acenol (pharmaceutical), Bayer Select Head Cold, Genebs, N-(4-Hydroxyphenyl)acetanilide, Drixoral Sinus, Aceta Tablets, D oliprane, Drixoral Plus, Valorin Extra, Bayer Select, NCX 701, Panale ve, Paracetamol [INN:BAN], Ty lenol, CCRIS 3, Snaplets-FR, Oraphen-PD, Phenaphen Caplets, Bayer Select Allergy-Sinus, Bayer Select Headache Pain, Dristan Cold No Drowsiness, Paracetamolum [INN-Latin], Sudafed Severe Cold Formula, Prestwick_13, St Joseph Aspirin-Free for Children, UNII-362O9ITL9D, Children's Acetaminophen Elixir Drops, Children's Acetaminophen Oral Solution, Midol PM Night Time Formula, Tavist Allergy/Sinus/Headache, Triaminic Sore Throat Formula, Dapa X-S, Bayer Select Sinus Pain Relief, Drixoral Cold & Flu, Phenol, p-acetamido-, Sine-Off Sinus Medicine Caplets, CHEBI:46195, HSDB 3001, Roxicet 5/500, RZVAJINKPMORJF-UHFFFAOYSA-N, Tocris-1706, Contac Cough & Sore Throat Formula, N-acetyl-para-aminophenol, 4-(N-Acetylamino)phenol, Acetaminophen (4-hydroxyacetanilide), Bayer Select Menstrual Multi-Symptom, EINECS 203-157-5, 222 AF, n-acetyl-4-hydroxyaniline, St. Joseph Cold Tablets for Children, CHEMBL112, NSC 109028, 4-Hydroxyanilid kyseliny octove [Czech], Children's Acetaminophen Elixir Solution, N-(4-hydroxyphenyl)-acetamide, 362O9ITL9D, ANEXSIA 10/660, component of Dialog, component of Dilone, component of Endecon, component of Percocet, component of Phenaphen, TYL, N-(4-Hydroxyphenyl)acetamide (Tylenol), component of Percogesic, DSSTox_CID_6, NCGC00016361-07, CAS-103-90-2, WLN: QR DMV1, DSSTox_RID_75318, DSSTox_GSID_20006, component of Hycomine Compound, Flexsure, Tylenol (caplet), Tylenol (geltab), Tylenol 8-Hour, Anacin 3, SMR000112065, Acetaminophen [USP], SR-01000597517, Acetaminophen [USP:JAN], paracetamol (acetaminophen), acetominophene, Claratal, Daphalgan, Resprin, Calpol infant, Daga, Apacet Capsules, Atasol Caplets, Atasol Tablets, Tempra Caplets, Tylenol Caplets, Tylenol Elixir, Tylenol Gelcaps, Tylenol Tablets, Actamin Extra, Actamin Super, Aminofen Max, Apacet Elixir, Atasol Drops, Exdol Strong, p-Acetoaminophen, Tempra Drops, Tempra Syrup, Tylenol Drops, alpha-Per, Citramon P, Excedrin Caplets, Papa-Deine, Dial-alpha-gesic, Apo-Acetaminophen, 4-acetominophenol, Genebs X-Tra, 4-acetamido phenol, 4-acetamido-phenol, Tempra D.S, 4-Acetamino phenol, APAP, Paracetamol, Aspirin free anacin, Acetaminophen 650, acetyl-p-aminophenol, p-hydroxy-acetanilid, p-hydroxyacetoanilide, Paracetamol (INN), Proxyphene/Acetamine, Tylenol (TN), Supac (Salt/Mix), Tylox (Salt/Mix), Zydone (Salt/Mix), Atasol Forte Caplets, Atasol Forte Tablets, Atasol Oral Solution, para-acetylaminophenol, Anexsia (Salt/Mix), Endecon (Salt/Mix), Sinubid (Salt/Mix), Talacen (Salt/Mix), Vicodin (Salt/Mix), Wygesic (Salt/Mix), Acetaminophen Uniserts, Datril Extra-Strength, Tylenol Infants Drops, Demilets (Salt/Mix), Empracet (Salt/Mix), Intensin (Salt/Mix), Propacet (Salt/Mix), Suppap-120, Suppap-325, Suppap-650, Panadol Extra Strength, TheraFlu (Salt/Mix), Coricidin (Salt/Mix), Liquiprin (Salt/Mix), Hy-Phen (Salt/Mix), IV-APAP, phenol derivative, 11, PubChem17726, Spectrum_000016, Tempra Chewable Tablets, Naldegesic (Salt/Mix), Actimol Chewable Tablets, Feverall Junior Strength, Darvocet-N (Salt/Mix), AC1L1CNW, AC1Q1KYJ, AC1Q1KYK, Anacin-3 Extra Strength, Liquiprin Infants" Drops, N-acetyl para aminophenol, Prestwick0_000868, Prestwick1_000868, Prestwick2_000868, Prestwick3_000868, Spectrum2_000085, Spectrum3_000283, Spectrum4_000140, Spectrum5_000736, Coricidin D (Salt/Mix), Quiet World (Salt/Mix), Genapap Children's Elixir, Tylenol Children's Elixir, 4-Acetamidophenol, 98%, Actifed Plus (Salt/Mix), D0U5QK, D0U9NY, Epitope ID:117710, Genapap Children's Tablets, Sudafed Sinus (Salt/Mix), EC 203-157-5, Actimol Infants' Suspension, Drixoral Sinus (Salt/Mix), Liquiprin Children's Elixir, N-acetyl-4-hydroxyaniline;, SCHEMBL3480, Acetaminophen (JP17/USP), Coricidin Sinus (Salt/Mix), BSPBio_000915, BSPBio_001786, DDS-06A, KBioGR_000560, KBioSS_000356, 4-13-00-01091 (Beilstein Handbook Reference), Actimol Children's Suspension, Apacet Extra Strength Caplets, Apacet Extra Strength Tablets, Aspirin-Free Excedrin Caplets, Genebs Extra Strength Caplets, KSC492K1N, MLS001146925, MLS001331684, MLS002154041, BIDD:GT0005, DivK1c_000660, N-(4-hydroxyphenyl)ethanamide, SPECTRUM1500101, Genapap Extra Strength Caplets, Genapap Extra Strength Tablets, SPBio_000010, SPBio_002836, Tapanol Extra Strength Caplets, Tapanol Extra Strength Tablets, Tylenol Extra Strength Caplets, Tylenol Extra Strength Gelcaps, Tylenol Extra Strength Tablets, ACMC-20989w, Actimol Junior Strength Caplets, Apacet Regular Strength Tablets, BPBio1_001007, Excedrin Extra Strength Caplets, Genebs Regular Strength Tablets, GTPL5239, Panadol Junior Strength Caplets, SGCUT00014, Tylenol Junior Strength Caplets, Midol Teen Formula (Salt/Mix), DTXSID2020006, Genapap Regular Strength Tablets, Panadol Maximum Strength Caplets, Panadol Maximum Strength Tablets, SCHEMBL19474893, Tylenol Regular Strength Caplets, Tylenol Regular Strength Tablets, Aspirin-Free Anacin (Salt/Mix), BDBM26197, CTK3J2516, HMS502A22, KBio1_000660, KBio2_000356, KBio2_002924, KBio2_005492, KBio3_001286, EBD5728, NSC3991, Tylenol Arthritis Extended Relief, Acetaminophen, analytical standard, MolPort-000-150-777, NINDS_000660, Tylenol Infants" Suspension Drops, BCPP000441, Drixoral Cold & Flu (Salt/Mix), HMS1570N17, HMS1920A03, HMS2091G03, HMS2097N17, HMS2269G20, HMS3268A10, HMS3714N17, LS-32, Pharmakon1600-01500101, Tylenol Allergy Sinus (Salt/Mix), Midol Regular Strength (Salt/Mix), ACT06727, BCP23431, KS-000002NN, NSC 3991, NSC-3991, STR00901, to_000023, Tylenol Children's Chewable Tablets, Acetaminophen, BioXtra, >=99.0%, Bayer Select Head Cold (Salt/Mix), Robitussin Night Relief (Salt/Mix), Tox21_110397, Tox21_201930, Tox21_300100, ANW-14994, BBL005229, CCG-38901, MFCD00002328, NSC109028, NSC755853, SBB043758, STL140694, Tylenol Children's Suspension Liquid, ZINC13550868, AKOS000121004, Feverall Sprinkle Caps Junior Strength, Ornex Severe Cold Formula (Salt/Mix), Tox21_110397_1, Bayer Select Allergy-Sinus (Salt/Mix), BCP9000225, CS-2819, DB00316, MCULE-3844920617, NSC-109028, NSC-755853, RP21489, RTR-000905, TRA0127672, IDI1_000660, Sine-Aid, Maximum Strength (Salt/Mix), Sudafed Severe Cold Formula (Salt/Mix), NCGC00016361-01, NCGC00016361-02, NCGC00016361-03, NCGC00016361-04, NCGC00016361-05, NCGC00016361-06, NCGC00016361-08, NCGC00016361-09, NCGC00016361-10, NCGC00016361-12, NCGC00016361-13, NCGC00025267-01, NCGC00025267-02, NCGC00025267-03, NCGC00025267-04, NCGC00025267-05, NCGC00253912-01, NCGC00259479-01, Tylenol Junior Strength Chewable Tablets, 8055-08-1, AC-23969, AJ-70539, AN-24662, BC204766, CJ-15887, H865, HY-66005, KB-74449, Midol PM Night Time Formula (Salt/Mix), SC-19146, Triaminic Sore Throat Formula (Salt/Mix), BCP0726000305, SBI-0051269.P003, AB1009347, Bayer Select Sinus Pain Relief (Salt/Mix), KB-188932, KB-192758, TR-000905, AB00051905, Aspirin Free Anacin Maximum Strength Caplets, Aspirin Free Anacin Maximum Strength Tablets, FT-0658035, Sine-Off Sinus Medicine Caplets (Salt/Mix), ST24028862, ST45179777, Unavailable - See ASDI_CatNo 500008847, 6473-EP1441224A2, 6473-EP2270008A1, 6473-EP2272832A1, 6473-EP2275420A1, 6473-EP2277565A2, 6473-EP2277566A2, 6473-EP2277567A1, 6473-EP2277568A2, 6473-EP2277569A2, 6473-EP2277570A2, 6473-EP2277861A1, 6473-EP2277865A1, 6473-EP2277875A2, 6473-EP2280008A2, 6473-EP2281559A1, 6473-EP2281819A1, 6473-EP2281823A2, 6473-EP2292280A1, 6473-EP2292617A1, 6473-EP2292619A1, 6473-EP2298764A1, 6473-EP2298765A1, 6473-EP2305219A1, 6473-EP2305654A1, 6473-EP2305659A1, 6473-EP2308510A1, 6473-EP2308872A1, 6473-EP2311818A1, 6473-EP2314585A1, 6473-EP2314590A1, 6473-EP2316829A1, 6473-EP2371811A2, C06804, D00217, 72238-EP2305640A2, 72238-EP2308867A2, 72238-EP2308870A2, 91399-EP2277876A1, 91399-EP2284149A1, 91399-EP2292614A1, 91399-EP2305636A1, AB00051905-09, AB00051905_10, Aspirin Free Anacin Maximum Strength Gel Caplets, Bayer Select Menstrual Multi-Symptom (Salt/Mix), Contac Cough & Sore Throat Formula (Salt/Mix), L024125, St. Joseph Cold Tablets for Children (Salt/Mix), Tylenol Extra Strength Adult Liquid Pain Reliever, I05-0086, J-001064, J-514275, Paracetamol (Acetaminophen) 1.0 mg/ml in Methanol, SR-01000597517-1, SR-01000597517-2, SR-01000597517-4, BRD-K41524689-001-08-6, F3096-1731, F48B493F-B1FD-410C-AA0A-F40EC71A0689, Bayer Select Maximum Strength Headache Pain Relief Formula, Paracetamol, British Pharmacopoeia (BP) Reference Standard, Paracetamol, European Pharmacopoeia (EP) Reference Standard, Acetaminophen solution, drug standard, 1.0 mg/mL in methanol, Acetaminophen, United States Pharmacopeia (USP) Reference Standard, Acetaminophen, meets USP testing specifications, 98.0-102.0%, powder, Acetaminophen, Pharmaceutical Secondary Standard; Certified Reference Material, InChI=1/C8H9NO2/c1-6(10)9-7-2-4-8(11)5-3-7/h2-5,11H,1H3,(H,9,10, Paracetamol for equipment qualification, EuropePharmacopoeia (EP) Reference Standard, 1430221-00-3, 4 inverted exclamation marka-Hydroxyacetanilide; 4-Acetamidophenol; N-Acetyl-4-aminophenol; APAP, 719293-04-6, Tylenol (USA), Anacin Aspirin Free (USA), Apra (USA), Crocin (India), Feverall (USA), Genapap (USA), Panadol (UK), Panamax (Australia), Panodil (Denmark)


ID: 2052

chemical graph of compound 2052



InChIKey: RZVHIXYEVGDQDX-UHFFFAOYSA-N
SMILES: C1=CC=C2C(=C1)C(=O)C3=CC=CC=C3C2=O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6780
synonyms found at PubChem are:
ANTHRAQUINONE, 9,10-Anthraquinone, 84-65-1, anthracene-9,10-dione, 9,10-Anthracenedione, Anthradione, Hoelite, 9,10-Dioxoanthracene, Corbit, Morkit, 9,10-Anthrachinon, Anthra-9,10-quinone, Anthrapel, 9,10-quinone, Az-Q, Anthrachinon, Caswell No. 052A, Anthraquinone [BSI:ISO], UNII-030MS0JBDO, Bis-alkylamino anthraquinone, NSC 7957, 9,10-Anthrachinon [Czech], CCRIS 649, 9,10-Anthracendion, Anthracene, 9,10-dihydro-9,10-dioxo-, CHEBI:40448, HSDB 2074, EINECS 201-549-0, Anthracene-9,10-quinone, EPA Pesticide Chemical Code 122701, 030MS0JBDO, CHEMBL55659, AI3-09073, RZVHIXYEVGDQDX-UHFFFAOYSA-N, 9,10-dihydro-9,10-dioxoanthracene, NCGC00094960-03, DSSTox_CID_95, DSSTox_RID_75364, DSSTox_GSID_20095, CAS-84-65-1, Morkie, Anthracenequinone, 9,10-anthrachinoe, 9,10-Anthraguinone, Anthraquinone, 97%, Spectrum_001527, SpecPlus_000645, AC1L1NAG, Spectrum2_000405, Spectrum3_001501, Spectrum4_000907, Spectrum5_001897, ACMC-209pw0, Anthra-9,10-quinone #, D0L5LN, Epitope ID:116191, EC 201-549-0, AC1Q6JY1, SCHEMBL14943, BSPBio_003141, KBioGR_001374, KBioSS_002007, KSC362C5J, DivK1c_006741, SPECTRUM1502103, SPBio_000330, DTXSID3020095, KBio1_001685, KBio2_002007, KBio2_004575, KBio2_007143, KBio3_002641, NSC7957, Anthraquinone, analytical standard, MolPort-001-783-170, HMS1921J14, NSC-7957, ZINC3847491, Tox21_111369, 9,10-dihydroanthracene-9,10-dione, ANW-37822, BBL003001, BDBM50094892, CCG-39966, MFCD00001188, SBB060613, STK398385, Anthracene,10-dihydro-9,10-dioxo-, AKOS000282964, Tox21_111369_1, DS-4810, LS-1837, MCULE-4655011423, RP26414, RTR-031315, TRA0074021, NCGC00094960-01, NCGC00094960-02, NCGC00094960-04, NCGC00094960-06, AC-12719, AJ-45864, AN-24075, K513, KB-74706, SC-46775, Anthraquinone, purum, >=99.0% (HPLC), DB-005409, TR-031315, A0502, Anthraquinone 100 microg/mL in Acetonitrile, FT-0622417, ST24024605, ST50410412, T8216, Anthraquinone, Vetec(TM) reagent grade, 97%, C16207, Anthraquinone, PESTANAL(R), analytical standard, AB-131/40003277, SR-01000944707, I14-1219, SR-01000944707-1, BRD-K15957397-001-03-4, Melting point standard 283-286C, analytical standard, F0001-2133, Melting point standard 283-286 inverted exclamation markaC, InChI=1/C14H8O2/c15-13-9-5-1-2-6-10(9)14(16)12-8-4-3-7-11(12)13/h1-8


ID: 2053

chemical graph of compound 2053



InChIKey: SAOOBRUHTPONGX-CDKFMWKUSA-N
SMILES: CC1=C2CC=C3[C@](C2=CC(=C1OC(=O)C)OC(=O)C)(CC[C@@]4([C@@]3(CC[C@@]5([C@H]4C[C@](CC5)(C)C(=O)O)C)C)C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 9828620
synonyms found at PubChem are:
Dihydrocelastryl diacetate, BDBM81366, MolPort-044-811-219, 2,3-Diacetoxy-24-norfriedelane-1(10),2,4,7-tetraene-29-oic acid


ID: 2054

chemical graph of compound 2054



InChIKey: SARMGXPVOFNNNG-UHFFFAOYSA-N
SMILES: CC(C)N=C(N)/N=C(\N)/NC1=CC=C(C=C1)Cl.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 12498
synonyms found at PubChem are:
AC1L1ZQ3, MLS002154090, SARMGXPVOFNNNG-UHFFFAOYSA-N, SMR001233398, FT-0664524, Z1558572526, 1-[amino-(4-chloroanilino)methylidene]-2-propan-2-ylguanidine hydrochloride, 1-({amino[(4-chlorophenyl)amino]methylidene}amino)-N'-(propan-2-yl)methanimidamide hydrochloride, Chloroguanidine, hydrochloride, WLN: GR DMYUM&MYUM&MY1&1 &GH, Paludrine hydrochloride, NSC12977, AC1NSE0V, NSC26614, NSC-12977, NSC-26614, (1Z)-1-[amino-(4-chloroanilino)methylidene]-2-propan-2-ylguanidine hydrochloride, Proguanil hydrochloride, 637-32-1, Diguanyl, Paludrine, Chlorguanide hydrochloride, Chloroquanil, Bigumalum, Chloroguanide hydrochloride, Proguanil HCl, Tirian hydrochloride, Palusil hydrochloride, Drinupal hydrochloride, Guanatol hydrochloride, 1-(p-Chlorophenyl)-5-isopropylbiguanide hydrochloride, Chloroguanidine hydrochloride, UNII-R71Y86M0WT, Bigumal, EINECS 211-283-7, NSC 12977, NSC 26614, 3359 RP, SN 12,837, R71Y86M0WT, 336U50, M 4888, N-4-Chlorophenyl-N(sup 5)-isopropyldiguanide hydrochloride, Chloroguanide HCl, N-(4-Chlorophenyl)-N(sup5)-isopropyldiguanide hydrochloride, Paludrine (TN), BIGUANIDE, 1-(p-CHLOROPHENYL)-5-ISOPROPYL-, MONOHYDROCHLORIDE, DSSTox_CID_27756, DSSTox_RID_82533, DSSTox_GSID_47776, W-109585, 1-(4-chlorophenyl)-5-isopropylbiguanide hydrochloride, N1-(4-Chlorophenyl)-N5-isopropylbiguanide, N-(4-Chlorophenyl)-N'-(1-methylethyl)-imidodicarbonimidic Diamide Hydrochloride, NCGC00016528-01, CAS-637-32-1, SR-05000001973, 1-(4-chlorophenyl)-3-(N-propan-2-ylcarbamimidoyl)guanidine;hydrochloride, Proguanil chloride, Proguanil hydrochloride [USAN:USP], C11H16ClN5.HCl, GWAH7673A, SCHEMBL218859, Proguanil hydrochloride (JAN), C11H17Cl2N5, AMBZ0378, GW AH7673A, 500-92-5 (Parent), CHEMBL1201059, DTXSID7047776, MolPort-003-666-543, HMS1571G19, Pharmakon1600-01504211, Atovaquone, Proguanil Hydrochloride, Tox21_110476, CCG-39555, GL3057, MFCD01732193, NSC758688, AKOS024255720, Tox21_110476_1, AM85857, API0004822, HS-0102, NSC-758688, QC-1853, Imidodicarbonimidic diamide, N-(4-chlorophenyl)-N'-(1-methylethyl)-, monohydrochloride, NCGC00016528-05, LS-43874, Proguanil hydrochloride, >=95% (HPLC), AB0095163, KB-276270, X3488, D02487, M-4888, N1-(4-Chlorophenyl)-N5-isopropylbiguanide HCl, 637P321, SR-05000001973-3, Proguanil hydrochloride, European Pharmacopoeia (EP) Reference Standard, Proguanil hydrochloride, United States Pharmacopeia (USP) Reference Standard, (1E)-1-[amino-[(4-chlorophenyl)amino]methylidene]-2-propan-2-ylguanidine hydrochloride, Proguanil for system suitability, European Pharmacopoeia (EP) Reference Standard, Proguanil hydrochloride, Pharmaceutical Secondary Standard; Certified Reference Material, Imidodicarbonimidic diamide, N-(4-chlorophenyl)-N'-(1-methylethyl)-, monohydrochloride (9CI), 1-(4-chlorophenyl)-2-(N-propan-2-ylcarbamimidoyl)guanidine


ID: 2055

chemical graph of compound 2055



InChIKey: SASVNKPCTLROPQ-NZYDNVMFSA-N
SMILES: CC(=O)O[C@@H]1[C@H]2COC(=O)[C@@H]2[C@@H](C3=CC4=C(C=C13)OCO4)C5=CC(=C(C(=C5)OC)OC)OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 164791
synonyms found at PubChem are:
Podophyllotoxin acetate, Acetylpodophyllotoxin, 1180-34-3, Acetyl podophyllotoxin, Podophyllotoxin, acetate, Podophyllin Acetate, NSC 36408, Spectrum_001858, Spectrum2_001681, Spectrum3_001672, Spectrum4_001662, Spectrum5_000563, AC1L4VH1, BSPBio_003483, KBioGR_002183, KBioSS_002375, SCHEMBL985502, SPECTRUM1504412, SPBio_001602, CHEMBL1409147, Podophyllotoxin, acetate (8CI), CTK4B0543, KBio2_002371, KBio2_004939, KBio2_007507, KBio3_002703, DTXSID90151999, NSC36408, ZINC4164766, CCG-38772, NSC-36408, SDCCGMLS-0066778.P001, NCGC00161925-01, NCGC00161925-02, BRD-K62577500-001-03-6, [(5R,5aR,8aR,9R)-8-oxo-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-5-yl] acetate, Furo(3',4':6,7)naphtho(2,3-d)-1,3-dioxol-6(5aH)-one, 9-(acetyloxy)-5,8,8a,9-tetrahydro-5-(3,4,5-trimethoxyphenyl)-, (5R-(5alpha,5abeta,8aalpha,9alpha))- (9CI), Furo[3',4':6,7]naphtho[2,3-d]-1,3-dioxol-6(5aH)-one,9-(acetyloxy)-5,8,8a,9-tetrahydro-5-(3,4,5-trimethoxyphenyl)-, (5R,5aR,8aR,9R)-, Furo[3',7]naphtho[2,3-d]-1,3-dioxol-6(5aH)-one, 9-(acetyloxy)-5,8,8a,9-tetrahydro-5-(3,4,5-trimethoxyphenyl)-, [5R-(5.alpha.,5a.beta.,8a.alpha.,9.alpha.)]-


ID: 2056

chemical graph of compound 2056



InChIKey: SASVNKPCTLROPQ-RGXPITOMSA-N
SMILES: CC(=O)O[C@@H]1[C@H]2COC(=O)[C@H]2[C@@H](C3=CC4=C(C=C13)OCO4)C5=CC(=C(C(=C5)OC)OC)OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 233299
synonyms found at PubChem are:
PICROPODOPHYLLOTOXIN ACETATE, 38491-90-6, SR-05000002684, Spectrum_001662, Picropodophyllin, acetate, AC1L5PQN, Spectrum2_000807, Spectrum3_000662, Spectrum4_001634, Spectrum5_000447, BSPBio_002323, KBioGR_002067, KBioSS_002142, (5r,5ar,8as,9r)-8-oxo-9-(3,4,5-trimethoxyphenyl)-5,5a,6,8,8a,9-hexahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-5-yl acetate, SPECTRUM1504411, SPBio_000673, CHEMBL454333, SCHEMBL4276054, CTK4I0063, KBio2_002142, KBio2_004710, KBio2_007278, KBio3_001543, NSC31708, NSC-31708, CCG-214618, SDCCGMLS-0066752.P001, NCGC00161924-01, NCGC00161924-02, SR-05000002684-1, SR-05000002684-2, BRD-K99108905-001-02-0, [(5R,5aR,8aS,9R)-8-oxo-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-5-yl] acetate


ID: 2057

chemical graph of compound 2057



InChIKey: SAVSLMGBKQKUAV-JYJNAYRXSA-N
SMILES: CC(C)[C@@H](C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H](C(C)C)C(=O)O)NC(=O)C(F)(F)F

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 40785040
synonyms found at PubChem are:
Tfa-VAL-TYR-VAL-OH, 64577-63-5, CHEMBL3138715, ZINC8681552, FT-0640958, C-44077, L-Valine,N-(2,2,2-trifluoroacetyl)-L-valyl-L-tyrosyl-, (S)-2-((S)-3-(4-hydroxyphenyl)-2-((S)-3-methyl-2-(2,2,2-trifluoroacetamido)butanamido)propanamido)-3-methylbutanoic acid


ID: 2058

chemical graph of compound 2058



InChIKey: SBHXYTNGIZCORC-ZDUSSCGKSA-N
SMILES: C1[C@H](OC2=CC(=CC(=C2C1=O)O)O)C3=CC(=C(C=C3)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 440735
synonyms found at PubChem are:
ERIODICTYOL, 552-58-9, Eriodictiol, (S)-Eriodictyol, UNII-Q520486B8Y, (S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychroman-4-one, (S)-2-(3,4-Dihydroxyphenyl)-2,3-dihydro-5,7-dihydroxy-4-benzopyrone, CHEMBL8996, CHEBI:28412, Q520486B8Y, (2S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-2,3-dihydro-4H-chromen-4-one, Q-100627, 3',4',5,7-Tetrahydroxyflavanone, 4H-1-Benzopyran-4-one,2-(3,4-dihydroxyphenyl)-2,3-dihydro-5,7-dihydroxy-, (2S)-, eriodicryol, eryodictiol, (+)-Eriodictyol, EINECS 209-016-4, NSC 649412, Eriodictyol with HPLC, D08AIJ, AC1L99UV, SCHEMBL19180, BIDF1031, BIDF1032, Eriodictyol, analytical standard, 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-4-one, ZINC58117, MolPort-003-938-846, SBHXYTNGIZCORC-ZDUSSCGKSA-N, 3' 4' 5 7-tetrahydroxyflavanone, 4049-38-1, 5,7,3'',4''-tetrahydroxyflavon, BCP13401, Eriodictyol, >=95.0% (HPLC), BDBM50325671, LMPK12140002, 5,7,3'',4''-tetrahydroxyflavanone, AKOS025311577, Eriodictyol solution, 20 mM in DMSO, AC-6043, API0002587, SC-88664, ZB002321, LS-193891, FT-0686607, N2309, C05631, 552E589, UNII-CQT975GLYF component SBHXYTNGIZCORC-ZDUSSCGKSA-N, (S)-2-(3,4-Dihydroxy-phenyl)-5,7-dihydroxy-chroman-4-one, (2S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-2,3-dihydrochromen-4-one, (S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-2,3-dihydrochromen-4-one, (S)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychroman-4-one solution, 20 mM in DMSO, (S)-3 inverted exclamation marka,4 inverted exclamation marka,5,7-Tetrahydroxyflavanone, ERD


ID: 2059

chemical graph of compound 2059



InChIKey: SBNFWQZLDJGRLK-UHFFFAOYSA-N
SMILES: CC(=CC1C(C1(C)C)C(=O)OCC2=CC(=CC=C2)OC3=CC=CC=C3)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 4767
synonyms found at PubChem are:
phenothrin, Sumithrin, 26002-80-2, Phenoxythrin, Phenothrine, Pibutin, Sumitrin, Duet, Anchimanaito 20S, Wellcide, Solo (insecticide), Multicide 2154, Fenotrina, S 2539 (pesticide), Fenotrina [Spanish], Phenothrine [French], Phenothrinum [Latin], 3-Phenoxybenzyl chrysanthemate, Caswell No. 652B, Phenothrin [INN:BAN], Phenothrine [ISO-French], OMS 1809, OMS 1810, PT 515, CCRIS 2502, Multicide Concentrate F-2271, HSDB 3922, Phenothrin [BSI:ISO], Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, (3-phenoxyphenyl)methyl ester, EINECS 247-404-5, S-2539, ENT 27 972, EPA Pesticide Chemical Code 069005, delta-(cis-trans)-Phenothrin, 3-phenoxybenzyl 2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropanecarboxylate, 2,2-Dimethyl-3-(2-methyl-1-propenyl)cyclopropanecarboxylic acid (3-phenoxyphenyl)methyl ester, AI3-29062, D-Phenothrin, 188023-86-1, CHEBI:34916, 3-Phenoxybenzyl (+-)-cis-trans-chrysanthemate, 3-Phenoxybenzyl (1RS)-cis,trans-chrysanthemate, SBNFWQZLDJGRLK-UHFFFAOYSA-N, m-Phenoxybenzyl 2,2-dimethyl-3-(2-methylpropenyl)cyclopropanecarboxylate, 2,2-Dimethyl-3-(2-methylpropenyl)cyclopropanecarboxylic acid m-phenoxybenzyl ester, 3-Phenoxybenzyl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxylate, S-2539F, NCGC00094561-01, 3-Phenoxybenzyl 2-dimethyl-3-(methylpropenyl)cyclopropanecarboxylate, (3-Phenoxyphenyl)methyl 2,2-dimethyl-3-(2-methyl-1-propenyl)cyclopropanecarboxylate, (3-phenoxyphenyl)methyl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate, 3-Phenoxybenzyl (1RS)-cis,trans-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxylate, 3-Phenoxybenzyl (1RS,3RS;1RS,3SR)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxylate, Benzyl alcohol, m-phenoxy-, 2,2-dimethyl-3-(2-methylpropenyl)cyclopropanecarboxylate, Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methylpropenyl)-, m-phenoxybenzyl ester, DSSTox_CID_12688, DSSTox_RID_79033, DSSTox_GSID_32688, Phenothrinum, m-Phenoxybenzyl (+-)-cis,trans-2,2-dimethyl-3-(2-methylpropenyl)cyclopropanecarboxylate, Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, 3-(phenoxyphenyl)methyl ester, Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, 3-(phenoxyphenyl)methyl ester, cis,trans-(+/-)-, CAS-26002-80-2, Phonothrin, (R)-Phenothrin, Phenothrin (INN), Hegor antipoux (TN), Spectrum_001981, SpecPlus_000796, AC1L1IWQ, Spectrum3_001204, Spectrum4_000583, Spectrum5_000644, SCHEMBL74649, BSPBio_002588, KBioGR_001046, KBioSS_002547, MLS004712075, DivK1c_006892, SPECTRUM1504098, CHEMBL1322884, DTXSID7032688, CTK8G3999, KBio1_001836, KBio2_002538, KBio2_005106, KBio2_007674, KBio3_002088, MolPort-003-930-931, s538, HMS1922B17, Pharmakon1600-01504098, HY-B1072, Tox21_111297, Tox21_301570, CCG-38960, NSC758668, Phenothrin 10 microg/mL in Isooctane, AKOS015914551, Tox21_111297_1, CS-4628, NSC-758668, ACM26002802, NCGC00094561-02, NCGC00094561-03, NCGC00094561-04, NCGC00094561-06, NCGC00255299-01, ACM188023861, AK129237, BC680104, LS-58710, SC-16053, SC-19633, SMR001563205, SBI-0051922.P002, AX8019762, KB-236765, 542-EP2274983A1, 542-EP2280009A1, 542-EP2308857A1, 542-EP2314583A1, FT-0630520, Phenothrin, PESTANAL(R), analytical standard, C14387, D08357, S 2539, AB00052445_02, AB00052445_03, 002P802, A818137, SR-01000872757, J-016219, SR-01000872757-1, BRD-A22106989-001-01-9, BRD-A22106989-001-02-7, I14-41370, (3-phenoxyphenyl)methyl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarboxylate, 2,2-Dimethyl-3-(2-methylpropenyl-1)cyclopropancarbonic acid, 3-phenoxybenzyl ester, 3-Phenoxybenzyl 2,2-dimethyl-3-(2-methyl-1-propenyl)cyclopropanecarboxylate #, 3-phenoxyphenylmethyl 2,2-dimethyl- 3-(2-methyl-1-propenyl)cyclopropanecarboxylate, Cyclopropanecarboxylic acid,2,2-dimethyl-3-(2-methylpropen-1-yl), 3-phenoxybenzyl ester, 2,2-Dimethyl-3-(2-methyl-1-propenyl)cyclopropanecarboxylic acid (3-phenoxy-phenyl)methyl ester, 2,2-dimethyl-3-(2-methylprop-1-enyl)-1-cyclopropanecarboxylic acid (3-phenoxyphenyl)methyl ester, 53528-32-8, 73170-79-3


ID: 2060

chemical graph of compound 2060



InChIKey: SBPBAQFWLVIOKP-UHFFFAOYSA-N
SMILES: CCOP(=S)(OCC)OC1=NC(=C(C=C1Cl)Cl)Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 2730
synonyms found at PubChem are:
chlorpyrifos, 2921-88-2, Chlorpyriphos, Dursban, Trichlorpyrphos, Lorsban, Chlorpyrifos-ethyl, Brodan, Coroban, Pyrinex, Killmaster, Bonidel, Danusban, Geodinfos, Lentrek, Piridane, Spannit, Stipend, Tafaban, Durmet, Equity, Terial, Zidil, Suscon blue, Suscon green, suSCon, Dursban F, Dursban R, Lock-On, Dursban 4E, Chlorpyriphos-ethyl, Dowco 179, Ethyl chlorpyriphos, Clorpyrifos, Dursban 10CR, Chlorpyrifos (Dursban), Detmol U.A., Chloropyrifos, Phosphorothioic acid, O,O-diethyl O-(3,5,6-trichloro-2-pyridinyl) ester, Dhanusban, Grofo, Detmol ua, Chlorpyrifos ethyl, Radar (fungicide), Dursban 44, Lorsban 50SL, Empire 20, Terial 40L, Chlorpyrifos [BAN], Chloropyriphos, Chlorpyrofos, Chlorpyrophos, Pageant, Silrifos, Caswell No. 219AA, m-Chlorpyrifos, XRM 429, O,O-Diethyl O-3,5,6-trichloro-2-pyridyl phosphorothioate, C9H11Cl3NO3PS, OMS-0971, XRM 5160, Dursban 2E, Chlorpyriphos [ISO-French], UNII-JCS58I644W, ENT 27311, CCRIS 7144, HSDB 389, Chlorpyrifos [ANSI:BSI:ISO], EINECS 220-864-4, O,O-Diethyl O-(3,5,6-trichloro-2-pyridinyl)phosphorothioate, EPA Pesticide Chemical Code 059101, BRN 1545756, Phosphorothioic acid, O,O-diethyl O-(3,5,6-trichloro-2-pyridyl) ester, AI3-27311, MLS001065609, JCS58I644W, O,O-Diaethyl-O-3,5,6-trichlor-2-pyridylmonothiophosphat, O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) thiophosphate, CHEBI:34631, SBPBAQFWLVIOKP-UHFFFAOYSA-N, 2-Pyridinol, 3,5,6-trichloro-, O-ester with O,O-diethyl phosphorothioate, Chlorpyrifos (BAN), O,O-Diethyl O-(3,5,6-trichloro-2-pyridyl) phsophorothioate, SMR000568474, DSSTox_CID_458, O,O-Diaethyl-O-3,5,6-trichlor-2-pyridylmonothiophosphat [German], DSSTox_RID_75603, DSSTox_GSID_20458, o,o-Diethyl-o-(3,5,6-trichloro-2-pyridyl)phosphorothioate, O,O-Diethyl O-(3,5,6-Trichloro-2-pyridyl) phosphorothioate, O,O-Diethyl-O-(3,5,6-trichloro-2-pyridyl)phosphorothiolate, O,O-diethyl O-(3,5,6-trichloropyridin-2-yl) phosphorothioate, diethoxy-sulfanylidene-(3,5,6-trichloropyridin-2-yl)oxyphosphorane, diethoxy-sulfanylidene-[(3,5,6-trichloro-2-pyridinyl)oxy]phosphorane, CAS-2921-88-2, pridane, Chlorpyritos, Affront, Paqeann, Piridann, Empirn, Eraden, Scoun, Detmol Un, diethoxy-sulfanylidene-(3,5,6-trichloropyridin-2-yl)oxy-?^{5}-phosphane, detmol u. a, Detmol U.A, Chlorpyrifos solution, Stipend and Tricel., Zodiac (TN), Chloropyrifos solution, Dowco 179, Dursban, Spectrum_001897, SpecPlus_000518, Spectrum2_001230, Spectrum3_000849, Spectrum4_000689, Spectrum5_002014, C7H7Cl3NO3PS, D0M5ES, AC1L1EC5, cid_2730, Dursban, analytical standard, BIDD:PXR0044, SCHEMBL21680, BSPBio_002437, KBioGR_001157, KBioSS_002427, SPECTRUM330058, DivK1c_006614, SPBio_001080, AC1Q38B6, CHEMBL463210, DTXSID4020458, BDBM74063, CTK8E8187, KBio1_001558, KBio2_002421, KBio2_004989, KBio2_007557, KBio3_001937, SBPBAQFWLVIOKP-UHFFFAOYSA-, OMS 971, MolPort-003-665-453, HMS3039C03, HMS3264O03, Pharmakon1600-00330058, ZINC608250, Tox21_202383, Tox21_300148, AC-993, CCG-39144, ENT-27311, NSC755891, AKOS015891656, Phosphorothioic acid O,O-diethyl O-(3,5,6-trichloro-2-pyridinyl) ester, ENT 27,311, KS-5372, LS-1137, NSC-755891, NCGC00091472-01, NCGC00091472-02, NCGC00091472-03, NCGC00091472-04, NCGC00091472-05, NCGC00091472-06, NCGC00091472-07, NCGC00091472-08, NCGC00091472-09, NCGC00253974-01, NCGC00259932-01, AN-15356, BC220240, CC-25729, Chlorpyrifos 10 microg/mL in Cyclohexane, O799, SC-47023, ZB014607, Chlorpyrifos 10 microg/mL in Acetonitrile, Chlorpyrifos 100 microg/mL in Cyclohexane, SBI-0052543.P002, Chlorpyrifos 100 microg/mL in Acetonitrile, TR-036379, FT-0602970, C14322, D07688, M-1133, 26848-EP2274983A1, 26848-EP2275422A1, 26848-EP2280002A1, 26848-EP2280009A1, 26848-EP2292608A1, 26848-EP2305662A1, 26848-EP2308857A1, 26848-EP2308858A1, 26848-EP2311816A1, 26848-EP2311817A1, 26848-EP2314583A1, 88579-EP2298076A1, 88579-EP2298077A1, 88579-EP2301353A1, 88579-EP2305031A1, 88579-EP2305034A1, 88579-EP2305035A1, 88579-EP2305662A1, AB00053051_06, Chlorpyrifos, PESTANAL(R), analytical standard, 921C882, A819822, C-20634, SR-01000854727, I02-0698, I06-1337, J-017440, SR-01000854727-2, BRD-K08303368-001-02-7, BRD-K08303368-001-06-8, Chlorpyrifos Solution, 100 mg/L, (RM, ISO Guide 34), Chlorpyrifos, certified reference material, TraceCERT(R), Diethyl O-(3,5,6-trichloro-2-pyridyl) phosphorothioate, O,O-Diethyl O-3,5,6-trichloro-2-pyridylphosphorothioate, O,O- diethyl-O-(3,5,6-trichloro-2-pyridyl)thiophosphate, diethoxy-thioxo-[(3,5,6-trichloro-2-pyridyl)oxy]phosphorane, O,O-Diethyl o-(3,5,6-trichloro-2-pyridinyl) thiophosphate #, diethoxy-sulfanylidene-(3,5,6-trichloropyridin-2-yl)oxy--phosphane, diethoxy-thioxo-[(3,5,6-trichloro-2-pyridyl)oxy]-$l^{5}-phosphane, ethyl 3,5,6-trichloropyridin-2-yl ethoxy(sulfanylidene)phosphonite, O,O-diethyl O-(3,5,6-trichloro-2-pyridinyl) phosphorothioic acid, O,O-DIETHYL O-3,5,6-TRICHLOROPYRIDIN-2-YL PHOSPHOROTHIOATE, diethoxy-sulfanylidene-[3,5,6-tris(chloranyl)pyridin-2-yl]oxy--phosphane, Phosphorothioic Acid O,O-Diethyl O-(3,5,6-Trichloro-2-pyridinyl)ester, Chlorpyrifos solution, 100 mug/mL in acetonitrile, PESTANAL(R), analytical standard, diethoxy-sulfanylidene-[3,5,6-tris(chloranyl)pyridin-2-yl]oxy-$l^{5}-phosphane, 12768-48-8, 39475-55-3, Chlorpyrifos solution, certified reference material, TraceCERT(R), 1000 mug/mL in methyl tert-butyl ether, ampule of 1 mL, InChI=1/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3


ID: 2061

chemical graph of compound 2061



InChIKey: SCKYRAXSEDYPSA-UHFFFAOYSA-N
SMILES: CC1=CC(=O)N(C(=C1)C2CCCCC2)O

biological descriptors:

CFTR relevance: CFTR proteostasis regulator

Category:
Influence on CFTR function enhances CFTR function
Order of interaction indirect
subcellular compartment several

reference list:

"N Pedemonte" "LJ Galietta" "V Tomati" "U Pfeffer" "E Sondo" "AI Esposito" "E Caci"


CID is 2749
synonyms found at PubChem are:
CICLOPIROX, 29342-05-0, Loprox, Penlac, Ciclopiroxum, Batrafen, HOE 296b, Stieprox, Terit, Ciclopiroxum [INN-Latin], cyclopirox, Mycoster, Ciclopirox gel, cyclopyroxolamine, Loprox cream, HOE-296b, Loprox Gel, Ciclopirox Olamin, Ciclopirox-Olamin, Dafnegin-CSC, 6-Cyclohexyl-1-hydroxy-4-methyl-2(1H)-pyridone, 2(1H)-Pyridinone, 6-cyclohexyl-1-hydroxy-4-methyl-, 6-cyclohexyl-1-hydroxy-4-methylpyridin-2(1H)-one, Loprox Shampoo, 6-Cyclohexyl-1-hydroxy-4-methyl-2(1H)-pyridinone, UNII-19W019ZDRJ, Penlac nail lacquer, Ciclopirox [USAN:BAN:INN], Loprox (TN), Penlac (TN), Ciclopirox (Penlac), Ciclopirox (USP/INN), EINECS 249-577-2, HOE-296, 19W019ZDRJ, 6-cyclohexyl-1-hydroxy-4-methylpyridin-2-one, C12H17NO2, CHEBI:453011, SCKYRAXSEDYPSA-UHFFFAOYSA-N, 2(1H)-Pyridone, 6-cyclohexyl-1-hydroxy-4-methyl-, 6-CYCLOHEXYL-1-HYDROXY-4-METHYL-1H-PYRIDIN-2-ONE, 6-cyclohexyl-1-hydroxy-4-methyl-pyridin-2-one, 6-Cyclohexyl-1-hydroxy-4-methyl-2-(1H)-pyridone, (6-Cyclohexyl-1-hydroxy-4-methyl-2(1H)-pyridone), W-106995, MLS002153867, CNL8, SMR001233223, Ciclopirox [USAN:USP:INN:BAN], Batrafen (TN), Stieprox (TN), 2-aminoethanol;6-cyclohexyl-1-hydroxy-4-methylpyridin-2-one, AC1L1EDN, Prestwick0_000541, Prestwick1_000541, Prestwick2_000541, Prestwick3_000541, Spectrum2_000146, Spectrum3_000351, Spectrum4_000288, Spectrum5_000747, D07GRH, CHEMBL1413, SCHEMBL34424, BSPBio_000581, BSPBio_002041, KBioGR_000816, cid_38911, KSC563C4H, BIDD:GT0080, SPBio_000252, SPBio_002502, BPBio1_000641, ZINC1145, DTXSID9048564, BDBM66087, CTK4G3143, KBio3_001261, MolPort-003-845-943, HMS3656I12, BCP28530, HY-B0450, KS-00000L3N, AN-773, BG0571, s2528, AKOS015895717, AB06517, CS-2561, DB01188, KS-5085, NCGC00017112-04, NCGC00017112-05, NCGC00017112-06, NCGC00017112-08, NCGC00017112-11, NCGC00178850-01, NCGC00178850-02, AC-24195, AJ-07970, AK544043, BC205517, CC-25776, SC-17361, SBI-0206690.P002, AB0011605, AB2000628, KB-270156, LS-174247, TL8002303, 1-hydroxy-4-methyl-6-cyclohexyl-2-pyridone, FT-0602961, 6-cyclohexyl-1-hydroxy-4-methyl-2-pyridinone, D03488, 6-cyclohexyl-4-methyl-1-oxidanyl-pyridin-2-one, AB00053438_09, AB00053438_10, AB00053438_11, 342C050, A819878, C-10474, 6-Cyclohexenyl-1-hydroxy-4-methyl-2(1h)-pyridone, 6-cyclohexyl-1-hydroxy-4-methyl-2(1 H)-pyridinone, Batrafen; Loprox;Mycoster;Stieprox;HOE 296b;Penlac, I06-0862, SR-05000001589-5, 6-cyclohexyl-1-hydroxy-4-methyl-2(1 H )-pyridinone, 6-Cyclohexyl-1-hydroxy-4-methyl-2(1H)-pyridinone #, BRD-K13044802-213-04-1, BRD-K13044802-213-09-0, 2-aminoethanol;6-cyclohexyl-1-hydroxy-4-methyl-2-pyridone, 6-cyclohexyl-1-hydroxy-4-methyl-1,2-dihydropyridin-2-one, 2-aminoethanol;6-cyclohexyl-1-hydroxy-4-methyl-2-pyridinone, 2-azanylethanol;6-cyclohexyl-4-methyl-1-oxidanyl-pyridin-2-one


ID: 2062

chemical graph of compound 2062



InChIKey: SCLZRKVZRBKZCR-SLINCCQESA-M
SMILES: CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)N[C@H]3[C@@H]4N(C3=O)[C@H](C(S4)(C)C)C(=O)[O-].[Na+]

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 12557
synonyms found at PubChem are:
Cloxacillin sodium, Cloxacillin sodium salt, 642-78-4, Sodium cloxacillin, Cloxacillin sodium anhydrous, Sodium orbenin, Monosodium cloxacillin, Sodium syntarpen, Austrastaph, Staphybiotic, Ankerbin, Ekvacillin, Gelstaph, Orbenin sodium, Prevencilina P, Prostaphilin A, Prostaphlin A, BRL 1621 sodium salt, Tegopen, Syntarpen sodium salt, UNII-MWQ645MKMF, BRL-1621 sodium salt, EINECS 211-390-9, MWQ645MKMF, 3-o-Chlorophenyl-5-methyl-4-isoxazolylpenicillin sodium, Sodium 3-(o-chlorophenyl)-5-methyl-4-isoxazolylpenicillin, CHEBI:51357, DSSTox_CID_25551, DSSTox_RID_80950, DSSTox_GSID_45551, 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-(3-(2-chlorophenyl)-5-methyl-4-isoxazolecarboxamido)-3,3-dimethyl-7-oxo-, monosodium salt, (2S,5R,6R)-, 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-(3-(2-chlorophenyl)-5-methyl-4-isoxazolecarboxamido)-3,3-dimethyl-7-oxo-, monosodium salt, (2S-(2alpha,5alpha,6beta))-, 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-(3-(o-chlorophenyl)-5-methyl-4-isoxazolecarboxamido)-3,3-dimethyl-7-oxo-, monosodium salt, Cloxacillin sodium salt monohydrate, NCGC00017029-01, CAS-642-78-4, Prestwick_916, sodium cloxacillin(1-), 5-Methyl-3-(o-chlorophenyl)-4-isoxazolyl] pencillin, C19H17ClN3NaO5S, C19H17ClN3O5S.Na, SCHEMBL41013, MLS002154231, 61-72-3 (free acid), SPECTRUM1500201, Cloxacillin Sodium (anhydrous), CHEMBL262636, DTXSID4045551, CTK8F8746, HMS502E18, MolPort-002-509-865, HMS1568F13, HMS1920A04, HMS2091G12, HMS2095F13, HMS2234C11, HMS3712F13, BCP10752, Tox21_110744, CCG-40259, MFCD00063568, AKOS027250800, Tox21_110744_1, API0002088, MCULE-7556215634, NCGC00178840-05, AN-20457, SMR000718745, LS-149770, Cloxacillin sodium salt, >=97.0% (HPLC), FT-0603191, 7081-44-9 (.H2O), 1252-37-5, 50794-85-9, sodium (2S,5R,6R)-6-(3-(2-chlorophenyl)-5-methylisoxazole-4-carboxamido)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate, sodium (2S,5R,6R)-6-[[3-(2-chlorophenyl)-5-methyl-isoxazole-4-carbonyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate, sodium 2,2-dimethyl-6beta-({[5-methyl-3-(2-chlorophenyl)isoxazol-4-yl]carbonyl}amino)penam-3alpha-carboxylate


ID: 2063

chemical graph of compound 2063



InChIKey: SCMSYZJDIQPSDI-SRVKXCTJSA-N
SMILES: CC(C)CCNC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1[C@H](O1)C(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 123664
synonyms found at PubChem are:
76684-89-4, e-64c, Loxistatin acid, EP 475, EP 475 (Enzyme inhibitor), E 64c, MLS000028693, E-64-c, C15H26N2O5, BRN 6688621, Loxistatin Acid (E-64C), SMR000058872, CHEMBL418661, E-64c;EP 475, N-(N-(3-carboxyoxirane-2-carbonyl)leucyl)isoamylamine, NSC 694279, L-trans-Epoxysuccinyl-Leu-3-methylbutylamide, (+)-(2S,3S)-3-((S)-3-Methyl-1-(3-methylbutylcarbamoyl)butylcarbamoyl)-2-oxiranecarboxylic acid, (2S,3S)-3-[[(2S)-4-methyl-1-(3-methylbutylamino)-1-oxopentan-2-yl]carbamoyl]oxirane-2-carboxylic acid, (2S,3S)-3-{[(1S)-3-methyl-1-[(3-methylbutyl)carbamoyl]butyl]carbamoyl}oxirane-2-carboxylic acid, Oxiranecarboxylic acid, 3-(((3-methyl-1-(((3-methylbutyl)amino)carbonyl)butyl)amino)carbonyl)-, (2S-(2-alpha,3-beta(R*)))-, Oxiranecarboxylic acid, 3-(((3-methyl-1-(((3-methylbutyl)amino)carbonyl)butyl)amino)carbonyl)-, (2S-(2alpha,3beta(R*)))-, SR-01000000286, (2S,3S)-trans-Epoxysuccinyl-L-leucylamido-3-methylbutane, Opera_ID_1991, Ec64-c, E-64c Calpain Inhibitor, AC1L3X2J, AC1Q5JQ7, E-64c, Calpain Inhibitor, [2S,3S]-trans-Epoxysuccinyl-L-leucylamido-3-methylbutane, (2s,3s)-3-({(2s)-4-methyl-1-[(3-methylbutyl)amino]-1-oxopentan-2-yl}carbamoyl)oxirane-2-carboxylic acid, epoxysuccinyl derivative E64c, cid_123664, E64C, SCHEMBL3281530, BDBM16510, E 64-c, MolPort-003-941-226, SCMSYZJDIQPSDI-SRVKXCTJSA-N, ZINC3913936, 2390AH, MFCD00132882, s7392, AKOS027250809, CCG-207845, CCG-208199, HO-tES-Leu-NH-CH2-CH2CH(CH3)2, NCGC00023595-03, LS-101007, 684E894, SR-01000000286-2, SR-01000000286-3, BRD-K21937671-001-10-0, N-(N-(L-3-trans-carboxyoxirane -2-carbonyl)-L-leucyl)isoamylamine, N-(N-(3-transcarboxyoxirane-2-carbonyl)-L-leucyl)-3-methylbutylamine, (2S,3S)-3-[[(1S)-1-(isoamylcarbamoyl)-3-methyl-butyl]carbamoyl]oxirane-2-carboxylic acid, (2R,3S)-3-((S)-1-(isopentylamino)-4-methyl-1-oxopentan-2-ylcarbamoyl)oxirane-2-carboxylic acid, (2S,3S)-3-[[(2S)-4-methyl-1-(3-methylbutylamino)-1-oxidanylidene-pentan-2-yl]carbamoyl]oxirane-2-carboxylic acid, (2S,3S)-3-[[[(2S)-4-methyl-1-(3-methylbutylamino)-1-oxopentan-2-yl]amino]-oxomethyl]-2-oxiranecarboxylic acid


ID: 2064

chemical graph of compound 2064



InChIKey: SCULJPGYOQQXTK-OLRINKBESA-N
SMILES: CC(=O)O[C@@H]1[C@@H]([C@]2(CC[C@H]3[C@H]([C@@]24[C@@H]1O4)CC[C@H]5[C@@]3(CC[C@@H](C5)O)C)C)C6=COC(=O)C=C6

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 11969542
synonyms found at PubChem are:
Cinobufagin, 470-37-1, Cinobufagine, Cino-bufagin, UNII-T9PSN4R8IR, T9PSN4R8IR, CHEBI:80805, NSC90325, SCHEMBL642990, CHEMBL250785, MolPort-003-940-630, HY-N0421, ZINC4215351, 8074AH, MFCD00056825, NSC-90325, CCG-208337, CS-3697, SC-76202, C3460, N1154, ST24044142, C16931, 470C371, SR-05000002305, Q-100496, SR-05000002305-2, 14,15|A-Epoxy-3|A,16|A-dihydroxy-5|A,20(22)-bufadienolide 16-acetate, 5|A,20(22)-Bufadienolide-3|A,16|A-diol-14,15|A-epoxy 16-acetate, 14,15beta-Epoxy-3beta,16beta-dihydroxy-5beta,20(22)-bufadienolide 16-acetate, 5.beta.-Bufa-20, 14,15.beta.-epoxy-3.beta.,16.beta.-dihydroxy-, 16-acetate, 5beta-Bufa-20,22-dienolide, 14,15beta-epoxy-3beta,16beta-dihydroxy-, 16-acetate (8CI), Bufa-20, 16-(acetyloxy)-14,15-epoxy-3-hydroxy-, (3.beta.,5.beta.,15.beta.,16.beta.)-, 14,15beta-Epoxy-3beta,16beta-dihydroxy-5beta,20(22)-bufadienolide 16-acetate, 5beta,20(22)-Bufadienolide-3beta,16beta-diol-14,15beta-epoxy 16-acetate, 5-((1R,2R,2aR,3aS,3bR,5aR,7S,9aS,9bS,11aR)-2-Acetyl-7-hydroxy-9a,11a-dimethylhexadecahydronaphtho[1',2'


ID: 2065

chemical graph of compound 2065



InChIKey: SCVHFRLUNIOSGI-UHFFFAOYSA-N
SMILES: CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3CCCC3

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 1917
synonyms found at PubChem are:
8-Cyclopentyl-1,3-dimethylxanthine, 8-cyclopentyltheophylline, 35873-49-5, 8-Cyclopentyl theophylline, 1,3-dimethyl-8-cyclopentylxanthine, UNII-U7PWT4CPL5, U7PWT4CPL5, 8-cyclopentyl-1,3-dimethyl-7H-purine-2,6-dione, NSC 101806, BRN 1133199, Xanthine, 8-cyclopentyl-1,3-dimethyl-, Theophylline, 8-cyclopentyl-, CHEMBL106265, 8-Cyclopentyl-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione, 1H-Purine-2,6-dione, 8-cyclopentyl-3,9-dihydro-1,3-dimethyl-, Spectrum_000351, Lopac-C-102, AC1L1CIO, AC1Q6LAU, Spectrum2_001734, Spectrum3_000658, Spectrum4_000760, Spectrum5_001769, D0L5JL, NCIOpen2_006919, Lopac0_000391, BSPBio_002295, GTPL385, KBioGR_001120, KBioSS_000831, MLS000859932, DivK1c_000824, SCHEMBL431907, SPECTRUM2300193, SPBio_001808, CPT; 8-Cyclopentyltheophylline, 8-cyclopentyltheophylline (cpt), SCHEMBL18029489, BDBM81925, CTK4H5503, HMS502J06, KBio1_000824, KBio2_000831, KBio2_003399, KBio2_005967, KBio3_001515, DTXSID70189432, CHEBI:109538, MolPort-003-846-098, NINDS_000824, SCVHFRLUNIOSGI-UHFFFAOYSA-N, HMS2231K17, HMS3261O03, HMS3374O03, 1H-Purine-2,6-dione, 8-cyclopentyl-3,7-dihydro-1,3-dimethyl-, CAS_1917, NSC_1917, Tox21_500391, CCG-39502, NSC101806, PDSP1_000994, PDSP2_000978, ZINC15880093, AKOS027320620, AKOS030211020, CCG-221695, LP00391, NSC-101806, IDI1_000824, Mol Pharmacol 29: 331 (1986), NCGC00015178-01, NCGC00015178-02, NCGC00015178-03, NCGC00015178-04, NCGC00015178-05, NCGC00015178-06, NCGC00015178-07, NCGC00093819-01, NCGC00093819-02, NCGC00093819-03, NCGC00093819-04, NCGC00261076-01, SMR000326793, DB-048886, LS-149466, C-102, EU-0100391, FT-0639285, 8-cyclopentyl-1,3-dimethyl-9H-purine-2,6-dione, L000085, SR-01000075232, SR-01000075232-1, BRD-K38347298-001-02-3, BRD-K38347298-001-06-4, 1H-Purine-2, 8-cyclopentyl-3,7-dihydro-1,3-dimethyl-, 8-Cyclopentyl-1,3-dimethyl-3,7-dihydro-purine-2,6-dione, 1H-Purine-2,6-dione,8-cyclopentyl-3,9-dihydro-1,3-dimethyl-, 8-Cyclopentyl-1,3-dimethylxanthine, >=98% (HPLC), powder, 1H-Purine-2,6-dione, 8-cyclopentyl-3,7-dihydro-1,3-dimethyl- (9CI), 8-cyclopentyl-1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione


ID: 2066

chemical graph of compound 2066



InChIKey: SCZVLDHREVKTSH-UHFFFAOYSA-N
SMILES: COC1=C(C=CC(=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5280666
synonyms found at PubChem are:
Chrysoeriol, 491-71-4, Chryseriol, 3'-Methoxyapigenin, Luteolin 3'-methyl ether, 3'-O-Methylluteolin, 3'-O-Methyluteolin, 4',5,7-trihydroxy-3'-methoxyflavone, 5,7,4'-Trihydroxy-3'-methoxyflavone, 5,7-Dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-benzopyrone, 5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4H-chromen-4-one, 4H-1-Benzopyran-4-one, 5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-, UNII-Q813145M20, EINECS 207-742-6, 5,7-Dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4H-1-benzopyran-4-one, BRN 0295004, CHEMBL214321, CHEBI:16514, 3'-Methoxy-4',5,7-trihydroxyflavone, Q813145M20, FLAVONE, 4',5,7-TRIHYDROXY-3'-METHOXY-, 5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)chromen-4-one, Chrysoeril, Chrysoriol, Scoparol, CCRIS 9338, 3''-Methoxyapigenin, AC1NQXE5, D01FGM, Luteolin 3''-methyl ether, MLS001048958, SCHEMBL293757, cid_5280666, DTXSID60197687, MolPort-002-511-856, SCZVLDHREVKTSH-UHFFFAOYSA-N, HMS2271C08, ZINC519621, BCP28924, BDBM50241084, LMPK12110799, NSC732318, AKOS004110683, MCULE-7873890076, NSC-732318, 4',5,7-Trihydroxy-3'-methoxy-Flavone, NCGC00163527-01, 4'',5,7-trihydroxy-3''-methoxyflavone, 4CN-2225, KB-41367, LS-69048, SMR000386981, ST077089, ZB014281, 2-(5-methoxy,7-dihydroxy-benzpyran-4-one, FT-0665034, W1640, 3'-METHOXY-5,7,4'-TRIHYDROXYFLAVONE, C04293, C-57505, SR-01000758948, SR-01000758948-3, 2-(5-methoxy,4-hydroxyphenyl)5,7-dihydroxy-benzpyran-4-one, 5-7-Dihydroxy-2--4-hydroxy-3-methoxyphenyl--4H-1-benzopyran-4-one, 5,7-DIHYDROXY-2-(4-HYDROXY-3-METHOXY-PHENYL)-CHROMEN-4-ONE, 5,7-Dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4H-1-benzopyran-4-one, 9CI


ID: 2067

chemical graph of compound 2067



InChIKey: SEBFKMXJBCUCAI-HKTJVKLFSA-N
SMILES: COC1=C(C=CC(=C1)[C@@H]2[C@H](OC3=C(O2)C=C(C=C3)[C@@H]4[C@H](C(=O)C5=C(C=C(C=C5O4)O)O)O)CO)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 31553
synonyms found at PubChem are:
silibinin, Silybin, 22888-70-6, SILYMARIN, Flavobin, Silymarin I, Silybin A, Silibinine, Silliver, Silybine, Silibinin A, Silibininum, Silibinina, Flavobin Spofa, Silymarine I, Silibinin [INN], Silymarine, Silibinine [INN-French], Silibininum [INN-Latin], Silibinina [INN-Spanish], 7C3MT, Legalon, UNII-33X338MNE4, EINECS 245-302-5, NSC 651520, Silibin, Silimarin, CHEBI:9144, 33X338MNE4, Silibinin (INN), C25H22O10, NSC651520, NCGC00091057-01, DSSTox_CID_6018, DSSTox_RID_77985, DSSTox_GSID_26018, (2R,3R)-3,5,7-trihydroxy-2-((2R,3R)-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-2,3-dihydrobenzo[b][1,4]dioxin-6-yl)chroman-4-one, 36804-17-8, silybinin, Silibinin (mixture of A/B isomers), Silybin (7CI), (2R,3R)-3,5,7-trihydroxy-2-[(2R,3R)-3-(4-hydroxy-3-methoxy-phenyl)-2-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]chroman-4-one, (2R,3R)-3,5,7-trihydroxy-2-[(2R,3R)-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-2,3-dihydro-4H-chromen-4-one, (2R,3R)-3,5,7-trihydroxy-2-[(2R,3R)-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]-2,3-dihydrochromen-4-one, 3,5,7-Trihydroxy-2-(3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-1,4-benzodioxan-6-yl)-4-chromanone, 4H-1-Benzopyran-4-one, 2,3-dihydro-2-(2,3-dihydro-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-1,4-benzodioxin-6-yl)-3,5,7-trihydroxy-, (2R-(2-alpha,3-beta,6(2R*,3R*)))-, 4H-1-Benzopyran-4-one, 2-(2,3-dihydro-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-1,4-benzodioxin-6-yl)-2,3-dihydro-3,5,7-trihydroxy-, (2R-(2alpha,3beta,6(2R*,3R*)))-, CAS-22888-70-6, dura-silymarin, CCRIS 9378, Legalon (TN), Silibinin (Silybin), Silybin, Technical grade, AC1L1LUB, AC1Q6OSA, Spectrum2_001694, Spectrum3_001132, Spectrum4_001978, Spectrum5_001893, BSPBio_002623, KBioGR_002481, MLS001304057, SCHEMBL324884, SPECTRUM1505256, SPBio_001648, CHEMBL431701, MEGxp0_001301, DTXSID8026018, KBio3_002123, KS-00000KGH, MolPort-001-741-606, SEBFKMXJBCUCAI-HKTJVKLFSA-N, HMS1922P05, HMS2232P03, 2,3-Dihydro-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-6-(3,5,7-trihydroxy-4-oxobenzopyran-2-yl)benzodioxin, 2-[2R,3R-Dihydro-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-1,4-benzodioxin-6-yl]-2R,3R-dihydro-3,5,7-trihydroxy-4H-1-benzopyran-4-one, 802918-57-6, ZINC2033589, Tox21_111070, Tox21_200755, AN-924, BDBM50084982, CCG-38779, MFCD03225424, s2357, Silibinin solution, 20 mM in DMSO, Silybin, mixture of isomers A and B, AKOS004119918, Tox21_111070_1, API0026191, CS-2128, DB09298, DS-9661, LS-2125, MCULE-6463439345, MCULE-8379030042, NSC-651520, SDCCGMLS-0066916.P001, SMP2_000323, NCGC00091057-02, NCGC00091057-03, NCGC00091057-05, NCGC00258309-01, Silybin A (constituent of milk thistle), BP-30210, HY-13748, R765, SMR000718776, SBI-0207018.P001, Silibinin, disposable screening library format, 88S706, D08515, W-2484, AB00876265_06, SR-01000799140, Q-100291, SR-01000799140-2, BRD-K80353138-001-02-2, BRD-K80353138-001-07-1, Silibinin [mixture of A (2R,3R) and B (2R,3R) isomers], UNII-4RKY41TBTF component SEBFKMXJBCUCAI-HKTJVKLFSA-N, Silibinin (mixture of A/B isomers) solution, 20 mM in DMSO, (2R,3R)-3,5,7-trihydroxy-2-((2,3-anti)-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-2,3-dihydrobenzo[b][1,4]dioxin-6-yl)chroman-4-one, (2R,3R)-3,5,7-Trihydroxy-2-[(2R,3R)-3-(4-hydroxy-3-methoxy-phenyl)-2-hydroxymethyl-2,3-dihydro-benzo[1,4]dioxin-6-yl]-chroman-4-one, (2R,3R)-3,5,7-Trihydroxy-2-[3-(4-hydroxy-3-methoxy-phenyl)-2-hydroxymethyl-2,3-dihydro-benzo[1,4]dioxin-6-yl]-chroman-4-one, 11054-49-2, 11076-05-4, 11076-06-5, 142796-20-1, 22888-69-3, 27359-03-1, 28577-40-4, 29832-10-8, 3,5,7-Trihydroxy-2-(3-(4-hydroxy-3-methoxyphenyl)- 2-(hydroxymethyl)-1,4-benzodioxan-6-yl)-4-chromanone, 3,5,7-Trihydroxy-2-[3-(4-hydroxy-3-methoxy-phenyl)-2-hydroxymethyl-2,3-dihydro-benzo[1,4]dioxin-6-yl]-chroman-4-one, 3,5,7-trihydroxy-2-[3-(4-hydroxy-3-methoxyphenyl)-2-hydroxymethyl-(2R,3R)-2,3-dihydrobenzo[b][1,4]dioxin-6-yl]-(2R,3R)-3,4-dihydro-2H-4-chromenone, 37574-50-8, 4H-1-Benzopyran-4-one, 2-[(2R,3R)-2,3-dihydro-3-(4-hydroxy-3-methoxyphenyl)-2-(hydroxymethyl)-1,4-benzodioxin-6-yl]-2,3-dihydro-3,5,7-trihydroxy-, (2R,3R)-, 50976-99-3, 87725-90-4


ID: 2068

chemical graph of compound 2068



InChIKey: SEEPANYCNGTZFQ-UHFFFAOYSA-N
SMILES: C1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)N

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5215
synonyms found at PubChem are:
sulfadiazine, 68-35-9, Sulphadiazine, Sulfapyrimidine, Sulfadiazin, Sulfazine, Sulfadiazene, Liquadiazine, Sulfapyrimidin, Adiazin, Adiazine, Debenal, Pyrimal, 2-Sulfanilamidopyrimidine, Cremodiazine, Spofadrizine, Theradiazine, Cremotres, Deltazina, Diazolone, Eskadiazine, Microsulfon, Neotrizine, Palatrize, Piridisir, Quadetts, Quadramoid, Sanodiazine, Sterazine, Sulfatryl, Sulfolex, Sulfonsol, Terfonyl, Trifonamide, Truozine, Diazin, Diazyl, Neazine, Pirimal, Sulfose, Trisem, Sulfanilamidopyrimidine, Honey diazine, Lipo-Levazine, Tri-Sulfameth, Triple Sulfas, Coco-Diazine, Lipo-Diazine, Metha-Meridiazine, Sulfadiazinum, Diazovit, Sulfadiazina, Sulphadiazine E, Sulfapirimidin, Di-Azo-Mul, Thi-Di-Mer, 2-Sulfanilylaminopyrimidine, Codiazine, Silvadene, Pecta-diazine, suspension, Benzenesulfonamide, 4-amino-N-2-pyrimidinyl-, Solfadiazina, CocoDiazine, Solfadiazina [DCIT], RP 2616, 4-amino-N-(pyrimidin-2-yl)benzenesulfonamide, Pyrimidine, 2-sulfanilamido-, 2-Sulfanilamidopyrimidin, Sulfapyrimidin [German], Zinc Sulfadiazine, 2-Sulfapyrimidine, Sulfonamides Duplex, Sulfadiazinum [INN-Latin], Sulfadiazina [INN-Spanish], 4-AMINO-N-2-PYRIMIDINYLBENZENESULFONAMIDE, N(1)-2-pyrimidylsulfanilamide, N(1)-2-pyrimidinylsulfanilamide, Pecta-Diazine, 2-Sulfanilamidopyrimidin [German], S.N. 112, 4-amino-N-pyrimidin-2-ylbenzenesulfonamide, A 306, A-306 (VAN), N(sup 1)-2-Pyrimidinylsulfanilamide, Sulfadiazine (TN), Thermazene, N1-2-Pyrimidinylsulfanilamide, Sildaflo, CHEBI:9328, Sulfadiazine [USAN:INN:JAN], Sulfanilamide, N(sup 1)-2-pyrimidinyl-, rBPI21 & Sulfa, N(sup1)-2-Pyrimidylsulfanilamide, Sulfanilamide, N1-2(1H)-pyrimidinylidene-, 4-amino-N-pyrimidin-2-yl-benzenesulfonamide, N1-(Pyrimidin-2-yl)sulfanilamide, Sulfanilamide, N1-2-pyrimidinyl-, UNII-0N7609K889, A-306, N(sup1)-2-Pyrimidinylsulfanilamide, EINECS 200-685-8, NSC 35600, 2-Sulfanilamido-pyrimidine, 4-amino-N-(pyrimidin-2-yl)benzene-1-sulfonamide, CHEMBL439, N1-2-Pyrimidylsulfanilamide, BRN 0235192, C10H10N4O2S, CRL-8131 & Sulfadiazine, Sulfadiazine (JAN/USP/INN), Triple sulfa, 4-Amino-N-2-pyrimidinyl-benzenesulfonamide, AI3-01047, S. N. 112, 4-Amino-N-(2-pyrimidinyl)benzenesulfonamide, N-(2-Pyrimidinyl)sulfanilamide, SULFADIAZINE SODIUM, SEEPANYCNGTZFQ-UHFFFAOYSA-N, Trisulfapyrimidine, oral suspension, NSC35600, CAS-68-35-9, NCGC00016305-01, 0N7609K889, [(4-aminophenyl)sulfonyl]pyrimidin-2-ylamine, NSC117870, Recombinant bactericidal/permeability-increasing protein & Sulfadiazine, Sulfadiazine, Zinc, 141582-64-1, SMR000059113, SR-01000002973, Neotrizine (TN), Lantrisul (TN), Sulfadiazine,(S), Sulfaloid (TN), Sulfadiazine [USP:INN:BAN:JAN], Terfonyl (TN), DRG-0214, Prestwick_428, Sulfose (TN), Triple Sulfa (TN), Triple Sulfas (TN), Triple Sulfoid (TN), Spectrum_000986, Sulfadiazina Reig Jofre, Sulfacombin (Salt/Mix), AC1L1JUR, Prestwick0_000023, Prestwick1_000023, Prestwick2_000023, Prestwick3_000023, Spectrum2_001319, Spectrum3_001362, Spectrum4_000342, Spectrum5_000992, Sulfonamides Duplex (TN), Sulfa-Triple #2 (TN), D05LKP, Epitope ID:140083, AC1Q51XM, AC1Q6W1E, Sulfadiazine, >=99.0%, DSSTox_CID_24130, DSSTox_RID_80105, DSSTox_GSID_44130, Oprea1_081078, SCHEMBL24176, BSPBio_000085, BSPBio_002884, KBioGR_000743, KBioSS_001466, 5-25-10-00067 (Beilstein Handbook Reference), MLS000069423, MLS006011457, DivK1c_000543, SPECTRUM1500546, SPBio_001417, SPBio_002006, BPBio1_000095, WLN: T6N CNJ BMSWR DZ, DTXSID7044130, CTK7D7930, HMS501L05, KBio1_000543, KBio2_001466, KBio2_004034, KBio2_006602, KBio3_002104, MolPort-000-629-738, NINDS_000543, HMS1568E07, HMS1921A13, HMS2090P09, HMS2092I15, HMS2095E07, HMS2235D19, HMS3371L19, HMS3655I10, HMS3712E07, Pharmakon1600-01500546, ZINC120319, ALBB-014888, BCP12140, HY-B0273, Tox21_110360, BBL013169, BDBM50166571, CCG-39257, MFCD00006065, NSC-35600, NSC757324, s1770, SBB007604, SBB057674, STK317797, 2-(p-Aminobenzenesulfonamido)pyrimidin, AKOS000119073, CS-2263, DB00359, KS-1144, MCULE-4577338719, NE10425, NSC-757324, RP17586, 2-(4-Aminobenzenesulfonamido)pyrimidine, 4-amino-N-2-pyrimidylbenzenesulfonamide, IDI1_000543, N1-2(1H)-pyrimidinylidene-sulfanilamide, NCGC00016305-02, NCGC00016305-03, NCGC00016305-04, NCGC00016305-05, NCGC00016305-06, NCGC00016305-10, NCGC00023291-03, NCGC00023291-04, SULFADIAZINE (TRISULFAPYRIMIDINES), Sulfanilamide, N1-2-pyrimidinyl-(8CI), 2-(4-Aminobenzenesulfonylamino)pyrimidine, AC-26817, H458, ST059447, Sulfanilamide, N1-2-pyrimidinyl- (8CI), ZB004097, Mixture of sulfadiazine, and sulfamethazine, SBI-0051520.P003, AB2000282, KB-295527, LS-147838, 4-[[(Pyrimidin-2-yl)amino]sulfonyl]aniline, 4-Amino-N-2-pyrimidinyl- benzenesulfonamide, AB00052095, Benzenesulfonamide,4-amino-N-2-pyrimidinyl-, FT-0674741, R3929, S0579, ST51006797, TL80073596, 4-amino-N-(2-pyrimidinyl) benzenesulfonamide, 4-Amino-n-(2-pyrimidinyl)benzene-sulfonamide, 4-Amino-N-(2-pyrimidinyl)benzenesulfonamide #, 68S359, C07658, D00587, Trisulfapyrimidine, oral suspension (Salt/Mix), AB00052095-13, AB00052095-14, AB00052095_15, AB00052095_16, Benzenesulfonamide, 4-amino-N-(2-pyrimidinyl)-, Sulfadiazine, VETRANAL(TM), analytical standard, Q-201759, SR-01000002973-2, SR-01000002973-3, BRD-K32273377-001-05-4, BRD-K32273377-001-09-6, I01-15838, F1657-1720, I14-110269, Sulfadiazine, certified reference material, TraceCERT(R), Z271004844, Mixture of sulfadiazine, sulfamerazine, and sulfamethazine, Sulfadiazine, European Pharmacopoeia (EP) Reference Standard, Sulfadiazine, United States Pharmacopeia (USP) Reference Standard, Adiazin, Adiazine, Debenal, Liquadiazine, Microsulfon, Sulfazine, Sulfolex, Sulfadiazine, Sulfadiazine, Pharmaceutical Secondary Standard; Certified Reference Material, Sulfadiazine for identification of impurity F, European Pharmacopoeia (EP) Reference Standard


ID: 2069

chemical graph of compound 2069



InChIKey: SEEXPXUCHVGZGU-UHFFFAOYSA-M
SMILES: CC1=C(N(C(=C1)CC(=O)[O-])C)C(=O)C2=CC=C(C=C2)Cl.[Na+]

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 47290
synonyms found at PubChem are:
Zomepirac sodium salt, Sodium zomepirac, ZOMEPIRAC SODIUM, Zomax, 64092-48-4, Zomepirac (sodium salt), Zomepirac sodium anhydrous, UNII-DA5B6IWF46, McN 2783-21-98, EINECS 264-669-2, DA5B6IWF46, 5-(4-Chlorobenzoyl)-1,4-dimethyl-1H-pyrrole-2-acetic acid sodium salt, NCGC00090751-01, Sodium 5-(4-chlorobenzoyl)-1,4-dimethyl-1H-pyrrole-2-acetate, CAS-64092-48-4, 1H-Pyrrole-2-acetic acid, 5-(4-chlorobenzoyl)-1,4-dimethyl-, sodium salt, DSSTox_CID_13989, DSSTox_RID_79106, DSSTox_GSID_33989, 5-(p-Chlorobenzoyl)-1,4-dimethylpyrrole-2-acetic acid Sodium-Potassium salt, SMR000686071, NCGC00094811-01, Prestwick_973, 1H-Pyrrole-2-acetic acid, 5-(4-chlorobenzoyl)-1,4-dimethyl-, sodium salt, dihydrate, Zomepirac Sodium (anhydrous), MLS001055441, MLS002153996, CHEMBL266459, C15H13ClNO3.2H2O.Na, DTXSID3033989, SCHEMBL11172041, CTK8G3888, MolPort-005-936-008, HMS1570K20, HMS2097K20, HMS3714K20, 33369-31-2 (Parent), HY-B0890, Tox21_111006, Tox21_111335, Tox21_202177, MFCD00057223, AKOS015962410, Tox21_111006_1, CCG-220779, CS-4353, MCULE-3654355863, NCGC00017126-01, NCGC00094811-06, NCGC00259726-01, AC-17496, LS-136555, FT-0675929, ST51015168, C-44302, sodium [5-(4-chlorobenzoyl)-1,4-dimethyl-1H-pyrrol-2-yl]acetate, sodium 2-(5-(4-chlorobenzoyl)-1,4-dimethyl-1H-pyrrol-2-yl)acetate, 2-{5-[(4-chlorophenyl)carbonyl]-1,4-dimethylpyrrol-2-yl}acetic acid, sodium sa lt, 65859-57-6


ID: 2070

chemical graph of compound 2070



InChIKey: SESFRYSPDFLNCH-UHFFFAOYSA-N
SMILES: C1=CC=C(C=C1)COC(=O)C2=CC=CC=C2

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 2345
synonyms found at PubChem are:
BENZYL BENZOATE, 120-51-4, Ascabiol, Benylate, Novoscabin, Benzoic acid, phenylmethyl ester, Ascabin, Scabitox, Scobenol, Benzyl phenylformate, Phenylmethyl benzoate, Benzoic acid, benzyl ester, Benzylets, Colebenz, Peruscabin, Scabagen, Scabanca, Scabiozon, Benzoic acid benzyl ester, Vanzoate, Scabide, Benzyl benzenecarboxylate, benzylbenzoate, Antiscabiosum, Benzylis benzoas, Benzyl alcohol benzoic ester, Peruscabina, Spasmodin, Venzonate, Benzylum benzoicum, Benzylester kyseliny benzoove, Benzoesaeurebenzylester, Caswell No. 082, Benzylbenzenecarboxylate, Venzoate, FEMA Number 2138, Benzyl benzoate (natural), NSC 8081, BENZOIC ACID PHENYLMETHYLESTER, UNII-N863NB338G, FEMA No. 2138, HSDB 208, EINECS 204-402-9, Benzylester kyseliny benzoove [Czech], EPA Pesticide Chemical Code 009501, BRN 2049280, CHEMBL1239, AI3-00523, CHEBI:41237, SESFRYSPDFLNCH-UHFFFAOYSA-N, N863NB338G, NCGC00094981-03, DSSTox_CID_9153, DSSTox_RID_78686, DSSTox_GSID_29153, Q-200696, Benzyl benzoate, analytical standard, Benzoate de benzyle, BZM, CAS-120-51-4, SMR000471875, benzylbenzoat, Benzyl benzoate [USP:JAN], Acarobenzyl, Benzevan, Benzyl benzoate [USAN:JAN], Benzyl benzoat, Benzyl ester, 1dzm, Benylate (TN), benzoic acid benzyl, Benzoesaurebenzylester, Spectrum_001240, Spectrum2_000532, Spectrum3_001757, Spectrum4_000773, Spectrum5_001128, Benzyl benzoate 99+ %, ACMC-1C8AP, WLN: RVO1R, D0G1VX, Benzyl benzoate, >=99%, EC 204-402-9, AC1L1DH0, SCHEMBL3038, BENZYL BENZOATE BP98, BSPBio_003494, KBioGR_001186, KBioSS_001720, 4-09-00-00307 (Beilstein Handbook Reference), KSC174Q0R, MLS001066412, MLS001336003, MLS001336004, DivK1c_000204, SPECTRUM1503002, SPBio_000543, Benzyl benzoate (JP17/USP), AC1Q661C, ZINC1021, DTXSID8029153, BENZOIC ACID,BENZYL ESTER, Benzyl benzoate, 99% 250g, CTK0H4808, HMS500K06, KBio1_000204, KBio2_001720, KBio2_004288, KBio2_006856, KBio3_002714, KS-00000UHX, NSC8081, MolPort-001-740-297, NINDS_000204, HMS1921P16, HMS2092F20, HMS2269D24, Pharmakon1600-01503002, HY-B0935, NSC-8081, Tox21_111372, Tox21_201337, Tox21_303418, ANW-17509, BDBM50134035, CCG-39578, MFCD00003075, NSC758204, s4599, SBB058609, STL183088, AKOS003495939, Benzyl benzoate, >=99%, FCC, FG, Tox21_111372_1, CHM0028580, DB00676, FCH2703790, LS-2573, MCULE-4369643785, NSC-758204, RL00855, RTR-003391, IDI1_000204, Benzyl benzoate, for synthesis, 99.0%, NCGC00094981-01, NCGC00094981-02, NCGC00094981-04, NCGC00094981-05, NCGC00094981-07, NCGC00257502-01, NCGC00258889-01, AC-17033, AN-22825, CC-24472, KB-75431, ZB000222, SBI-0051748.P002, Benzoic acid-benzyl ester (Benzyl benzoate), DB-041563, TR-003391, B0064, FT-0622708, ST50406335, Benzyl benzoate, natural, >=99%, FCC, FG, Benzyl benzoate, ReagentPlus(R), >=99.0%, Benzyl benzoate, SAJ first grade, >=98.0%, Benzyl benzoate, tested according to Ph.Eur., A19449, Benzyl benzoate, SAJ special grade, >=99.0%, C12537, D01138, AB00052298_07, Benzyl benzoate, Vetec(TM) reagent grade, 98%, Benzyl benzoate, meets USP testing specifications, C-24290, SR-01000763773, I14-6951, SR-01000763773-2, Benzoic acid-benzyl ester 5000 ng/microl in n-Hexane, BRD-K52072429-001-06-1, Benzoic acid benzyl ester; Benzoic acid phenylmethyl ester, Benzyl benzoate, certified reference material, TraceCERT(R), Benzyl benzoate, United States Pharmacopeia (USP) Reference Standard, Benzyl benzoate, Pharmaceutical Secondary Standard; Certified Reference Material, InChI=1/C14H12O2/c15-14(13-9-5-2-6-10-13)16-11-12-7-3-1-4-8-12/h1-10H,11H


ID: 2071

chemical graph of compound 2071



InChIKey: SEYCAKMZVYADRS-UHFFFAOYSA-N
SMILES: CCCCC1=CC2=CC=CC=C2C(=N1)OCCN(C)C.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 17714
synonyms found at PubChem are:
Quotane, Quotane hydrochloride, Chinisocaine hydrochloride, Quinisocaine hydrochloride, Dimethisoquin hydrochloride [USAN], EINECS 220-468-1, Dimethisoquin HCl, 3-Butyl-1-(2-(dimethylamino)ethoxy)isoquinoline hydrochloride, 1-(beta-Dimethylaminoethoxy)-3-n-butylisoquinoline hydrochloride, 2-((3-Butyl-1-isoquinolyl)oxy)ethyl(dimethyl)ammonium chloride, 3-Butyl-1-(2-(dimethylamino)ethoxy)isoquinoline monohydrochloride, 1-(beta-Dimethylaminoethoxy)-3-n-butylisoquinoline monohydrochloride, ISOQUINOLINE, 3-BUTYL-1-(2-(DIMETHYLAMINO)ETHOXY)-, HYDROCHLORIDE, Ethanamine, 2-((3-butyl-1-isoquinolinyl)oxy)-N,N-dimethyl-, monohydrochloride, UNII-SMP2689462, SMP2689462, AC1L2AJ5, C17H24N2O.HCl, 86-80-6 (Parent), LS-85371, 2-(3-butylisoquinolin-1-yl)oxyethyl-dimethylazanium chloride, {2-[(3-butylisoquinolin-1-yl)oxy]ethyl}dimethylamine hydrochloride, Dimethisoquin hydrochloride, 2773-92-4, DSSTox_CID_25373, DSSTox_RID_80835, DSSTox_GSID_45373, NCGC00016618-01, CAS-2773-92-4, 2-(3-butylisoquinolin-1-yl)oxy-N,N-dimethylethanamine;hydrochloride, N-{2-[(3-butyl-1-isoquinolinyl)oxy]ethyl}-N,N-dimethylamine, MLS002153920, SCHEMBL467135, CHEMBL1533364, DTXSID6045373, HMS1569N22, Tox21_110528, AKOS024326188, Tox21_110528_1, CCG-220630, MCULE-5724448142, NCGC00016618-04, SMR000769826, KB-281896, D06661, SR-01000854196, SR-01000854196-2, 2-(3-butylisoquinolin-1-yl)oxy-N,N-dimethylethanamine,hydroc, 2-(3-butylisoquinolin-1-yl)oxy-N,N-dimethylethanamine,hydrochloride, 2-[(3-Butyl-1-isoquinolinyl)oxy]-N,N-dimethylethanamine hydrochloride, (2-(3-BUTYL-ISOQUINOLIN-1-YLOXY)-ETHYL)-DIMETHYL-AMINE, HYDROCHLORIDE


ID: 2072

chemical graph of compound 2072



InChIKey: SFAVZRNMTSBKPO-PFEQFJNWSA-N
SMILES: CN1CCC2=CC3=C(C4=C2[C@H]1CC5=CC=CC=C54)OCO3.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 44656911
synonyms found at PubChem are:
MolPort-000-716-723, MCULE-6609025744, Remerine HCl, 17669-16-8, REMERINEHYDROCHLORIDE, CHEMBL545513, MolPort-009-757-632, AKOS030489728, CCG-208369, ACM17669168


ID: 2073

chemical graph of compound 2073



InChIKey: SFBODOKJTYAUCM-UHFFFAOYSA-N
SMILES: CC(C)OC1=CC2=C(C=C1)C(=O)C(=CO2)C3=CC=CC=C3

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3747
synonyms found at PubChem are:
ipriflavone, 35212-22-7, Osten, Yambolap, Osteofix, 7-Isopropoxyisoflavone, Iprosten, Ipriflavonum, Ipriflavona, Osteoquine, Quinogin, Ipriflavone [INN:JAN], 7-Isopropoxy-3-phenyl-4H-1-benzopyran-4-one, Osten (TN), Iprivone, Osteochin, TC 80, Ipriflavonum [INN-Latin], Ipriflavona [INN-Spanish], 7-(1-Methylethoxy)-3-phenyl-4H-1-benzopyran-4-one, UNII-80BJ7WN25Z, FL 113, FL-113, CCRIS 1920, MLS000069470, 3-phenyl-7-propan-2-yloxychromen-4-one, 7-isopropoxy-3-phenyl-4H-chromen-4-one, Ipriflavone (Osteofix), BRN 4754346, SMR000059060, 4H-1-Benzopyran-4-one, 7-(1-methylethoxy)-3-phenyl-, 80BJ7WN25Z, CHEBI:31719, SFBODOKJTYAUCM-UHFFFAOYSA-N, 3-phenyl-7-(propan-2-yloxy)-4H-chromen-4-one, NCGC00024094-04, DSSTox_CID_20679, DSSTox_RID_79537, DSSTox_GSID_40679, Ostivone, CAS-35212-22-7, Ipriflavon, (Ipriflavone), Ipriflavone, INN, 7-Isoproxyisoflavone, 7-isopropoxy-isoflavone, 7-Isopropoxy isoflavone, 7-isopropyloxy-isoflavone, AC1L1GME, AC1Q6AMH, Ipriflavone (JAN/INN), Opera_ID_1176, D0R2OA, Ipriflavone (JP17/INN), Cambridge id 6663564, cid_3747, Oprea1_106310, Oprea1_275552, MLS000759494, MLS001146879, MLS001424060, MLS006011644, SCHEMBL111472, 7-isopropoxy-3-phenyl-chromone, CHEMBL165790, ZINC4016, Ipriflavone, analytical standard, Jsp006346, DTXSID5040679, BDBM43662, CTK8B3043, SFBODOKJTYAUCM-UHFFFAOYSA-, MolPort-002-215-881, FL113, HMS2051J15, HMS2234M05, HMS3371E17, HMS3393J15, HMS3656K19, HMS3715D04, TC-80, TN-39, HY-N0094, Tox21_111532, Tox21_113172, ANW-41668, MFCD00221719, s2422, 7-Isopropoxy-3-phenyl-chromen-4-one, AKOS003627375, Tox21_111532_1, Tox21_113172_1, AC-8130, AN-8305, CCG-100963, CS-6395, MCULE-4241728982, NC00213, VA11103, KS-0000128C, 7-(methylethoxy)-3-phenylchromen-4-one, NCGC00018139-01, NCGC00018139-02, NCGC00018139-03, NCGC00018139-04, NCGC00018139-05, NCGC00018139-07, NCGC00018139-08, AS-12306, CC-29584, CPD000059060, LS-39792, SAM001246714, SC-76131, ST083683, ZB000555, 3-phenyl-7-propan-2-yloxy-chromen-4-one, AB1006726, FT-0621442, I0669, 3-phenyl-7-propan-2-yloxy-1-benzopyran-4-one, D01338, AB00384280-21, 212I227, C-17639, SR-01000000042, 7-Isopropoxy-3-phenyl-4H-1-benzopyran-4-one 97%, SR-01000000042-2, 7-Isopropoxy-3-phenyl-4H-1-benzopyran-4-one, 97%, F0196-0909, InChI=1/C18H16O3/c1-12(2)21-14-8-9-15-17(10-14)20-11-16(18(15)19)13-6-4-3-5-7-13/h3-12H,1-2H3


ID: 2074

chemical graph of compound 2074



InChIKey: SGDBTWWWUNNDEQ-LBPRGKRZSA-N
SMILES: C1=CC(=CC=C1C[C@@H](C(=O)O)N)N(CCCl)CCCl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 460612
synonyms found at PubChem are:
melphalan, 148-82-3, Alkeran, Melfalan, L-PAM, Phenylalanine mustard, L-Sarcolysine, L-Sarcolysin, L-Phenylalanine mustard, Levofalan, p-L-Sarcolysin, Levopholan, Melphalanum, Levofolan, Melfalano, Phenylalanine nitrogen mustard, 4-[Bis(2-chloroethyl)amino]-L-phenylalanine, p-Bis(beta-chloroethyl)aminophenylalanine, Alanine Nitrogen Mustard, p-Di-(2-chloroethyl)amino-L-phenylalanine, L-Sarkolysin, Melfalano [INN-Spanish], Melphalanum [INN-Latin], 3-(p-(Bis(2-chloroethyl)amino)phenyl)-L-alanine, p-N-Bis(2-chloroethyl)amino-L-phenylalanine, 4-(Bis(2-chloroethyl)amino)-L-phenylalanine, CB 3025, 3-p-(Di(2-chloroethyl)amino)-phenyl-L-alanine, L-3-(p-(Bis(2-chloroethyl)amino)phenyl)alanine, p-L-sarcolysine, Rcra waste number U150, NCI-C04853, CCRIS 374, UNII-Q41OR9510P, CB-3025, CHEBI:28876, (2S)-2-amino-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoic acid, HSDB 3234, Melphalan [USAN:INN:BAN:JAN], At-290, NSC-8806, ALKERAN (TN), p-N,N-bis(2-chloroethyl)amino-L-phenylalanine, EINECS 205-726-3, CHEMBL852, RCRA waste no. U150, NSC 241286, BRN 2816456, L-3-(para-(Bis(2-chloroethyl)amino)phenyl)alanine, Sarcolysinum, SK-15673, phenylalanine nitrogen mu stard, SGDBTWWWUNNDEQ-LBPRGKRZSA-N, Q41OR9510P, p-N-Di(chloroethyl)aminophenylalanine, Alanine, 3-(p-(bis(2-chloroethyl)amino)phenyl)-, L-, Alanine, 3-[p-[bis(2-chloroethyl)amino]phenyl]-, L-, p-N-di(chloroethyl)aminophenylala nine, NCGC00090757-02, NSC 8806, DSSTox_CID_804, L-Phenylalanine, 4-(bis(2-chloroethyl)amino)-, 3-(p-(Bis(2-chloroethyl)amino)phenyl)alanine, 4-[Bis-(2-chloroethyl)amino]-L-phenylalanine, TRANSGENIC MODEL EVALUATION (MELPHALAN), DSSTox_RID_75797, DSSTox_GSID_20804, 8057-25-8, W-108096, TRANSGENIC LEP (MELPHALAN) (SEE ALSO MELPHALAN), Evomela, (S)-2-amino-3-(4-(bis(2-chloroethyl)amino)phenyl)propanoic acid, (2s)-2-amino-3-(4-[bis(2-chloroethyl)amino]phenyl)propanoic acid, MELPHALAN (SEE ALSO TRANSGENIC MODEL EVALUATION (MELPHALAN)), Melphalan-d8 Dihydrochloride, 4-(Bis(2-chloroethyl)amino)phenylalanine, NSC8806, CAS-148-82-3, SMR000058720, Phenylalanine, 4-[bis(2-chloroethyl)amino]-, L-Phenylalanine, 4-[bis(2-chloroethyl)amino]-, (2S)-2-amino-3-{4-[bis(2-chloroethyl)amino]phenyl}propanoic acid, NSC241286, Melphalan, powder, 4-[Bis(2-chloroethyl)amino]phenylalanine, Prestwick_1006, Melphalan [USAN:USP:INN:BAN:JAN], Spectrum_000397, 3025 C.B., AC1LA2OE, Spectrum2_000074, Spectrum3_000684, Spectrum4_000882, Spectrum5_001601, DL-Melphalan hydrochloride, D00FGO, Epitope ID:141802, SCHEMBL5872, BSPBio_002407, KBioGR_001284, KBioSS_000877, 4-14-00-01689 (Beilstein Handbook Reference), MLS001333666, MLS002153368, BIDD:GT0044, DivK1c_000653, SPECTRUM1500382, SPBio_000287, Melphalan (JP15/USP/INN), Melphalan (JP17/USP/INN), GTPL7620, ZINC1673, DTXSID6020804, NIOSH/AY3360000, CTK5E7915, HMS502A15, KBio1_000653, KBio2_000877, KBio2_003445, KBio2_006013, KBio3_001627, L-phenylalanine mustard (L-PAM), 3025 c.b, MolPort-003-665-535, NINDS_000653, HMS2090B09, HMS2091B16, HMS2235D21, Pharmakon1600-01500382, KS-00001D9Q, Tox21_111010, Tox21_202522, AN-976, BDBM50025837, CCG-39704, DL-442, LS-865, NSC757098, s8266, AKOS015895374, Alkeran;L-Phenylalanine mustard;L-PAM, Tox21_111010_1, API0003288, CS-3120, DB01042, NSC-757098, IDI1_000653, SMP2_000174, NCGC00090757-01, NCGC00090757-03, NCGC00090757-04, NCGC00090757-05, NCGC00090757-06, NCGC00260071-01, AS-13314, CC-30199, H877, HY-17575, LS-15868, SBI-0052787.P003, AB0005221, AB2000419, AY3360000, TL8001065, AY33600000, FT-0603357, 4-[bis(2-chloroethyl)-amino]-L-phenylalanine, 4-[bis(2-chloroethyl)-amino]-l-phenyl-alanine, 4-[bis(2-chloroethyl)amino]-(L)-phenylalanine, C07122, D00369, K-4728, AB00053282-07, AB00053282-08, AB00053282_09, 148M823, A808810, Alanine, 3-(p-(bis(2-chloroethyl)amino)phenyl)-, C-19011, SR-05000001667, SR-05000001667-1, BRD-K87827419-001-02-8, 2-amino-3-[4-bis(2-chloroethyl)amino]phenylpropanoic acid, UNII-A960M0G5TP component SGDBTWWWUNNDEQ-LBPRGKRZSA-N, 2-amino-3-[4-[bis(2-chloroethyl)amino]phenyl]-propanoic acid, (2S)-2-azanyl-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoic acid, 2-Amino-3-{4-[bis-(2-chloro-ethyl)-amino]-phenyl}-propionic acid, (S)-2-Amino-3-{4-[bis-(2-chloro-ethyl)-amino]-phenyl}-propionic acid, 2-Amino-3-{4-[bis-(2-chloro-ethyl)-amino]-phenyl}-propionic acid(L-PAM), 2-Amino-3-{4-[bis-(2-chloro-ethyl)-amino]-phenyl}-propionic acid (Melphalan), 2-Amino-3-{4-[bis-(2-chloro-ethyl)-amino]-phenyl}-propionic acid(Melphalan), AC1OCG57, (2S)-2-azaniumyl-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoate


ID: 2075

chemical graph of compound 2075



InChIKey: SGEWCQFRYRRZDC-VPRICQMDSA-N
SMILES: C1=CC(=CC=C1C2=CC(=O)C3=C(O2)C(=C(C=C3O)O)[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5280441
synonyms found at PubChem are:
Vitexin, 3681-93-4, Apigenin 8-C-glucoside, Vitxein, UNII-9VP70K75OK, 8-beta-D-Glucopyranosyl-apigenin, EINECS 222-963-8, 9VP70K75OK, Flavone, 8-D-glucosyl-4',5,7-trihydroxy-, CHEBI:16954, 8-beta-D-Glucopyranosyl-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one, (1S)-1,5-anhydro-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-8-yl]-D-glucitol, 4H-1-Benzopyran-4-one, 5,7-dihydroxy-8-beta-D-glucopyranosyl-2-(4-hydroxyphenyl)-, 4H-1-Benzopyran-4-one, 8-beta-D-glucopyranosyl-5,7-dihydroxy-2-(4-hydroxyphenyl)-, 5,7-dihydroxy-8-beta-d-glucopyranosyl-2-(4-hydroxyphenyl)-4h-1-benzopyran-4-one, 5,7-dihydroxy-2-(4-hydroxyphenyl)-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one, 5,7-dihydroxy-2-(4-hydroxyphenyl)-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]chromen-4-one, Vitexin,(S), AC1NQX0Z, V0191, Vitexin, analytical standard, SCHEMBL25277, CHEMBL487417, CTK8F0956, DTXSID90190287, 4H-1-Benzopyran-4-one, 8-.beta.-D-glucopyranosyl-5,7-dihydroxy-2-(4-hydroxyphenyl)-, MolPort-003-935-138, SGEWCQFRYRRZDC-VPRICQMDSA-N, Apigenin 8-C-.beta.-D-glucoside, ACT02625, ZINC4245684, BDBM50362886, GC5761, MFCD00017456, AKOS025311479, AC-6086, CCG-208516, NCGC00163642-01, 521-33-5, AN-10375, LS-39593, SC-45938, (hydroxymethyl)tetrahydro-2H-pyran-2-yl)-, TR-035805, FT-0603644, N1319, C01460, 681V934, C-22262, Vitexin, primary pharmaceutical reference standard, Q-100437, 8-((2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-, 5,7,4'-Trihydroxyflavone 8-C-.beta.-D-glucopyranoside, Vitexin, United States Pharmacopeia (USP) Reference Standard, 4H-1-Benzopyran-4-one, 5,7-dihydroxy-8-.beta.-D-glucopyranosyl-2-(4-hydroxyphenyl)-, 4H-1-Benzopyran-4-one,8-b-D-glucopyranosyl-5,7-dihydroxy-2-(4-hydroxyphenyl)-, 5,7-dihydroxy-2-(4-hydroxyphenyl)-8-((2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)-4H-chromen-4-one


ID: 2076

chemical graph of compound 2076



InChIKey: SGFCERQKVVMREN-UHFFFAOYSA-N
SMILES: CCC(C)C(=O)C1=C(C2=C(C(=C1O)C)OC3=C2C(=C(C(=C3C)O)C(=O)C(C)CC)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3270699
synonyms found at PubChem are:
RHODOMYRTOXIN B, KBio2_007472, Spectrum_001834, SpecPlus_000368, Spectrum2_001651, Spectrum3_001619, Spectrum4_001671, Spectrum5_000601, AC1MN2V8, BSPBio_003257, KBioGR_002221, KBioSS_002339, DivK1c_006464, SPECTRUM1504119, SPBio_001801, CHEMBL1552997, SCHEMBL12827333, CHEBI:91507, KBio1_001408, KBio2_002336, KBio2_004904, KBio3_002477, CCG-38767, SDCCGMLS-0066792.P001, NCGC00095684-01, NCGC00095684-02, BRD-A08003242-001-01-9, 2-methyl-1-[1,3,7,9-tetrahydroxy-4,6-dimethyl-8-(2-methylbutanoyl)dibenzofuran-2-yl]butan-1-one


ID: 2077

chemical graph of compound 2077



InChIKey: SGJNQVTUYXCBKH-HNQUOIGGSA-N
SMILES: C1=CC(=C(C=C1/C=C/C2=CC(=CC(=O)O2)O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 54685921
synonyms found at PubChem are:
hispidin, 555-55-5, UNII-SSJ18CG55E, 6-(3,4-dihydroxystyrl)-4-hydroxy-2-pyrone, 6-[(E)-2-(3,4-dihydroxyphenyl)vinyl]-4-hydroxy-2H-pyran-2-one, 6-(3,4-Dihydroxystyryl)-4-hydroxy-2-pyrone, SSJ18CG55E, CHEBI:36332, 2-[(E)-2-(3,4-dihydroxyphenyl)ethenyl]-6-hydroxy-4-pyranone, (E)-6-(3,4-dihydroxystyryl)-4-hydroxy-2H-pyran-2-one, 6-[(E)-2-(3,4-dihydroxyphenyl)ethenyl]-4-hydroxy-2H-pyran-2-one, Hispidine, iso-Hispidin, AC1NS4G2, Lopac0_000634, 2-[2-(3,4-dihydroxyphenyl)ethenyl]-6-hydroxy-4h-pyran-4-one, SCHEMBL246649, CHEMBL1224512, SCHEMBL12305090, SCHEMBL16506390, CHEBI:131178, MolPort-003-941-572, HMS3261P10, Tox21_500634, Hispidin, solid, >=98% (HPLC), HSCI1_000157, MFCD01866972, AKOS015896249, AKOS030537191, ZINC100031035, CCG-204722, LP00634, QC-3972, SMP2_000346, NCGC00094001-01, NCGC00094001-02, NCGC00094001-03, NCGC00261319-01, EU-0100634, H 5257, A830701, SR-01000075911, I06-2124, SR-01000075911-1, BRD-K07325606-001-02-3, 4-hydroxy-6-(3,4-dihydroxystyryl)-2-pyrone (hispidine), 2-[(E)-2-(3,4-dihydroxyphenyl)ethenyl]-6-hydroxypyran-4-one, 6-[(E)-2-(3,4-dihydroxyphenyl)vinyl]-4-hydroxy-pyran-2-one, 2-[(E)-2-[3,4-bis(oxidanyl)phenyl]ethenyl]-6-oxidanyl-pyran-4-one, 2H-Pyran-2-one, 6-[(E)-2-(3,4-dihydroxyphenyl)ethenyl]-4-hydroxy-


ID: 2078

chemical graph of compound 2078



InChIKey: SGMZJAMFUVOLNK-UHFFFAOYSA-M
SMILES: C[N+](C)(C)CCO.[Cl-]

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6209
synonyms found at PubChem are:
CHOLINE CHLORIDE, 67-48-1, Hepacholine, Biocolina, Biocoline, Lipotril, Paresan, Luridin chloride, Choline hydrochloride, Bilineurin chloride, (2-Hydroxyethyl)trimethylammonium chloride, Cholinium chloride, 2-Hydroxy-N,N,N-trimethylethanaminium chloride, Hormocline, Neocolina, Chloride de choline, Choline chlorhydrate, Choline, chloride, Cholinechloride, Cholini chloridum, Cloruro de colina, CHOLINE (CL), Chlorure de choline, Choline (chloride), Trimethyl(2-hydroxyethyl)ammonium chloride, Colina cloruro [DCIT], Choline chloride [INN], Ethanaminium, 2-hydroxy-N,N,N-trimethyl-, chloride, (beta-Hydroxyethyl)trimethylammonium chloride, Chloride de choline [French], CCRIS 3716, Cholini chloridum [INN-Latin], HSDB 984, UNII-45I14D8O27, Cloruro de colina [INN-Spanish], Chlorure de choline [INN-French], Choline chloride solutions, EINECS 200-655-4, 2-Hydroxy-N,N,N,-trimethylethanaminium chloride, NSC 402838, (2-hydroxyethyl)trimethylazanium chloride, 2-hydroxyethyl(trimethyl)azanium chloride, AI3-18302, CHEMBL282468, Ammonium, (2-hydroxyethyl)trimethyl-, chloride, CHEBI:133341, 45I14D8O27, 2-hydroxyethyl(trimethyl)ammonium chloride, Ethanaminium, 2-hydroxy-N,N,N-trimethyl-, chloride (1:1), Colina cloruro, 2-(trimethylamino)ethan-1-ol, chloride, NSC402838, SR-01000075745, C5H14NO.Cl, AC1LAWPE, Choline Chloride,(S), ACMC-1BFXK, DSSTox_CID_325, EC 200-655-4, DSSTox_RID_75513, DSSTox_GSID_20325, SCHEMBL14957, KSC352Q3D, 62-49-7 (Parent), SPECTRUM1503428, AC1L1M13, DTXSID4020325, CTK2F2831, HMS500F09, KS-00000VXT, Choline chloride, 98% 100g, MolPort-001-785-869, SGMZJAMFUVOLNK-UHFFFAOYSA-M, HMS1922E20, HMS2093G05, HMS3652D05, Pharmakon1600-01503428, HY-B1337, hydroxyethyltrimethylammonium chloride, Tox21_200492, ANW-35351, CCG-39465, MFCD00011721, NSC758473, s4171, SBB060960, AKOS015903458, CS-4855, LS-1563, MCULE-7472714268, NE10696, NSC-402838, NSC-758473, RP20572, RTR-022668, CAS-67-48-1, WLN: Q2K1&1&1 &Q &G, NCGC00095059-01, NCGC00095059-02, NCGC00258046-01, AN-23764, K112, SC-74396, AB1002139, DB-055035, TR-022668, B1703, FT-0612603, ST24040686, ST51037199, (2-H2-Hydroxyethyl)trimethylammonium chloride, (.beta.-Hydroxyethyl)trimethylammonium chloride, (2-oCOO>>u)Ey(1/4)x>>uAE>> i section sign, AB01568267_01, A835769, I14-1931, SR-01000075745-3, SR-01000075745-5, 1CDEFBD7-7905-4D2C-BEA8-44A54D9787D3, F8889-3032, (2-Hydroxyethyl)Trimethyl-Ammonium Chloride, 2-(chlorotrimethylamino)ethanol


ID: 2079

chemical graph of compound 2079



InChIKey: SGVZDMWHXVXUBY-KAIFKDDSSA-N
SMILES: COC1=CC2=C(C=CN=C2C=C1)[C@@H]([C@H]3C[C@@H]4CCN3C[C@@H]4C=C)O.O.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 16219921
synonyms found at PubChem are:
Quinidine hydrochloride monohydrate, 6151-40-2, UNII-Z1PDY5DB92, QUINIDINE HYDROCHLORIDE, Z1PDY5DB92, Quinidine HCl, SMR000875291, Quinidine, monohydrochloride, monohydrate, MLS001333607, MLS001333608, MLS002154251, SCHEMBL1694760, CHEMBL1435413, CTK8E6870, MolPort-003-959-420, HY-B1302, Quinidine Hydrochloride, Monohydrate, Cinchonan-9-ol, 6'-methoxy-, monohydrochloride, monohydrate, (9S)-, AKOS025394776, Cinchonan-9-ol, 6'-methoxy-, hydrochloride, hydrate (1:1:1), (9S)-, CCG-220280, CS-8213, NCGC00180978-01, TX-017947, Quinidine hydrochloride monohydrate, technical grade, 6 inverted exclamation marka-Methoxycinchonan-9-ol hydrochloride monohydrate, (S)-(6-methoxyquinolin-4-yl)((2R,4S,5R)-5-vinylquinuclidin-2-yl)methanol hydrochloride hydrate


ID: 2080

chemical graph of compound 2080



InChIKey: SGXXNSQHWDMGGP-IZZDOVSWSA-N
SMILES: CN/C(=C\[N+](=O)[O-])/NCCSCC1=CSC(=N1)CN(C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3033637
synonyms found at PubChem are:
nizatidine, 76963-41-2, Axid, Acinon, Zanizal, Nizax, Calmaxid, Cronizat, Distaxid, Galitidin, Naxidine, Nizatidina, Nizatidinum, Antizid, Gastrax, Nizaxid, Panaxid, Ulcosol, Ulxid, Zinga, Splendil ER, Axid Ar, Nizatidinum [Latin], Nizatidina [Spanish], LY-139037, Tazac, Niaztidine, Niatidine, Nizatidine [USAN:BAN:INN:JAN], ZE-101, ZL-101, Acinon (TN), Axid (TN), LY 139037, N-(2-(((2-((Dimethylamino)methyl)-4-thiazolyl)methyl)thio)ethyl)-N'-methyl-2-nitro-1,1-ethenediamine, SGXXNSQHWDMGGP-IZZDOVSWSA-N, 1,1-ethenediamine, n-[2-[[[2-[(dimethylamino)methyl]-4-thiazolyl]methyl]thio]ethyl]-n'-methyl-2-nitro-, N-(4-(6-Methylamino-7-nitro-2-thia-5-aza-6-hepten-1-yl)-2-thiazolylmethyl)-N,N-dimethylamin, (E)-N-(2-(((2-((dimethylamino)methyl)thiazol-4-yl)methyl)thio)ethyl)-N'-methyl-2-nitroethene-1,1-diamine, HSDB 3574, C12H21N5O2S2, BRN 4846056, (E)-1-N'-[2-[[2-(dimethylaminomethyl)-1,3-thiazol-4-yl]methylsulfanyl]ethyl]-1-N-methyl-2-nitroethene-1,1-diamine, (E)-N-[2-[[2-(dimethylaminomethyl)-1,3-thiazol-4-yl]methylsulfanyl]ethyl]-N'-methyl-2-nitroethene-1,1-diamine, (E)-N-{2-[({2-[(dimethylamino)methyl]-1,3-thiazol-4-yl}methyl)thio]ethyl}-N'-methyl-2-nitroethene-1,1-diamine, 1,1-Ethenediamine, N-(2-(((2-((dimethylamino)methyl)-4-thiazolyl)methyl)thio)ethyl)-N'-methyl-2-nitro-, dimethyl[(4-{[(2-{[(E)-1-(methylamino)-2-nitroethenyl]amino}ethyl)sulfanyl]methyl}-1,3-thiazol-2-yl)methyl]amine, SMR000466384, CHEBI:7601, NCGC00016934-01, 1,1-Ethenediamine, N-(2-(((2-((dimethylamino)methyl)-4-thiazoly)methyl)thio)ethyl)-N'-methyl-2-nitro-, CAS-76963-41-2, Tazac;Axid;Axid AR, Tazac (TN), AC1Q1WQW, Prestwick2_000921, SCHEMBL769, SCHEMBL770, CHEMBL653, D0Q9DK, AC1MHW19, AC1Q40UA, LY-139037, Nizatidine, Nizatidine (JAN/USP/INN), MLS000759518, MLS001076680, MLS001424001, BIDD:GT0761, Nizatidine, analytical standard, GTPL7248, Nizatidine (JP17/USP/INN), MolPort-003-849-605, MolPort-027-655-252, HMS2051K04, HMS2094A15, HMS2235N05, Pharmakon1600-01505985, dimethyl[(4-{[(2-{[1-(methylamino)-2-nitroethenyl]amino}ethyl)sulfanyl]methyl}-1,3-thiazol-2-yl)methyl]amine, EBD34008, HY-B0310, ZINC1530736, NSC759289, AKOS015900643, AC-5272, CCG-100836, CS-2350, DB00585, HS-0083, NC00086, NE47126, NSC-759289, NCGC00016934-02, CPD000466384, LS-67650, SAM001246752, SC-15260, SBI-0206937.P001, AB0106214, AB2000352, C07270, D00440, AB00698253-07, AB00698253_09, 963N412, A838919, L000761, SR-01000765410, I14-0503, SR-01000765410-4, BRD-K73589491-001-05-4, BRD-K92193792-001-01-7, (E)-N-(2-((2-((dimethylamino)methyl)thiazol-4-yl)methylthio)ethyl)-N-methyl-2-nitroethene-1,1-diamine, (E)-N1'-[2-[[2-[(dimethylamino)methyl]-1,3-thiazol-4-yl]methylsulfanyl]ethyl]-N1-methyl-2-nitro-ethene-1,1-diamine, (E)-N1'-[2-[[2-[(dimethylamino)methyl]-4-thiazolyl]methylthio]ethyl]-N1-methyl-2-nitroethene-1,1-diamine, 1,1-Ethenediamine, N'-[2-[[[2-[(dimethylamino)methyl]-4-thiazolyl]methyl]thio]ethyl]-N-methyl-2-nitro-, N-(4-(6-Methylamino-7-nitro-2-thia-5-aza-6-hepten-1-yl)-2-thiazolylmethyl)-N,N-dimethylamine, N-{2-[({2-[(dimethylamino)methyl]-1,3-thiazol-4-yl}methyl)sulfanyl]ethyl}-N'-methyl-2-nitroethene-1,1-diamine


ID: 2081

chemical graph of compound 2081



InChIKey: SGZRQMALQBXAIQ-UHFFFAOYSA-N
SMILES: CC(CC1=CC=C(C=C1)O)NCC(C2=CC(=CC(=C2)O)O)O.Br

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 16037
synonyms found at PubChem are:
TH 1165A, EINECS 217-742-8, 5-(1-Hydroxy-2-((2-(4-hydroxyphenyl)-1-methylethyl)amino)ethyl)resorcinol hydrobromide, 1-(3,5-Dihydroxy-phenyl)-2-((1-(4-hydroxybenzyl)ethyl)amino)-ethanol hydrobromide, AC1Q1RJP, Benzyl alcohol, 3,5-dihydroxy-alpha-(((p-hydroxy-alpha-methylphenethyl)amino)methyl)-, hydrobromide, AC1L274R, AN-17358, LS-42859, [2-(3,5-dihydroxyphenyl)-2-hydroxyethyl]-[1-(4-hydroxyphenyl)propan-2-yl]azanium bromide, 1,3-Benzenediol, 5-(1-hydroxy-2-((2-(4-hydroxyphenyl)-1-methylethyl)amino)ethyl)-, HBr, [2-(3,5-dihydroxyphenyl)-2-hydroxy-ethyl]-[2-(4-hydroxyphenyl)-1-methyl-ethyl]ammonium bromide, 5-(1-hydroxy-2-{[1-(4-hydroxyphenyl)propan-2-yl]amino}ethyl)benzene-1,3-diol hydrobromide(1:1), Fenoterol hydrobromide, 1944-12-3, fenoterol HBr, Fenoterol (hydrobromide), Fenoterol bromide, Phenoterol hydrobromide, Partusisten, CHEBI:31601, Berotec (TN), DSSTox_CID_25419, DSSTox_RID_80867, DSSTox_GSID_45419, Fenoterol hydrobromide (JAN), Fenoterol hydrobromide [JAN], CHEMBL537445, 2-(3,5-Dihydroxyphenyl)-2-hydroxy-2'-(4-hydroxyphenyl)-1'-methyldiethylamine hydrobromide, CAS-1944-12-3, SR-01000075873, Fenoterol-d6, 5-(1-hydroxy-2-(1-(4-hydroxyphenyl)propan-2-ylamino)ethyl)benzene-1,3-diol hydrobromide, 5-[1-hydroxy-2-[1-(4-hydroxyphenyl)propan-2-ylamino]ethyl]benzene-1,3-diol hydrobromide, Prestwick_667, AC1NWASK, NCGC00016721-01, MLS001056741, ARONIS24570, SCHEMBL121549, SPECTRUM1501007, DTXSID5045419, CTK8F9746, HY-B0976A, BBC/743, MolPort-003-666-344, REGID_for_CID_5702161, SGZRQMALQBXAIQ-UHFFFAOYSA-N, HMS1568J06, HMS1921B11, Pharmakon1600-01501007, 13392-18-2 (Parent), BCP28959, ZX-AS004943, Tox21_110581, Tox21_500544, BG0190, CCG-38987, NSC757811, AKOS015909691, Tox21_110581_1, API0002690, CS-5285, KS-5090, LP00544, NSC-757811, NCGC00015430-06, NCGC00093932-01, NCGC00093932-02, NCGC00093932-03, NCGC00093932-04, NCGC00261229-01, S314, SMR000326705, ACM1286129041, EU-0100544, FT-0668501, ST51015001, VU0243157-4, D01428, F 1016, C-54957, J-012593, SR-01000075873-1, SR-01000075873-6, I14-31833, Fenoterol hydrobromide, European Pharmacopoeia (EP) Reference Standard, 2-[3,5-Dihydroxyphenyl]-2- hydroxy-2 -[4-hydroxyphenyl]- 1 -methyldiethylamine, 5-(1-hydroxy-2-{[1-(4-hydroxyphenyl)propan-2-yl]amino}ethyl)benzene-1,3-diol hydrobromide, 5-(1-hydroxy-2-{[2-(4-hydroxyphenyl)-isopropyl]amino}ethyl)benzene-1,3-diol, b romide, Fenoterol for peak identification, European Pharmacopoeia (EP) Reference Standard, 1,3-Benzenediol, 5-(1-hydroxy-2-((2-(4-hydroxyphenyl)-1-methylethyl)amino)ethyl)-, HBr (9CI), 2-(3,5-Dihydroxyphenyl)-2-hydroxy-2 inverted exclamation marka-(4-hydroxyphenyl)-1 inverted exclamation marka-methyldiethylamine hydrobromide


ID: 2082

chemical graph of compound 2082



InChIKey: SHAYBENGXDALFF-UHFFFAOYSA-N
SMILES: CNCCC=C1C2=CC=CC=C2CCC3=CC=CC=C31.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 13468
synonyms found at PubChem are:
Psychostyl, Acetexa, Allegron, Altilev, Nortrilen, Norzepine, Pamelor, Sensival, Vividyl, Aventyl allegron, Nortriptyline Hcl, Ateben hydrochloride, Nortab hydrochloride, Aventyl hydrochloride, Pamelor hydrochloride, Nortriptylin hydrochloride, Lilly 38489, HSDB 3371, EINECS 212-973-0, NSC 78248, NSC 169453, 5-(3-(Methylamino)propylidene)dibenzo(a,e)cyclohepta(1,5)diene hydrochloride, 5-(3-Methylaminopropylidene)-10,11-dihydro-5H-dibenzo(a,d)cycloheptene hydrochloride, AC1Q1RWX, 1-Propanamine, 3-(10,11-dihydro-5H-dibenzo(a,d)cyclohepten-5-ylidene)-N-methyl-, hydrochloride, 10,11-Dihydro-N-methyl-5H-dibenzo(a,d)cycloheptene-delta(sup 5,gamma)-propylamine hydrochloride, 5H-Dibenzo(a,d)cycloheptene-delta(sup 5),gamma-propylamine, 10-11-dihydro-N-methyl-, hydrochloride, AC1L21SL, Nortriptyline hydrochloride [USAN:JAN], LS-60755, 5H-Dibenzo(a,d)cycloheptene-delta(sup 5),gamma-propylamine, 10-11-dihydro-N-methyl-,hydrochloride, Nortriptyline hydrochloride, 894-71-3, Desmethylamitriptyline hydrochloride, Nortriptyline (hydrochloride), UNII-00FN6IH15D, Noramitriptyline hydrochloride, Nortriptyline monohydrochloride, MLS000069673, 00FN6IH15D, N 7048, CPD000058486, SMR000058486, Pamelor (TN), EN300-26665, 3-(10,11-Dihydro-5H-dibenzo[a,d]cyclohepten-5-ylidene)-N-methyl-1-propanamine Hydrochloride, W-109609, 3-(10,11-Dihydro-5H-dibenzo[a,d]-cyclohepten-5-ylidene)-N-methyl-1-propanamine, WLN: L C676 BY&T&J BU3M1 &GH, NSC78248, NSC169453, NSC-169453, SR-01000000223, CAS-894-71-3, 5-[3-(Methylamino)propylidene]dibenzo[a,5]diene hydrochloride, (2)10,d]cycloheptene-.delta.5.gamma.-propylamine, hydrochloride, 5-[(3-(Methylamino)propylidene]-10,d]cycloheptene hydrochloride, NORTRIPTYLINEHYDROCHLORIDE, 5H-Dibenzo[a,.gamma.-propylamine, 10,11-dihydro-N-methyl-, hydrochloride, 5H-Dibenzo[a,.gamma.-propylamine, 10-11-dihydro-N-methyl-, hydrochloride, 1-Propanamine,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-ylidene)-N-methyl-, hydrochloride, 3-(5,6-dihydrodibenzo[2,1-b:1',2'-e][7]annulen-11-ylidene)-N-methylpropan-1-amine;hydrochloride, Prestwick_366, Nortriptyline hdrochloride, Nortriptyline hydrochloride [USAN:USP:JAN], Opera_ID_1915, AC1Q3BS4, DSSTox_CID_25109, DSSTox_RID_80676, DSSTox_GSID_45109, SCHEMBL41329, MLS001077267, MLS002222206, MLS006010656, 72-69-5 (free base), AC1L9B17, CHEBI:7641, CHEMBL1201156, DTXSID2045109, REGID_for_CID_441358, CTK8G2012, AOB5370, MolPort-003-959-040, SHAYBENGXDALFF-UHFFFAOYSA-N, HMS1568D10, HY-B1417, KS-000017PT, Tox21_110048, Tox21_500868, BG0274, MFCD00058024, NSC-78248, AKOS015889095, API0003634, CCG-212718, CS-4913, KS-1306, LP00868, NC00522, NE48409, NCGC00014483-01, NCGC00094192-01, NCGC00094192-02, NCGC00261553-01, 1-Propanamine, 3-(10,11-dihydro-5H-dibenzo[ a,d]cyclohepten-5-ylidene)-N-methyl-, hydrochloride, SAM002554915, EU-0100868, FT-0673146, N0957, Nortriptyline hydrochloride (JP17/USP/INN), D00816, N 7261, C-46080, Nortriptyline hydrochloride, >=98% (TLC), powder, SR-01000000223-2, SR-01000000223-7, I01-17298, Nortriptyline Hydrochloride 1.0 mg/ml in Methanol (as free base), Nortriptyline hydrochloride, British Pharmacopoeia (BP) Reference Standard, Nortriptyline hydrochloride, European Pharmacopoeia (EP) Reference Standard, 10,11-Dihydro-5-(N-methyl-3-aminopropylidene)-5H-dibenzo[a,d]cycloheptene Hydrochloride, 3-(10,11-2H-5H-dibenzo[a,d][7]annulen-5-ylidene)-N-methyl-1-propanaminium chloride, Nortriptyline for system suitability, European Pharmacopoeia (EP) Reference Standard, Nortriptyline hydrochloride, United States Pharmacopeia (USP) Reference Standard, 37025-22-2, 8057-32-7, methyl(3-{tricyclo[9.4.0.0?,?]pentadeca-1(15),3,5,7,11,13-hexaen-2-ylidene}propyl)amine hydrochloride, N-[3-(10,11-dihydro-5H-dibenzo[a,d][7]annulen-5-ylidene)propyl]-N-methylamine hydrochloride, AC1LCW73, AKOS026750086


ID: 2083

chemical graph of compound 2083



InChIKey: SHDSXTLKCOGMKJ-ONDCXVNZSA-N
SMILES: C[C@@H]1CC[C@]23CCC4([C@@]5(CCC6[C@@](C5C=C[C@@]4(C2[C@H]1C)OC3=O)(CCC(=O)C6(C)C)C)C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6708660
synonyms found at PubChem are:
3-OXOURSAN (28-13)OLIDE, Spectrum_001361, SpecPlus_000365, Spectrum2_001781, Spectrum3_001293, Spectrum4_001732, Spectrum5_000524, BSPBio_002925, KBioGR_002144, KBioSS_001841, SPECTRUM307047, DivK1c_006461, SPBio_001701, CHEMBL3039031, KBio1_001405, KBio2_001841, KBio2_004409, KBio2_006977, KBio3_002145, CCG-38430, SDCCGMLS-0066902.P001, NCGC00178388-01, SR-05000002682, SR-05000002682-1


ID: 2084

chemical graph of compound 2084



InChIKey: SHGAZHPCJJPHSC-XFYACQKRSA-N
SMILES: CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C\C(=O)O)/C)/C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5282379
synonyms found at PubChem are:
Isotretinoin, 13-cis-Retinoic acid, Accutane, Roaccutane, Claravis, Neovitamin A acid, 13-cis-Vitamin A acid, 4759-48-2, Amnesteem, Isotrex, Teriosal, Sotret, Roaccutan, 13-cis retinoic acid, isotretinoino, Isotretinoine, Isotretinoinum, 13-RA, Absorica, Isotane, Roacutan, Isotretinoine [INN-French], Isotretinoinum [INN-Latin], Isotretinoino [INN-Spanish], CIP-Isotretinoin, RETINOIC ACID, 13-cis-, Accutane (TN), Isotretinoin (USP), 13 cis retinoic acid, UNII-EH28UP18IF, cis-Retinoic acid, Ro 4-3780, Ro-4-3780, Sotret (TN), ISORETINOIN, ISOTRETINON, CCRIS 4286, Isotretinoin [USAN:INN:BAN], HSDB 3929, 13 Cis-Retinoic Acid, (13cis)-retinoic acid, 13-cis RA, EINECS 225-296-0, Ro-43780, (7E,9E,11E,13Z)-retinoic acid, CHEMBL547, BRN 1885770, EH28UP18IF, BML2-E07, CHEBI:6067, 13-cis-retinoic acid,Isotretinoin, SHGAZHPCJJPHSC-XFYACQKRSA-N, (2Z,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoic acid, 3,7-Dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)2-cis-4-trans-6-trans-8-trans-nonatetraenoic acid, CPD000471891, Isotretinoin Retinoic acid, R 3255, (2Z,4E6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid, Myorisan, Zenatane, Isosuprea Lidose, (2Z,4E,6E,8E)-3,7-Dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6,8-nonatetraenoic Acid, (2Z,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid, SR-01000076103, accure, isotretinoina, cis-Retinoate, Isotretinoin [USAN:BAN:INN], cis retinoic acid, Roaccutane (TN), Amnesteem (TN), cis-RA, Absorica (TN), Prestwick_642, CAS-4759-48-2, Claravi (TN), Decutan (TN), Isotane (TN), Isotretinoin [USAN:USP:INN:BAN], Oratane (TN), Clarus (TN), Izotek (TN), Ro 43780, ISOTREXGEL, Isotretinoin Zinc Salt, 13 cis Isomer, Isotretinoin Zinc Salt, 13-cis-Isomer, Ro 4 3780, (13-cis)-Retinoate, AC1NQZZ4, 13cRA, Prestwick2_000256, Prestwick3_000256, Spectrum5_001795, Spectrum5_001937, (13-cis)-Retinoic acid, DSSTox_CID_3177, D00DKK, Retinoic acid, (13cis)-, DSSTox_RID_76906, DSSTox_GSID_23177, Lopac0_001081, SCHEMBL38299, BSPBio_000072, BSPBio_001331, BSPBio_003345, 4-09-00-02388 (Beilstein Handbook Reference), MLS001074662, SPECTRUM1502013, BPBio1_000080, GTPL7600, DTXSID4023177, MolPort-003-666-394, HMS1361C13, HMS1568D14, HMS1791C13, HMS1921D08, HMS1989C13, HMS2092N07, HMS2095D14, HMS2233A07, HMS3259J09, HMS3263I04, HMS3402C13, HMS3712D14, Pharmakon1600-01502013, BCP18950, ZINC3792789, Tox21_200093, Tox21_501081, BDBM50031459, LMPR01090021, NSC758156, AKOS015841158, AB03039, CCG-205158, CS-1864, DB00982, DS-3367, LP01081, NC00635, NSC-758156, RP17638, IDI1_033801, NCGC00094358-01, NCGC00094358-02, NCGC00094358-03, NCGC00094358-04, NCGC00094358-05, NCGC00094358-06, NCGC00094358-07, NCGC00094358-08, NCGC00094358-09, NCGC00094358-10, NCGC00094358-11, NCGC00094358-12, NCGC00094358-13, NCGC00094358-14, NCGC00094358-15, NCGC00257647-01, NCGC00261766-01, AN-15746, CC-29726, HY-15127, SAM002548955, SC-18589, SMR000471891, 13-cis-Retinoic acid, >=98% (HPLC), 13-cis-Retinoic acid|||Retinoid analogues, SBI-0051051.P003, LS-143465, EU-0101081, R0088, 5952-EP0930075A1, 5952-EP2295426A1, 5952-EP2311840A1, 59I482, C07058, D00348, 24210-EP2311808A1, 24210-EP2311829A1, 24210-EP2314590A1, SR-01000076103-2, SR-01000076103-5, SR-01000076103-6, SR-01000076103-9, BRD-K76723084-001-05-9, I14-16776, SR-01000076103-10, Isotretinoin, European Pharmacopoeia (EP) Reference Standard, Isotretinoin, United States Pharmacopeia (USP) Reference Standard, (2Z,4E)-3,7-Dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)-2,4,6,8-nonatetraenoic acid, Isotretinoin for peak identification, European Pharmacopoeia (EP) Reference Standard, Isotretinoin, Pharmaceutical Secondary Standard; Certified Reference Material, (2Z,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)nona-2,4,6,8-tetraenoic acid, (2Z,4E,6E,8E)-3,7-Dimethyl-9-(2,6,6-trimethyl-cyclohex-1-enyl)-nona-2,4,6,8-tetraenoic acid, 3,7-DIMETHYL-9-(2,6,6-TRIMETHYL-1-CYCLOHEXEN-1-YL)-2-CIS-4-TRANS-6-TRANS-8-TRANS-NONATETRAENOIC ACID, 3,7-DIMETHYL-9-(2,6,6-TRIMETHYL-1-CYCLOHEXEN-1-YL)-2Z,4E,6E,8E-NONATETRANENOIC ACID


ID: 2085

chemical graph of compound 2085



InChIKey: SHGAZHPCJJPHSC-YCNIQYBTSA-N
SMILES: CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C/C(=O)O)/C)/C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 444795
synonyms found at PubChem are:
Retinoic acid, tretinoin, 302-79-4, all-trans-Retinoic acid, Vitamin A acid, trans-Retinoic acid, Airol, Retin-A, ATRA, Vesanoid, Renova, Dermairol, Aknoten, Aberel, Eudyna, all-trans-Vitamin A acid, Aknefug, Cordes vas, Epi-aberel, All-trans Retinoic Acid, Atralin, Tretin M, Vitamin A1 acid, all-trans-, Retin-A Micro, all-trans-Vitamin A1 acid, all-trans-Tretinoin, Vitamin A acid, all-trans-, Effederm, Retionic acid, Retinoic acid, all-trans-, Alltrans-retinoic acid, beta-Ra, Aberela [Norway], all-(E)-Retinoic acid, Avitoin [Norway], beta-Retinoic acid, All Trans Retinoic Acid, Acnavit [Denmark], Effederm [France], Aberela, Acnavit, Avitoin, Betarretin, Retacnyl, Tretinoino, TRETINON, Vesnaroid, Ro 1-5488, A-Acido (Argentina), A-Vitaminsyre, Tretinoin, all-trans-, Cordes VAS [Germany], Retin A, Stieva-A, A-Vitaminsyre [Denmark], (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid, NSC-122758, Tretinoine [INN-French], Tretinoinum [INN-Latin], Tretinoina [INN-Spanish], Tretinoino [INN-Spanish], Retinoate, Tretinoine, .beta.-Retinoic acid, all trans-Retinoic acid, Nexret, Vitamin a acid, trans-, Tretinoin/All-Trans Retinoic Acid, Avita Gel, 15-Apo-beta-caroten-15-oic acid, tretinoin liposome, Acid A Vit (Belgium, Netherlands), all-trans-beta-Retinoic acid, Tretinoinum, Tretinoina, Tretinoin [USAN:INN:BAN], [3H]Retinoic acid, UNII-5688UTC01R, Renova (TN), 3,7-Dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6,8-nonatetraenoic acid, CCRIS 3294, Avita (TN), MLS000028588, b-Retinoic acid, HSDB 2169, AT-RA, CHEMBL38, all-trans-Retinoate, (2E,4E,6E,8E)-3,7-Dimethyl-9-(2,6,6-trimethylcyclohex-1-enyl)nona-2,4,6,8-tetraenoic acid, (all-E)-3,7-Dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6,8-nonatetraenoic acid, 2,4,6,8-Nonatetraenoic acid, 3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, (all-E)-, EINECS 206-129-0, NSC122758, all-trans-b-Retinoic acid, NSC 122758, BRN 2057223, Tretinoin (JAN/USP/INN), Atragen, Retinova, SMR000058245, BML2-E05, tretinoine (French) (EINECS), Acid, Retinoic, RETINOIC ACID, ALL TRANS, Retisol-A, CHEBI:15367, Tretinoin 0.1% cream or placebo, Acid, Vitamin A, Acide retinoique (French) (DSL), SHGAZHPCJJPHSC-YCNIQYBTSA-N, 5688UTC01R, Tretinoin (TN), trans Retinoic Acid, Tretinoin Zinc Salt, (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoic acid, Acid, trans-Retinoic, REA, Salt, Tretinoin Zinc, Zinc Salt, Tretinoin, PDT-002-002, 9-cis-RA, Retin A (TN), NCGC00017280-10, CPD000058245, DSSTox_CID_1239, R 2625, AGN 100335, 3,7-Dimethyl-9-(2,6,6-trimethylcyclohex-1-enyl)nona-2,4,6,8-all-trans-tetraenoic acid, DSSTox_RID_76031, DSSTox_GSID_21239, trans-Retinoate, beta-Retinoate, Refissa, Vesanoid (TN), 4759-48-2, 3,7-Dimethyl-9-(2,6,6-trimethyl-1-cyclohexene-1-yl)-2,4,6,8-nonatetraenoic acid (ECL), 3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)nona-2,4,6,8-tetraenoic acid, 3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2E,4E,6E,8E-tetraenoic acid, (11Z)-retinoic acid, Isotretinoin;(2Z,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid, Tretinoin Sodium Salt, Salt, Tretinoin Sodium, Sodium Salt, Tretinoin, SR-01000000239, Tretinoin Potassium Salt, Acid, all-trans-Retinoic, Potassium Salt, Tretinoin, Salt, Tretinoin Potassium, beta-all-trans-Retinoic acid, beta all trans Retinoic Acid, Acid, beta-all-trans-Retinoic, TNP00194, tretinoin sodium, 1cbr, [3H]tretinoin, [All-E]-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6,8-nonatetraenoic acid, Trans-Retinoicacid, Tretinoin [USAN:USP:INN:BAN], tretinoin potassium, (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-enyl)nona-2,4,6,8-tetr aenoic acid, CAS-302-79-4, Prestwick_424, Aberela (TN), all-(E)-Retinoate, Tretinoine (French), Retinoic acid, cis-, Stieva-A (TN), (5E)-Retinoic acid, 9-trans-retinoic acid, [3H]Vitamin A acid, Retin-A (TN), PubChem16466, 1n4h, Retinoic acid all trans, Isotretinoin Retinoicacid, 6-s-trans-retinoic acid, AC1L9GWO, Opera_ID_1055, Prestwick2_000257, Prestwick3_000257, Spectrum5_001746, Spectrum5_001933, acide retinoique (French), Vesanoid (TN) (Roche), Tretinoin (Retinoic acid), Tretinoin - Retinoic Acid, bmse000562, D02DGU, D0A8ND, UPCMLD-DP097, AC1Q1J2J, Renova (0.02% cream), SCHEMBL3145, (9Z,13Z)-Retinoic acid, Altreno (0.05% lotion), BIDD:PXR0081, Lopac0_001061, Avita (0.025% gel), BSPBio_000074, BSPBio_001500, MLS001076515, MLS002207234, MLS002222211, MLS002548861, MLS006010222, ARONIS25153, BIDD:GT0483, SPECTRUM1502016, 9-cis-retinoic acid (9cRA), [3H]RA, BPBio1_000082, cid_444795, GTPL2644, .beta.-all-trans-Retinoic acid, all-trans-retinoic acid (ATRA), DTXSID7021239, Retinoic acid, 98% 250mg, SCHEMBL19091395, BDBM31883, HMS502N05, QCR-120, Retinoic acid, all-trans-(8CI), MolPort-000-883-857, BCPP000036, HMS1361K22, HMS1568D16, HMS1791K22, HMS1921D14, HMS1989K22, HMS2089D20, HMS2092N11, HMS2095D16, HMS2236N03, HMS3259E11, HMS3263E04, HMS3402K22, HMS3712D16, Pharmakon1600-01502016, Retinoic acid, all-trans- (8CI), ACT00012, BCP01405, Tox21_110812, Tox21_202330, Tox21_300305, Tox21_501061, AGN100335, All-trans Retinoic Acid (Tretinoin), CCG-39912, LMPR01090019, MFCD00001551, NSC759631, s1653, SBB065722, ZINC12358651, 13497-05-7 (hydrochloride salt), AKOS000280845, Tox21_110812_1, AC-6824, AN-9660, CS-1269, GS-3578, LP01061, LS-1154, NC00481, NSC-759631, RP17637, IDI1_000903, IDI1_033970, NCGC00017280-05, NCGC00017280-06, NCGC00017280-07, NCGC00017280-08, NCGC00017280-09, NCGC00017280-12, NCGC00017280-15, NCGC00017280-16, NCGC00017280-17, NCGC00017280-18, NCGC00017280-19, NCGC00017280-20, NCGC00017280-23, NCGC00021808-04, NCGC00021808-05, NCGC00021808-06, NCGC00021808-07, NCGC00021808-09, NCGC00021808-11, NCGC00021808-14, NCGC00021808-15, NCGC00254179-01, NCGC00259879-01, NCGC00261746-01, trans-Retinoic acid|||Retinoid analogues, AJ-61307, BC202905, BP-20401, BR-73126, HY-14649, KB-66303, Retinoic acid, >=98% (HPLC), powder, SAM002264647, SC-16932, ST057075, SBI-0051031.P003, AB1009361, ST2407905, EU-0101061, R0064, 02T794, 5914-EP2275412A1, 5914-EP2292576A2, C00777, D00094, J10054, S-1635, 33998-EP2275420A1, 33998-EP2295055A2, 33998-EP2295416A2, 33998-EP2295426A1, 33998-EP2295427A1, 33998-EP2298748A2, 33998-EP2298764A1, 33998-EP2298765A1, 33998-EP2298768A1, 33998-EP2301928A1, 33998-EP2305642A2, 33998-EP2308833A2, 33998-EP2308861A1, 33998-EP2311453A1, 33998-EP2311808A1, 33998-EP2311829A1, 33998-EP2311840A1, AB00052318-15, AB00052318-16, AB00052318-17, AB00052318_18, AB00052318_19, L000833, I04-0008, I14-2351, Q-200610, SR-01000000239-3, SR-01000000239-4, SR-01000000239-6, SR-01000000239-7, BRD-K06926592-001-01-7, BRD-K71879491-001-15-0, BRD-K71879491-001-22-6, SR-01000000239-12, SR-01000000239-13, SR-01000000239-14, SR-01000000239-15, WLN: L6UTJ A1 B1U1Y1&U2U1Y1&U1VQ C1 C1, ATRA; Tretinoin; Vitamin A acid; all-trans-Retinoic acid, Tretinoin, European Pharmacopoeia (EP) Reference Standard, WLN: L6UTJ A1 B1U1Y1 & U2U1Y1 & U1VQ C1 C1, Tretinoin, United States Pharmacopeia (USP) Reference Standard, Vesanoid, Airol, Renova, Atralin, Retin-A, Avita, Tretinoin, 3,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6,8-nonatetraenoic acid, Tretinoin, Pharmaceutical Secondary Standard; Certified Reference Material, (2E,4E)-3,7-Dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)-2,4,6,8-nonatetraenoic acid, (4E,6E,8E)-9-(2,6,6-Trimethyl-1-cyclohexenyl)-3,7-dimethyl-2,4,6,8-nonatetraenoic acid, (all-E)-3,7-Dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6,8-nonatetraenoate, 2,4,6,8-Nonatetranoic acid, 3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, 2,6,8-Nonatetranoic acid, 3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, 3,7-Dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6,8-nonatetraenoate, 3,7-Dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2E,4E,6E,8E,-nonatetraenoic acid, all-trans-3,7-Dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6,8-nonatetraenoic Acid, (2E,4E,6E,8E)-3,7-Dimethyl-9-(2,6,6-trimethyl-cyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid, 187175-63-9, 2,4, 6,8-Nonatetranoic acid, 3,7-dimethyl-9-(2,6, 6-trimethyl-1-cyclohexen-1-yl)-, (2E, 4E, 6E, 8E)-, 2,4,6,8-Nonatetraenoic acid, 3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)--, (all trans)-, 2,4,6,8-Nonatetranoic acid, 3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, (all trans)-, 2,6,8-Nonatetraenoic acid, 3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, (all-E)-, 3,7-Dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6,8-nonatetraenoic acid-, (all trans)-, 56573-65-0, 7005-78-9, 97950-17-9


ID: 2086

chemical graph of compound 2086



InChIKey: SHIBSTMRCDJXLN-KCZCNTNESA-N
SMILES: C[C@]12CC[C@@H](C[C@H]1CC[C@@H]3[C@@H]2C[C@H]([C@]4([C@@]3(CC[C@@H]4C5=CC(=O)OC5)O)C)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 15478
synonyms found at PubChem are:
Digoxigenin, 1672-46-4, Lanadigenin, Digoxigenine, UNII-NQ1SX9LNAU, CHEBI:42098, HSDB 7108, NQ1SX9LNAU, EINECS 216-806-2, BRN 0096479, 3-beta,12-beta,14-Trihydroxy-card-20(22)-enolide, 3-beta,12,14-Trioxy-digen-(20:22)-olid [German], 3-beta,12,14-Trioxy-carden-(20:22)-olid [German], 3beta,12beta,14-trihydroxy-5beta-card-20(22)-enolide, Cardogenen-(20:22)-triol-(3-beta,12,14) [German], (3beta,5beta,12beta)-3,12,14-Trihydroxycard-20(22)-enolide, delta-sup(20:22)-3-beta,12-beta,14,21-Tetrahydroxynorcholenic acid lactone, 5-beta-CARD-20(22)-ENOLIDE, 3-beta,12-beta,14-TRIHYDROXY-, 3-[(3S,5R,8R,9S,10S,12R,13S,14S,17R)-3,12,14-trihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one, 4-(3,12,14-TRIHYDROXY-10,13-DIMETHYL-HEXADECAHYDRO-CYCLOPENTA[A]PHENANTHREN-17-YL)-5H-FURAN-2-ONE, SR-01000841253, Lanadigigenin, 1lke, 3|A-Digoxigenin, CAS-1672-46-4, 4j8t, 4j9a, Prestwick0_000883, Prestwick1_000883, Prestwick2_000883, Prestwick3_000883, bmse000735, Epitope ID:180303, 3-beta,12,14-Trioxy-carden-(20:22)-olid, 3-beta,12,14-Trioxy-digen-(20:22)-olid, CHEMBL1153, DSSTox_CID_30333, DSSTox_GSID_51778, SCHEMBL21105, BSPBio_000666, 5-18-04-00380 (Beilstein Handbook Reference), MLS002154050, SPBio_002885, AC1L25Z9, AC1Q69N3, BPBio1_000734, CARDOGENEN-(20:22)-TRIOL-(3-beta,12,14), Digoxigenin, analytical standard, DTXSID6051778, CTK8F9202, MolPort-004-955-165, SHIBSTMRCDJXLN-KCZCNTNESA-N, BDBM225707, CS337, HMS1570B08, HMS2097B08, HMS2233P09, HMS3714B08, HY-B1025, ZINC3982471, Tox21_303893, 2376AH, LMST01120008, AKOS015915909, CCG-220883, CS-4542, DB03671, NCGC00017309-03, NCGC00142481-02, NCGC00357149-01, AJ-47586, CC-26801, LS-52505, SMR001233370, ST056392, AB00513944, 6459-EP1441224A2, 6459-EP2269992A1, 6459-EP2272516A2, 6459-EP2277898A2, 6459-EP2298312A1, 6459-EP2316937A1, AB00513944_05, 5|A,20(22)-Cardenolide-3|A,12|A,14-triol, C-21538, 5beta,20(22)-Cardenolide-3beta,12beta,14-triol, J-010346, SR-01000841253-2, SR-01000841253-3, BRD-K18619710-001-03-7, I14-53600, 3beta,12beta,14-Trihydroxy-5beta,20(22)-cardenolide, (3b,5b,12b)-3,12,14-trihydroxycard-20(22)-enolide, Digoxigenin, European Pharmacopoeia (EP) Reference Standard, 3beta,12beta,14beta,21-Tetrahydroxy-20(22)-norcholenic acid lactone, Card-20(22)-enolide, 3,12,14-trihydroxy-, (3-beta,5-beta,12-beta)-, Card-20(22)-enolide, 3,12,14-trihydroxy-, (3-beta,5-beta,12-beta)- (9CI), 4-((1S,2S,5S,11S,15S,7R,10R,14R,16R)-5,11,16-trihydroxy-2,15-dimethyltetracycl o[8.7.0.0<2,7>.0<11,15>]heptadec-14-yl)-5-hydrofuran-2-one, 4-((3S,8R,9S,10S,12R,13S,14S,17R)-3,12,14-trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)furan-2(5H)-one


ID: 2087

chemical graph of compound 2087



InChIKey: SIACJRVYIPXFKS-UHFFFAOYSA-N
SMILES: C1=CC(=CC=C1CN)S(=O)(=O)N.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 67313
synonyms found at PubChem are:
Mafenide hydrochloride, 138-37-4, 4-Aminomethylbenzenesulfonamide hydrochloride, Marfanil, 4-(Aminomethyl)benzenesulfonamide hydrochloride, Masudin, Morfanil, Homosulfamine, Homosulfamine hydrochloride, Emilene hydrochloride, Sulfamylon hydrochloride, Mafenide HCl, Sulfbenzamine hydrochloride, 4-Homosulfanilamide hydrochloride, Mesudin hydrochloride, Ambamide hydrochloride, Mesudrin hydrochloride, Neofamid hydrochloride, Homosulfanilamide hydrochloride, Maphenide hydrochloride, Mafenide (hydrochloride), p-Aminomethylphenylsulfonamide hydrochloride, UNII-3J751V0284, alpha-Amino-p-toluenesulfonamide hydrochloride, NSC 3527, p-(Aminomethyl)benzenesulfonamide hydrochloride, EINECS 205-325-3, p-(Aminomethyl)benzenesulfonamide monohydrochloride, AI3-16157, p-Toluenesulfonamide, alpha-amino-, hydrochloride, Benzenesulfonamide, 4-(aminomethyl)-, monohydrochloride, 3J751V0284, C7H10N2O2S.HCl, DSSTox_CID_25296, DSSTox_RID_80787, DSSTox_GSID_45296, p-Toluenesulfonamide, alpha-amino-, monohydrochloride, 4-(Aminomethyl)Benzene-1-Sulfonamide Hydrochloride, 4-(aminomethyl)benzenesulfonamide;hydrochloride, NCGC00016403-01, CAS-138-37-4, SR-01000003113, Prestwick_640, sulfamylonhydrochloride, a-amino-p-toluenesulfonamide hydrochloride, AC1Q3ETD, AC1L27AC, homosulfanilamidehydrochloride, MLS002222235, SCHEMBL425524, SPECTRUM1500372, WLN: ZSWR D1Z & GH, CHEMBL1593568, DTXSID6045296, CTK8B3767, HY-B0614B, NSC3527, MolPort-003-056-401, SIACJRVYIPXFKS-UHFFFAOYSA-N, HMS1568B13, HMS1920J11, p-Toluenesulfonamide, hydrochloride, Pharmakon1600-01500372, 4-sulfamoylbenzylamine hydrochloride, BCP03071, KS-000009JQ, NSC-3527, p-aminomethylbenzene sulfonamide hcl, 4-Aminomethylbenzenesulfonamide, HCl, Tox21_110423, ANW-43135, CCG-39706, MFCD00013005, NSC757093, AKOS008967290, p-AMINOMETHYLBENZENE-SULFONAMIDE, p-Toluenesulfonamide, monohydrochloride, Tox21_110423_1, 4-aminosulfonylbenzylamine hydrochloride, CS-4481, GS-4340, NSC-757093, RL01677, TRA0051493, NCGC00016403-06, NCGC00094711-01, NCGC00094711-02, NCGC00094711-03, NCGC00094711-04, 4CA-0795, AC-29745, AN-43815, BC200603, BR-32299, p-aminomethylphenylsulfonamidehydrochloride, SC-00739, SMR001307253, SY020868, p-AMINOMETHYLBENZENE-SULFONAMIDE HCl, 4-(aminosulfonyl)-benzylamine hydrochloride, AB0022213, KB-187386, KB-189311, LS-154100, p-aminomethylbenzenesulfonamide hydrochloride, ST2410990, TR-005078, 4-(AMINOMETHYL)BENZENESULFONAMIDE HCL, AM20060505, FT-0631805, p-aminomethyl-benzenesulfonamide hydrochloride, W3016, 4-(Aminomethyl)benzenesulfonamideHydrochloride, 4-aminomethyl-benzenesulfonamide hydrochloride, p-Aminomethyl benzene sulfonamide hydrochloride, alpha-amino-p-toluenesulfonamidmonohydrochloride, .alpha.-Amino-p-toluenesulfonamide hydrochloride, 4-(aminomethyl)benzene-sulfonamide hydrochloride, I01-2860, J-007128, J-521664, SR-01000003113-4, 4-(Aminomethyl)benzenesulfonamide hydrochloride (1:1), F0856-0073, Benzenesulfonamide, 4-(aminomethyl)-, monohydrochloride (9CI), 4-Aminomethylbenzenesulfonamide hydrochloride, analytical standard, >=95%, AKOS026750005, 4-(aminomethyl)benzenesulfonamide, chloride, SBB059851, AKOS023093332, MCULE-3873724782, ST51046115


ID: 2088

chemical graph of compound 2088



InChIKey: SIEYLFHKZGLBNX-UHFFFAOYSA-N
SMILES: CCCCN1CCCCC1C(=O)NC2=C(C=CC=C2C)C.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 64737
synonyms found at PubChem are:
Bupivacaine hydrochloride, Bupivacaine HCL, 14252-80-3, 18010-40-7, Vivacaine, 1-butyl-N-(2,6-dimethylphenyl)piperidine-2-carboxamide hydrochloride, Marcain, Bupivacaine (hydrochloride), (+-)-Bupivacaine hydrochloride, Bupivacaine hydrochloride [JAN], EINECS 241-917-8, AH-2250, CHEBI:31322, 1-Butyl-N-(2,6-dimethylphenyl)-2-piperidinecarboxamide monohydrochloride, 2',6'-Pipecoloxylidide, 1-butyl-, hydrochloride, 2-Piperidinecarboxamide, 1-butyl-N-(2,6-dimethylphenyl)-, monohydrochloride, 2',6'-Pipecoloxylidide, 1-butyl-, monohydrochloride, LAC-43, Win 11,318, Bupivacaine hydrochloride anhydrous, Bicain, Win 11318 HCl, SMR000058218, WIN-11318, MNarcaine hydrochloride, 14252-80-3 (HCl), 18010-40-7 (HCl), 73360-54-0 (HCl.H2O), Bupivacaine hydrochloride kit, LAC 43, SR-05000001874, levobupivacaine hydrochloride (anhydrous), SKY 0302, Prestwick_894, AH 2250, Marcaine hydrochloride preservation free, bupivacain hydrochloride, 2-Piperidinecarboxamide, 1-butyl-N-(2,6-dimethylphenyl)-, monohydrochloride, monohydrate, Bupivacaine hydrochloride preservation free, AC1L21TT, bupivacaine monohydrochloride, SCHEMBL34374, MLS001361336, MLS002154259, SPECTRUM1503818, Bupicacain hydrochlorid-1-wasser, CHEMBL1200396, DTXSID0030877, CHEBI:77441, CTK8F8361, HY-B0405A, KS-00000XIC, AOB6341, Bupivacaine hydrochloride [USAN], MolPort-003-666-503, SIEYLFHKZGLBNX-UHFFFAOYSA-N, HMS1568N12, HMS1922I12, Pharmakon1600-01503818, Bupivacaine hydrochloride (Marcain), ACT04725, BCP22697, BCP22708, KS-00000M4Q, (+-)-1-Butyl-2',6'-pipecoloxylidide monohydrochloride, monohydrate, bupivacaine hydrochloride (anhydrous), CCG-39367, NSC119660, NSC758631, s2454, AKOS015889322, Marcain;Marcaine;Sensorcaine;Vivacaine, API0001784, BCP9000461, CS-2505, FD-0235, LS-2113, MCULE-5414144502, NSC-119660, NSC-758631, NCGC00095072-01, NCGC00095072-02, AK481431, AN-14283, AN-18756, H875, KB-48484, SC-24334, SC-94629, ST013772, AB2000569, AX8018312, LS-185059, B3925, FT-0082605, FT-0607564, FT-0623287, 52B803, K-4565, I01-1868, J-011502, Q-100158, SR-05000001874-3, 1-butyl-2-piperidylformo-2',6'-xylidide hydrochloride, 2-Piperidinecarboxamide,6-dimethylphenyl)-, hydrochloride, 1-butyl-2-[(2,6-dimethylphenyl)carbamoyl]piperidinium chloride, N-(2,6-dimethylphenyl)(1-butyl(2-piperidyl))carboxamide, chloride, rac-1-butyl-2-[(2,6-dimethylphenyl)carbamoyl]piperidinium chloride, rac-1-butyl-N-(2,6-dimethylphenyl)piperidine-2-carboxamide hydrochloride, 2-Piperidinecarboxamide, 1-butyl-N-(2,6-dimethylphenyl)-, monohydrochlorde, monohydrate, 1-Butyl-N-(2,6-dimethylphenyl)-2-piperidinecarboxamide hydrochloride dl-1-n-Butylpiperidine-2-carboxylic acid 2,6-dimethylanilide hydrochloride, 15233-43-9, AKOS026749767, FT-0651247


ID: 2089

chemical graph of compound 2089



InChIKey: SIQPXVQCUCHWDI-UHFFFAOYSA-N
SMILES: CCCN1C2=C(C(=O)NC1=O)NC=N2

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 1676
synonyms found at PubChem are:
ENPROFYLLINE, 3-Propylxanthine, 3-n-Propylxanthine, 41078-02-8, Enprofilina, Enprofyllinum, Nilyph, Oxeze, Enprofilina [INN-Spanish], Enprofyllinum [INN-Latin], Enprofylline [USAN:INN], 3,7-Dihydro-3-propyl-1H-purine-2,6-dione, D-4028, UNII-DT7DT5E518, 3-propyl-3,7-dihydro-1H-purine-2,6-dione, EINECS 255-201-8, 1H-Purine-2,6-dione, 3,7-dihydro-3-propyl-, Enprofylline (USAN/INN), 3-Propyl-3,7-dihydro-purine-2,6-dione, CHEMBL279898, DT7DT5E518, 3-propyl-7H-purine-2,6-dione, CHEBI:126237, 3-propyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione, NCGC00015824-07, 3-Propyl-1H-purine-2,6(3H,7H)-dione, 3-Propyl-1H-purine-2,6(3H,9H)-dione, 1H-Purine-2,6-dione,3,9-dihydro-3-propyl-, P 5679, AC1L1BZI, AC1Q6LGE, Lopac-P-5679, D09AMZ, DSSTox_CID_25186, DSSTox_RID_80733, DSSTox_GSID_45186, Lopac0_000910, MLS000069700, SCHEMBL156402, 3-Propylxanthine (enprofylline), DTXSID9045186, SCHEMBL18029491, CTK4I4231, MolPort-020-915-589, SIQPXVQCUCHWDI-UHFFFAOYSA-N, HMS2234D09, HMS3262F22, HMS3369J09, ZINC403567, BCP14343, Tox21_110232, Tox21_500910, BDBM50001493, MFCD00043205, PDSP1_001019, PDSP1_001202, PDSP2_001003, PDSP2_001186, AKOS006271777, AKOS013464325, CCG-204992, DB00824, LP00910, VA10810, 3-propyl-1,9-dihydropurine-2,6-dione, NCGC00015824-01, NCGC00015824-02, NCGC00015824-03, NCGC00015824-04, NCGC00015824-05, NCGC00015824-06, NCGC00015824-08, NCGC00015824-09, NCGC00022716-03, NCGC00022716-04, NCGC00022716-05, NCGC00261595-01, AJ-22159, KB-50533, SMR000058496, ZB013298, CAS-41078-02-8, LS-127057, EU-0100910, FT-0630617, D 4028, D04006, L000242, SR-01000000173, 3-propyl-2,3,6,9-tetrahydro-1H-purine-2,6-dione, SR-01000000173-2, 3-Propyl-3,7-dihydro-purine-2,6-dione(enprofylline), Z1945707486


ID: 2090

chemical graph of compound 2090



InChIKey: SISOFUCTXZKSOQ-ZHACJKMWSA-N
SMILES: CC1=CC=CC(=N1)/C=C/C2=CC=CC=C2

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5311432
synonyms found at PubChem are:
SIB 1893, SIB-1893, 2-methyl-6-(2-phenylethenyl)pyridine, 6266-99-5, SIB1893, 2-methyl-6-[(E)-2-phenylethenyl]pyridine, 7370-21-0, CHEMBL88612, MLS002607995, (E)-2-methyl-6-styrylpyridine, [E]-2-Methyl-6-[2-phenylethenyl]pyridine, (E)-2-Methyl-6-[2-phenylethenyl]pyridine, SR-01000076143, Lopac0_001171, Pyridine,2-methyl-6-(2-phenylethenyl)-, AC1NSKMI, AC1Q4VO3, GTPL1432, BDBM86715, CHEBI:93178, MolPort-003-959-634, HMS3263L03, 2-[(E)-Styryl]-6-methylpyridine, NSC36665, ZINC3941522, SIB 1893, >99%, solid, Tox21_501171, 2-Methyl-6-((E)-styryl)-pyridine, BDBM50084141, MFCD02262120, NSC-36665, PDSP1_001571, PDSP2_001555, AKOS006279967, CCG-205245, LP01171, CAS_5311432, NSC_5311432, NCGC00025046-02, NCGC00025046-03, NCGC00025046-04, NCGC00025046-05, NCGC00025046-06, NCGC00261856-01, 2-Methyl-6-styryl-pyridine(SIB-1893), BC600133, KB-60434, SMR000326914, (E)-2-Methyl-6-(2-phenylethyl)-pyridine, KB-231610, EU-0101171, S 9311, L000561, SR-01000076143-1, SR-01000076143-3, BRD-K67439147-001-01-7


ID: 2091

chemical graph of compound 2091



InChIKey: SIXVQHIRXMPXGZ-QHAWAJNXSA-N
SMILES: CC(C)C1=CC2=C(C=C1)[C@]3(CCC[C@@]([C@@]3(CC2)C)(C)C(=O)N)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 53320719
synonyms found at PubChem are:
Dehydroabietamide, CHEMBL1652147


ID: 2092

chemical graph of compound 2092



InChIKey: SJXJEAQVHBGSDL-BTQNPOSSSA-N
SMILES: CN1CCC2=C3[C@H]1CC4=C(C3=CC(=C2)O)C(=C(C=C4)O)O.Br

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 11957531
synonyms found at PubChem are:
R(-)-2-Hydroxyapomorphine hydrobromide, R(-)-2,10,11-Trihydroxyaporphine hybrobromide, 77630-01-4, MLS000860019, SMR000326877, R(-)-2 10 11-TRIHYDROXYAPORPHINE, R(-)-2,10,11-Trihydroxyaporphine hydrobromide, EU-0100445, SCHEMBL4923294, CHEMBL1257041, DTXSID60474682, Tox21_500445, CCG-221749, LP00445, NCGC00261130-01, D-029, VU0254273-2, R()-2,10,11-Trihydroxyaporphine hydrobromide, SR-01000075371, SR-01000075371-1


ID: 2093

chemical graph of compound 2093



InChIKey: SJZHCCUPAKHVFK-VSXUVRPXSA-N
SMILES: C[C@H]1[C@H]2[C@H](CC3[C@@]2([C@@H](C(=O)C4C3CC[C@@H]5[C@@]4(CC[C@@H](C5)OC(=O)C)C)OC(=O)C)C)O[C@]16CCC(CO6)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6708609
synonyms found at PubChem are:
Spectrum_000791, SpecPlus_000220, Spectrum2_001169, Spectrum4_001430, Spectrum5_000260, KBioGR_001880, KBioSS_001271, DivK1c_006316, SPBio_001157, KBio1_001260, KBio2_001271, KBio2_003839, KBio2_006407, 11-KETOROCKOGENIN ACETATE


ID: 2094

chemical graph of compound 2094



InChIKey: SKAIDWFZCIKFIY-XYOKQWHBSA-N
SMILES: C=CCOc1ccccc1/C=C(\C#N)/c2c(c(n[nH]2)N)C#N

biological descriptors:

CFTR relevance: CFTR activator

Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown

reference list:

"W Namkung" "J Park" "Y Seo" "AS Verkman"


CID is 5760598
synonyms found at PubChem are:
AC1NXVU7, ZINC8565361, STK389064, AKOS000113050, BAS 00858152, SR-01000418461, SR-01000418461-1, 3-[2-(2-Allyloxy-phenyl)-1-cyano-vinyl]-5-amino-1H-pyrazole-4-carbonitrile, 3-amino-5-[(Z)-1-cyano-2-(2-prop-2-enoxyphenyl)ethenyl]-1H-pyrazole-4-carbonitrile, 5-amino-3-{(Z)-1-cyano-2-[2-(prop-2-en-1-yloxy)phenyl]ethenyl}-1H-pyrazole-4-carbonitrile


ID: 2095

chemical graph of compound 2095



InChIKey: SKAWDTAMLOJQNK-UHFFFAOYSA-N
SMILES: CCOC(=O)C(CC1=CC=C(C=C1)O)NC(=O)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 2004
synonyms found at PubChem are:
ethyl N-acetyltyrosinate, acetyltyrosine ethyl ester, ACETYL TYROSINE ETHYL ESTER, Ethyl acetyltyrosine, Ethyl acetyltyrosinate, Acetyl-L-tyrosine ethyl ester, N-Acetyl-L-tyrosyl ethyl ester, ethyl 2-acetamido-3-(4-hydroxyphenyl)propanoate, N-Acetyltyrosine ethyl ester, Ethyl (2S)-2-(acetylamino)-3-(4-hydroxyphenyl)propanoate, NSC 64725, NSC 87506, Spectrum_000396, AC1L1CPO, Spectrum2_001345, Spectrum3_001394, Spectrum4_000107, Spectrum5_001342, N-acetyl-l-tyr ethyl ester, NCIOpen2_003135, BSPBio_003008, CBDivE_014491, KBioGR_000434, KBioSS_000876, DivK1c_000250, SCHEMBL468858, SPECTRUM1500695, SPBio_001529, ARONIS001784, CHEMBL1354672, CTK9A5467, HMS500M12, KBio1_000250, KBio2_000876, KBio2_003444, KBio2_006012, KBio3_002228, SKAWDTAMLOJQNK-UHFFFAOYSA-, CHEBI:110178, MolPort-001-495-443, NINDS_000250, SKAWDTAMLOJQNK-UHFFFAOYSA-N, HMS1921E08, AC1Q3239, AC1Q6405, NSC64725, NSC87506, ACETYL-L-TYROSINE,ETHYL ESTER, CCG-39283, NSC-64725, NSC-87506, STK048746, AKOS000491736, AKOS016352351, MCULE-6893452025, IDI1_000250, KS-00003V63, Tyrosine, N-acetyl-, ethyl ester, L-, NCGC00094836-01, NCGC00094836-02, NCGC00094836-03, ST45038599, BRD-A55063801-001-02-6, Ethyl 2-(acetylamino)-3-(4-hydroxyphenyl)propanoate, Z57205547, 2-(Acetylamino)-3-(4-hydroxyphenyl)propanoic acid ethyl ester, 30697-69-9, InChI=1/C13H17NO4/c1-3-18-13(17)12(14-9(2)15)8-10-4-6-11(16)7-5-10/h4-7,12,16H,3,8H2,1-2H3,(H,14,15)


ID: 2096

chemical graph of compound 2096



InChIKey: SKCUFZLDTAYNBZ-UHFFFAOYSA-N
SMILES: CC1=CC(=C(C2=C1C(=O)OC3=C(O2)C4=C(C(=C3C)O)C(=O)OC4O)C=O)OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 73677
synonyms found at PubChem are:
STICTIC ACID, 549-06-4, NSC87511, NSC-87511, CHEMBL173530, 1,3-Dihydro-1,4-dihydroxy-10-methoxy-5,8-dimethyl-3,7-dioxo-7H-isobenzofuro(4,5-b)(1,4)benzodioxepin-11-carboxaldehyde, 20426-13-5, 7H-Isobenzofuro[4,5-b][1,4]benzodioxepin-11-carboxaldehyde,1,3-dihydro-1,4-dihydroxy-10-methoxy-5,8-dimethyl-3,7-dioxo-, 7H-Isobenzofuro(4,5-b)(1,4)benzodioxepin-11-carboxaldehyde, 1,3-dihydro-1,4-dihydroxy-10-methoxy-5,8-dimethyl-3,7-dioxo-, 7H-Isobenzofuro[4,5-b][1,4]benzodioxepin-11-carboxaldehyde, 1,3-dihydro-1,4-dihydroxy-10-methoxy-5,8-dimethyl-3,7-dioxo-, C19H14O9, NSC 87511, Spectrum_000600, Spectrum2_000307, Spectrum3_001185, Spectrum4_001446, Spectrum5_000031, Stictic acid (StA), 1, AC1L2KA7, AC1Q6O4T, BSPBio_002829, KBioGR_001931, KBioSS_001080, SPECTRUM300006, cid_73677, MLS001049107, REGID_for_CID_73677, SPBio_000274, SCHEMBL13495711, CHEBI:93839, CTK5A2753, KBio2_001080, KBio2_003648, KBio2_006216, KBio3_002329, MolPort-002-513-899, SKCUFZLDTAYNBZ-UHFFFAOYSA-N, HMS2271H11, BDBM50056922, CCG-38584, AKOS027326813, MCULE-1616140952, SDCCGMLS-0066543.P001, NCGC00095566-01, NCGC00095566-02, NCGC00095566-03, NCI60_041935, SMR000386939, NCGC00095566-02!STICTIC ACID, dihydroxy-methoxy-dimethyl-dioxo-[?]carbaldehyde, SR-01000758942, SR-01000758942-2, BRD-A29578214-001-02-7, BRD-A29578214-001-08-4, 1,4-Dihydroxy-10-methoxy-5,8-dimethyl-3,7-dioxo-1,3-dihydro-7H-2,6,12-trioxabenzo[5,6]cyclohepta[1,2-E]indene-11-carbaldehyde #, 1,4-Dihydroxy-10-methoxy-5,8-dimethyl-3,7-dioxo-1,3-dihydro-7H-benzo[e]furo[3'',4'':3,4]benzo[b][1,4]dioxepine-11-carbaldehyde, Isophthalaldehydic acid,.alpha.2,4,6-tetrahydroxy-2,5-xylyl)oxy]-4-methoxy-6-methyl-, .gamma.-lactone, .epsilon.-lactone


ID: 2097

chemical graph of compound 2097



InChIKey: SKPLBLUECSEIFO-UHFFFAOYSA-N
SMILES: C1=CC(=CC=C1OCC(COC(=O)N)O)Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 2724
synonyms found at PubChem are:
CHLORPHENESIN CARBAMATE, Maolate, 886-74-8, Rinlaxer, 3-(4-Chlorophenoxy)-2-hydroxypropyl carbamate, Chlorphensin carbamate, Kolpicortin-sine, 3-(p-Chlorophenoxy)-2-hydroxypropyl carbamate, 3-(p-Chlorophenoxy)-1,2-propanediol 1-carbamate, 3-(4-Chlorophenoxy)-1,2-propanediol-1-carbamate, NSC 82943, Carbamic acid, 3-(p-chlorophenoxy)-2-hydroxypropyl ester, 3-(p-Chlorophenoxy)-1,2-propanediol-1-carbamate, U 19646, U-19,646, 1,2-Propanediol, 3-(p-chlorophenoxy)-, 1-carbamate, HSDB 3031, 1,2-Propanediol, 3-(4-chlorophenoxy)-, 1-carbamate, Chlorphenesin carbamate [USAN:JAN], EINECS 212-954-7, BRN 1978575, CHEBI:3643, SKPLBLUECSEIFO-UHFFFAOYSA-N, NSC82943, carbamic acid 3-(p-chlorophenoxy)-2-hydroxypropyl ester, (3-p-Chlorophenoxy)-2-hydroxypropylcarbamate, C10H12ClNO4, [3-(4-chlorophenoxy)-2-hydroxypropyl] carbamate, 1,2-propanediol-3-(p-chlorophenoxy)-1-carbamate, 3-[4-Chlorophenoxy]-1,2-propanediol-1-carbamate, 1,2-Propanediol,3-(4-chlorophenoxy)-, 1-carbamate, W-100393, NCGC00016548-01, CAS-886-74-8, Prestwick_882, Maolate (TN), AC1L1EBN, Prestwick0_000234, Prestwick1_000234, Prestwick2_000234, Prestwick3_000234, DSSTox_CID_2803, D0VB0U, AC1Q3ON3, WLN: ZVO1YQ1OR DG, DSSTox_RID_76735, DSSTox_GSID_22803, SCHEMBL34492, BSPBio_000307, MLS002154243, SPBio_002228, BPBio1_000339, CHEMBL607710, DTXSID5022803, CTK5G1170, HMS1568P09, HMS2095P09, HMS2232O23, HMS3371A08, HMS3712P09, Tox21_110487, NSC-82943, Chlorphenesin carbamate (JP17/USAN), CCG-220234, VZ31569, 1, 3-(p-chlorophenoxy)-, 1-carbamate, NCGC00179607-01, NCGC00179607-03, 1, 3-(4-chlorophenoxy)-, 1-carbamate, CC-25726, LS-49160, SMR001233511, FT-0602972, C07930, D00770, [3-(4-chlorophenoxy)-2-hydroxy-propyl] carbamate, C-14937, SR-01000841824, U-19646, 3-[(4-chlorophenyl)oxy]-2-hydroxypropyl carbamate, SR-01000841824-2, BRD-A39230911-001-03-7, 1,2-Propanediol, 3-(p-chlorophenoxy)-, 1-carbamate (8CI)


ID: 2098

chemical graph of compound 2098



InChIKey: SKVLYVHULOWXTD-UHFFFAOYSA-N
SMILES: C1=CC(=CC=C1NC(=O)CCC(=O)O)S(=O)(=O)NC2=NC=CS2

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5315
synonyms found at PubChem are:
succinylsulfathiazole, 116-43-8, Cremosuxidine, Colistatin, Sulfasuccidine, Sulfasuccinil, Sulfasuxidine, Sulfadigesin, Succinylsulphathiazole, Sulfasuccithiazole, Sulfasuccidin, Sulfenterone, Kaoxidin, Kaoxidine, Rolsul, Thiacyl, 4'-(2-Thiazolylsulfamoyl)succinanilic acid, Succinilsulfatiazol, Succinilsolfatiazolo, Succinylsulfathiazol, Succinylsulfathiazolum, p-2-Thiazolylsulfamylsuccinanilic acid, UNII-RSS8647O4S, Butanoic acid, 4-oxo-4-[[4-[(2-thiazolylamino)sulfonyl]phenyl]amino]-, NSC 14193, NSC 163939, Anhydrous Succinylsulfathiazole, 2-(N(sup4)-Succinylsulfanilamido)thiazole, CHEBI:9309, RSS8647O4S, Succinanilic acid, 4'-(2-thiazolylsulfamoyl)-, SKVLYVHULOWXTD-UHFFFAOYSA-N, Succinilsolfatiazolo [DCIT], NSC14193, 2-(N4-Succinylsulfanilamido)thiazole, NSC163939, 4-oxo-4-[4-(thiazol-2-ylsulfamoyl)anilino]butanoic acid, NCGC00016367-01, C13H13N3O5S2, CAS-116-43-8, Succinilsulfatiazol [INN-Spanish], Succinylsulfathiazol [INN-French], Succinylsulfathiazolum [INN-Latin], EINECS 204-141-0, DSSTox_CID_25281, DSSTox_RID_80782, BRN 0349989, DSSTox_GSID_45281, 4'-(1,3-Thiazol-2-ylsulphamoyl)succinanilic acid, AI3-26816, 4-oxo-4-[4-(1,3-thiazol-2-ylsulfamoyl)anilino]butanoic acid, Succinylsulfathiazole (INN), 4-oxo-4-((4-(N-(thiazol-2-yl)sulfamoyl)phenyl)amino)butanoic acid, Butanoic acid, 4-oxo-4-((4-((2-thiazolylamino)sulfonyl)phenyl)amino)-, N4-Succinyl-N-(2-thiazolyl)sulfanilamide, Succinyl sulfathiazole, SR-01000000176, 4-(Succinylamino)-N-(2-thiazolyl)benzenesulfonamide, succinylsulfathiazole[inn], Prestwick_1016, Succinylsulfathiazole [USP:INN:BAN], N-succinylsulfathiazole, Spectrum_001389, Maybridge1_006038, Prestwick0_000702, Prestwick1_000702, Prestwick2_000702, Prestwick3_000702, Spectrum2_001946, Spectrum3_001488, Spectrum4_000045, Tharap cat: antimicrobial, ACMC-209u5s, AC1L1K2W, Oprea1_335927, REGID_for_CID_5315, BSPBio_000883, BSPBio_003075, KBioGR_000509, KBioSS_001869, 4-27-00-04637 (Beilstein Handbook Reference), KSC492Q7H, MLS000069715, DivK1c_001028, SCHEMBL151873, SPECTRUM1502025, SPBio_002011, SPBio_002804, Succinylsulfathiazole, >=98%, AC1Q6W23, BPBio1_000973, CHEMBL1484857, DTXSID7045281, CTK3J2873, HMS503M17, HMS558K10, KBio1_001028, KBio2_001869, KBio2_004437, KBio2_007005, KBio3_002575, CCG-439, MolPort-000-421-568, NINDS_001028, HMS1570M05, HMS1921F06, HMS2092N21, HMS2097M05, HMS2230P18, HMS3373O12, HMS3714M05, Pharmakon1600-01502025, AC1Q7561, HY-B0921, ZINC1532343, Tox21_110400, ANW-43358, GA4716, MFCD00022437, NSC-14193, NSC758161, s4585, STK079059, Succinylsulfathiazole, ~95% (TLC), AKOS002161889, Tox21_110400_1, API0010062, MCULE-7766194789, NSC-163939, NSC-758161, RTR-031131, IDI1_001028, NCGC00016367-02, NCGC00016367-03, NCGC00016367-04, NCGC00016367-05, NCGC00016367-06, NCGC00016367-08, NCGC00022723-03, NCGC00022723-04, AN-22759, AS-15960, R534, SC-57927, SMR000058172, SBI-0051704.P002, TR-031131, 4\'-(2-Thiazolylsulfamoyl)succinanilic acid, AB00052259, EU-0083314, FT-0631665, S0581, S0991, ST50036309, C11745, D07060, AB00052259_13, 116S438, N4-Succinyl-N-(2-thiazolyl)sulfanilamide hydrate, J-003439, SR-01000000176-2, SR-01000000176-3, SR-01000000176-4, BRD-K01950558-001-05-5, BRD-K01950558-001-09-7, I04-12387, F0856-0033, 4-(Succinylamino)-N-(2-thiazolyl)benzenesulfonamide hydrate, 4-oxo-4-(4-(N-thiazol-2-ylsulfamoyl)phenylamino)butanoic acid, 4-oxo-4-((4-((2-thiazolylamino)sulfonyl)phenyl)amino)butanoic acid, 4-Oxo-4-[[4-[(2-thiazolylamino)sulfonyl]phenyl]amio]-butanoic acid, 4-oxo-4-{[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]amino}butanoic acid, 3-(N-{4-[(1,3-thiazol-2-ylamino)sulfonyl]phenyl}carbamoyl)propanoic acid, 4-Oxo-4-(4-[(1,3-thiazol-2-ylamino)sulfonyl]anilino)butanoic acid #, 4-Oxo-4-[[4-(thiazol-2-ylsulfamoyl)phenyl]amino]butanoic acid monohydrate, Butanoic acid, 4-oxo-4-((4-((2-thiazolylamino)sulfonyl)phenyl)amino)- (9CI), 1391-00-0


ID: 2099

chemical graph of compound 2099



InChIKey: SKVPTPMWXJSBTF-UHFFFAOYSA-N
SMILES: CC1=C(C(=O)N(N1C)C2=CC=CC=C2)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 98889
synonyms found at PubChem are:
4-Hydroxyantipyrine, 1672-63-5, Antipyrine, 4-hydroxy, SKVPTPMWXJSBTF-UHFFFAOYSA-N, 4-Hydroxy-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one, 4-hydroxy-1,5-dimethyl-2-phenyl-1,2-dihydro-3h-pyrazol-3-one, 4-hydroxy-1,5-dimethyl-2-phenylpyrazol-3-one, 4-Hydroxyantipyrene, Prestwick_270, NSC 174055, AC1Q6ISQ, Prestwick0_000030, Prestwick1_000030, Prestwick2_000030, Prestwick3_000030, 4-Hydroxyantipyrine, 99%, AC1L40HV, UNII-DPZ41NV570, BSPBio_000099, MLS002154180, SCHEMBL151171, SPBio_002020, BPBio1_000109, DPZ41NV570, CHEMBL1526434, CHEBI:94641, DTXSID70168242, MolPort-003-925-870, HMS1568E21, HMS2095E21, HMS2230K12, HMS3370O19, HMS3712E21, ZINC119268, NSC174055, STL454169, AKOS022181399, CCG-214538, NSC-174055, 4-Hydroxyantipyrine, analytical standard, NCGC00016592-01, NCGC00016592-02, NCGC00179659-01, AJ-11559, CC-19520, CS-15446, KB-39146, SMR001233473, CAS-1672-63-5, CS-0020302, FT-0633751, 4-hydroxy-1,5-dimethyl-2-phenyl-3-pyrazolone, 1,5-dimethyl-4-oxidanyl-2-phenyl-pyrazol-3-one, A811196, C-29865, SR-01000841217, J-010349, SR-01000841217-2, BRD-K49759007-001-03-6, BRD-K49759007-001-06-9, 3H-Pyrazol-3-one,2-dihydro-4-hydroxy-1,5-dimethyl-2-phenyl-, 1,2-Dihydro-4-hydroxy-1,5-dimethyl-2-phenyl-3H-pyrazol-3-one, 3H-Pyrazol-3-one, 1,2-dihydro-4-hydroxy-1,5-dimethyl-2-phenyl- (9CI)


ID: 2100

chemical graph of compound 2100



InChIKey: SKZKKFZAGNVIMN-UHFFFAOYSA-N
SMILES: C1=CC=C(C(=C1)C(=O)N)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5147
synonyms found at PubChem are:
salicylamide, 2-Hydroxybenzamide, 65-45-2, o-Hydroxybenzamide, Benzamide, 2-hydroxy-, Salicylic acid amide, 2-Carbamoylphenol, Flarpirina, Morsarinas, Algamon, Algiamida, Allevin, Amidosal, Andasol, Dolomide, Dropsprin, Eggosalil, Novecyl, Panithal, Raspberin, Salamid, Salamide, Saliamid, Saliamin, Salicim, Salipur, Salizell, Salymid, Serramida, Urtosal, Acket, Anamid, Oramid, Salrin, 2-Carboxamidophenol, Afko-Sal, Amid-Sal, Benzamide, o-hydroxy-, Salicilamida, Salicilamide, Salicylamidum, Salizell (VAN), Benesal (VAN), Salicilamide [DCIT], Salicilamide [Italian], Amid kyseliny salicylove, UNII-EM8BM710ZC, NSC 3115, Salicylamidum [INN-Latin], OHB, Salicilamida [INN-Spanish], H.P. 34, SR 4326, CCRIS 6045, HSDB 227, Amid kyseliny salicylove [Czech], Benzoic acid, 2-hydroxy-, amide, EINECS 200-609-3, BRN 0742439, EM8BM710ZC, CHEMBL27577, AI3-03454, MLS000069486, CHEBI:32114, SKZKKFZAGNVIMN-UHFFFAOYSA-N, NCGC00091414-02, SMR000046394, DSSTox_CID_1726, DSSTox_RID_76295, DSSTox_GSID_21726, CAS-65-45-2, Salicylamid, Samid, Salicylamide [INN:BAN:JAN], hydroxy benzamide, Saliclamide,(S), dihydroxybenzalamine, 2-oxidanylbenzamide, Salicylamide [USP:INN:BAN:JAN], Salicylamide (TN), 2-Hydroxy-benzamide, Salicylamide, 99%, PubChem10992, Spectrum_000946, ACMC-209nqv, AC1L1JPI, Opera_ID_1684, Spectrum2_001312, Spectrum3_000564, Spectrum4_000499, Spectrum5_001032, WLN: ZVR BQ, EC 200-609-3, AC1Q4Z8X, NCIOpen2_001127, Oprea1_069894, SCHEMBL21646, BSPBio_001948, KBioGR_001017, KBioSS_001426, 4-10-00-00169 (Beilstein Handbook Reference), KSC353S5B, DivK1c_000858, SPECTRUM1500532, Salicylamide (JAN/USP/INN), SPBio_001403, ZINC2055, Benzamide, 2-hydroxy- (9CI), DTXSID3021726, CTK2F3950, HMS502K20, KBio1_000858, KBio2_001426, KBio2_003994, KBio2_006562, KBio3_001448, NSC3115, MolPort-001-641-072, NINDS_000858, HMS1920P14, HMS2092G15, HMS2232E07, Pharmakon1600-01500532, component of Tolagesic (Salt/Mix), HY-B0811, Hydrochlorothiazide Related Compound, KS-00000H1J, NSC-3115, Tox21_111129, Tox21_201944, Tox21_302801, ANW-35045, BBL016007, BDBM50056900, CCG-39250, MFCD00007978, NSC757318, SBB058584, STK301812, AKOS000120983, Tox21_111129_1, CS-7630, DB08797, LS-1556, MCULE-5482995635, NSC-757318, RP20335, RTR-022279, TRA0035157, IDI1_000858, NCGC00091414-01, NCGC00091414-03, NCGC00091414-04, NCGC00091414-05, NCGC00091414-07, NCGC00256376-01, NCGC00259493-01, 36205-82-0 (mono-hydrochloride salt), AJ-08127, AN-23746, BR-81394, CJ-00076, DS-16216, KB-24513, Salicylamide, puriss., >=99.0% (T), SC-46863, SBI-0051509.P003, AB1004776, ST2410041, TR-022279, EU-0000058, FT-0659360, S0006, ST45061688, D01811, M-6078, 91096-EP2380872A1, AB00052089_12, A835120, AH-034/32461056, SR-01000721923, BENZOIC ACID,2-HYDROXY,AMIDE SALICYLAMIDE, I01-5217, J-509663, SR-01000721923-2, BRD-K81130846-001-02-6, BRD-K81130846-001-12-5, Z68590124, 2,4-Cyclohexadien-1-one, 6-(aminohydroxymethylene)- (9CI), Salicylamide, United States Pharmacopeia (USP) Reference Standard, 2-HYDROXYBENZAMIDE (SEE ALSO:N-HYDROXYBENZAMIDE (CAS 495-18-1)), InChI=1/C7H7NO2/c8-7(10)5-3-1-2-4-6(5)9/h1-4,9H,(H2,8,10, Salicylamide, Pharmaceutical Secondary Standard; Certified Reference Material, 287492-04-0


ID: 2101

chemical graph of compound 2101



InChIKey: SLAVHURDNZJSIH-UHFFFAOYSA-N
SMILES: CC1=C2C(=CC(=C1Cl)O)OC3(C2=O)C(=C(C(=CC3=O)O)Cl)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3334572
synonyms found at PubChem are:
Griseofulvin Analog A, KBio2_007384, Spectrum_001768, SpecPlus_000114, AC1MNWM2, Spectrum3_001049, Spectrum4_001189, BSPBio_002578, KBioGR_001857, KBioSS_002249, DivK1c_006210, KBio1_001154, KBio2_002248, KBio2_004816, KBio3_001798, NCGC00178593-01, 2',5-dichloro-5',6-dihydroxy-3',4-dimethyl-spiro[benzofuran-2,4'-cyclohexa-2,5-diene]-1',3-dione, 4',5-dichloro-3',6-dihydroxy-4,5'-dimethylspiro[1-benzofuran-2,6'-cyclohexa-2,4-diene]-1',3-dione


ID: 2102

chemical graph of compound 2102



InChIKey: SLAYUXIURFNXPG-CRAIPNDOSA-N
SMILES: C1C(=C(N2[C@H](S1)[C@@H](C2=O)NC(=O)CC3=CC=CC=C3CN)C(=O)O)CSC4=NN=NN4CC(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 43507
synonyms found at PubChem are:
CEFORANIDE, Precef, 60925-61-3, Ceforanido, Ceforanidum, Ceforanidum [INN-Latin], Ceforanido [INN-Spanish], Radacef, BL-S786, bl s786, BL-S 786, Ceforanide [USAN:INN:BAN], UNII-8M1YF8951V, Precef (TN), C20H21N7O6S2, Ceforanide (USP/INN), CHEBI:3495, (6R,7R)-7-[[2-[2-(aminomethyl)phenyl]acetyl]amino]-3-[[1-(carboxymethyl)tetrazol-5-yl]sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 8M1YF8951V, (6R,7R)-7-(2-(alpha-Amino-o-tolyl)acetamido)-3-(((1-(carboxymethyl)-1H-tetrazol-5-yl)thio)methyl)-8-oxo-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7-(o-(Aminomethyl)phenylacetamido)-3-(((1-(carboxymethyl)-1H-tetrazol-5-yl)thio)methyl)-3-cephem-4-carboxylic acid, Ceforanide sodium, (6R-trans)-7-(((2-(Aminomethyl)phenyl)acetyl)amino)-3-(((1-(carboxymethyl)-1H-tetrazol-5-yl)thio)methyl)-8-oxo-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, (6R,7R)-7-({[2-(aminomethyl)phenyl]acetyl}amino)-3-({[1-(carboxymethyl)-1H-tetrazol-5-yl]sulfanyl}methyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, (6R,7R)-7-({[2-(aminomethyl)phenyl]acetyl}amino)-3-({[1-(carboxymethyl)-1H-tetrazol-5-yl]thio}methyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, (6R,7R)-7-{2-[2-(aminomethyl)phenyl]acetamido}-3-({[1-(carboxymethyl)-1H-1,2,3,4-tetrazol-5-yl]sulfanyl}methyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7-(((2-(aminomethyl)phenyl)acetyl)amino)-3-(((1-(carboxymethyl)-1H-tetrazol-5-yl)thio)methyl)-8-oxo-, (6R-trans)-, 7-[O-(aminomethyl)phenylacetamido]-3-[[[1-(carboxymethyl)-1H-tetrazol-5-yl]thio]methyl]-3-cephem-4-carboxylic acid, 7beta-[2-(aminomethyl)phenyl]acetamido-3-{[1-(carboxymethyl)-1H-tetrazol-5-yl]sulfanyl}methyl-3,4-didehydrocepham-4-carboxylic acid, SR-01000872614, Ceforanide [USAN:USP:INN:BAN], NCGC00016897-01, CAS-60925-61-3, AC1Q6LON, ceforanide monosodium salt, Prestwick0_000470, Prestwick1_000470, Prestwick2_000470, Prestwick3_000470, DSSTox_CID_2760, D06OUL, AC1L2A0U, DSSTox_RID_76719, DSSTox_GSID_22760, BSPBio_000580, SCHEMBL122072, SPBio_002519, BL-S786R, BPBio1_000638, CHEMBL1201046, DTXSID1022760, MolPort-006-167-662, HMS1569M22, HMS2096M22, HMS3713M22, ZINC3830434, Tox21_110670, AKOS027427040, API0009042, CCG-220470, DB00923, AN-39394, AS-15783, Q766, SC-89759, LS-176135, AB00513845, FT-0698679, C06884, D00259, 925C613, SR-01000872614-2, SR-01000872614-3, BRD-K37848908-001-03-1


ID: 2103

chemical graph of compound 2103



InChIKey: SLGMBDZRONTSMC-UHFFFAOYSA-M
SMILES: C1=CC=C2C=[N+](C=CC2=C1)CCCO.[Cl-]

biological descriptors:

CFTR relevance: inactive

Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown

reference list:

"MH Nantz" "LJ Galietta" "K By" "EJ Niedzinski" "M Eda" "MF Springsteel" "MJ Haddadin" "MJ Kurth" "AS Verkman"


CID is 10822985


ID: 2104

chemical graph of compound 2104



InChIKey: SLSIBLKBHNKZTB-UHFFFAOYSA-N
SMILES: COC1=C(C2=C(C=C1)C(=C3C=COC3=N2)OC)OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6760
synonyms found at PubChem are:
Skimmianine, Skimmianin, 83-95-4, Chloroxylonine, 4,7,8-Trimethoxyfuro[2,3-b]quinoline, Skimmiamine, .beta.-Fagarine, b-fagarine, beta-Fagarine, Furo[2,3-b]quinoline, 4,7,8-trimethoxy-, UNII-4E1KLC380B, CCRIS 1585, NSC 217986, BRN 0028904, 4E1KLC380B, CHEBI:9172, 4,7,8-trimethoxyfurano[2,3-b]quinoline, FURO(2,3-b)QUINOLINE, 4,7,8-TRIMETHOXY-, Furo[2, 4,7,8-trimethoxy-, Prestwick_184, AC1Q4FEY, Prestwick0_000668, Prestwick1_000668, Prestwick2_000668, Prestwick3_000668, CBMicro_015540, AC1L1N8S, Oprea1_449938, Oprea1_598261, BSPBio_000735, MLS001049147, CHEMBL21396, SCHEMBL893654, SPBio_002656, BPBio1_000809, MEGxp0_000036, ZINC35525, DTXSID90232116, MolPort-000-742-994, SLSIBLKBHNKZTB-UHFFFAOYSA-N, HMS1570E17, HMS2097E17, HMS2268L06, NSC94654, TNP00202, BBL028481, NSC-94654, NSC217986, STL372641, AKOS004111157, CCG-208371, MCULE-8440641154, NSC-217986, CAS-83-95-4, NCGC00016333-01, NCGC00016333-02, NCGC00016333-03, NCGC00016333-05, NCGC00142348-01, 4CN-0525, LS-70939, NS-03981, SMR000386971, ST005173, BIM-0015492.P001, 4,7,8-Trimethoxyfuro[2,3-b]quinoline #, Furo[2,3-b]quinoline,4,7,8-trimethoxy-, FT-0699040, A10746, C10740, SR-01000739093, SR-01000739093-3, BRD-K25741894-001-03-8, 5255-76-5, InChI=1/C14H13NO4/c1-16-10-5-4-8-11(13(10)18-3)15-14-9(6-7-19-14)12(8)17-2/h4-7H,1-3H


ID: 2105

chemical graph of compound 2105



InChIKey: SLVOKEOPLJCHCQ-OUKQBFOZSA-N
SMILES: CCCCCCCC/C=C/CCCCCCCCOP(=O)([O-])OCC[N+](C)(C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 14856193
synonyms found at PubChem are:
ELAIDYLPHOSPHOCHOLINE, CHEBI:75487, 1-elaidylphosphocholine, SPECTRUM1505337, CHEMBL387559, SCHEMBL10415339, SCHEMBL18952927, (E)-octadec-9-enylphosphocholine, trans-9-Octadecenyl Phosphocholine, CCG-40030, (9E)-octadec-9-en-1-ylphosphocholine, NCGC00095351-01, NCGC00095351-02, J-006955, (9E)-octadec-9-en-1-yl 2-(trimethylazaniumyl)ethyl phosphate, 137052-40-5


ID: 2106

chemical graph of compound 2106



InChIKey: SLXKOJJOQWFEFD-UHFFFAOYSA-N
SMILES: C(CCC(=O)O)CCN

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 564
synonyms found at PubChem are:
6-aminohexanoic acid, 6-Aminocaproic acid, aminocaproic acid, 60-32-2, amicar, Epsikapron, Capramol, Caprocid, Epsamon, EACA, Acepramin, Caprolisin, Epsicapron, Hemocaprol, Respramin, Amikar, Hexanoic acid, 6-amino-, Epsilcapramin, Acepramine, Aminokapron, Caplamin, Capracid, Afibrin, Atsemin, EPSILON-AMINOCAPROIC ACID, Hemopar, Ipsilon, Hepin, Epsilon S, Aminocaproic, Capralense, epsilon-Leucine, EACS, epsilcapramine, epsilon-Norleucine, 6-Amino-n-hexanoic acid, omega-Aminocaproic acid, epsilon-Aminohexanoic acid, 6-amino-hexanoic acid, Capranol, omega-Aminohexanoic acid, Eaca kabi, Acido aminocaproico, Acidum aminocaproicum, epsilon-Amino-n-hexanoic acid, Epsilon-aminocapronzuur, Aminohexanoic acid, Epsilon-Aminocapronsaeure, Acide aminocaproique, CY 116, Caproamin, 6-aminohexanoate, Acide aminocaproique [French], Acidum aminocaproicum [Latin], CY-116, epsilon Aminocaproic Acid, e-Aminocaproic acid, epsilon-aminocaproate, Amicar (TN), 177 J.D., CL 10304, Acido aminocaproico [DCIT,Spanish], epsilon-Amino-n-caproic acid, NSC-26154, Kyselina omega-aminokapronova [Czech], Aminocaproate, Epsicaprom, 6-amino-n-caproic acid, ACS, epsilon-Ahx, acide aminocaproque, Kyselina omega-aminokapronova, JD 177, NSC 26154, HEXANOIC ACID,6-AMINO, Aminocaproic Acid In Plastic Container, .epsilon.-Norleucine, CCRIS 7706, 6-amino caproic acid, epsilon-Aminocaproic acid (JAN), HSDB 3005, CY116, UNII-U6F3787206, Acide aminocaproique [INN-French], Acido aminocaproico [INN-Spanish], Acidum aminocaproicum [INN-Latin], Aminocaproic acid (USP), Aminocaproic acid [USAN:BAN:INN], Aminocaproic acid [USAN:INN:BAN], EINECS 200-469-3, .omega.-Aminocaproic acid, 6-amino-n-caproate, 1319-82-0, .omega.-Aminohexanoic acid, NSC 400230, .epsilon.-Aminocaproic acid, 177 J.D, BRN 0906872, .epsilon.-Aminohexanoic acid, Aminocaproic acid (USP/INN), AI3-14512, CHEBI:16586, SLXKOJJOQWFEFD-UHFFFAOYSA-N, .epsilon. S, .epsilon.-Leucine, NSC26154, NSC400230, CAS-60-32-2, NCGC00015092-02, CL-10304, DSSTox_CID_70, U6F3787206, WLN: Z5VQ, A 7824, DSSTox_RID_75347, DSSTox_GSID_20070, e-amino-n-caproic acid, S04-0132, 6-Aminohexanoicacid, SMR000059162, 6 Aminocaproic Acid, 6 Aminohexanoic Acid, SR-01000075688, Acikaprin, amino caproic, Aminocapronsaure, e-Aminocaproate, w-Aminocaproate, e-Norleucine, e-Aminohexanoate, w-Aminohexanoate, 6-Aminocaproate, e-Leucine, epsilon-S, 1cea, 3kiv, Aminocaproic Acids, 6-amino-Hexanoate, 6Aminocaproic acid, omega-Aminocaproate, Amino Caproic Acid, Fullevir (TN), trifluoroacctic acid, H-epsilon-Acp-OH, omega-Aminohexanoate, w-Aminocaproic acid, e-Amino-n-hexanoate, e-Aminohexanoic acid, w-Aminohexanoic acid, 6-Amino-n-hexanoate, epsilon-Aminohexanoate, Epsillon-Aminocaproate, H-EAhx-OH, Acid, 6-Aminocaproic, H-Acp-OH, Acid, 6-Aminohexanoic, Aminocaproic acid [USAN:USP:INN:BAN], Spectrum_000038, ACMC-1AXZE, e-Amino-n-hexanoic acid, e-Aminocaproic acid USP, epsilon-Amino-n-hexanoate, H-6-Ahx-OH, Prestwick0_000960, Prestwick1_000960, Prestwick2_000960, Prestwick3_000960, Spectrum2_000131, Spectrum4_000143, Spectrum5_000780, Lopac-A-7824, Epsillon-Aminocaproic acid, epsilon-amino caproic acid, Acid, epsilon-Aminocaproic, bmse000394, D05QNF, D0FD0H, D0LU5G, Aminocaproic acid (Amicar), AC1L19IP, AC1Q54EY, 6-Aminocaproic acid; EACA, 6-ACA, CHEMBL1046, Lopac0_000082, SCHEMBL15293, BSPBio_000960, CBDivE_004370, KBioGR_000586, KBioSS_000398, (6-)|A-?Aminocaproic acid, epsilon-Aminocaproic acid USP, KSC238G9H, MLS001335991, MLS002695931, BIDD:GT0162, DivK1c_000551, NH2-(CH2)5-COOH, SPECTRUM1500114, SPBio_000202, SPBio_003109, BPBio1_001056, GTPL6574, .epsilon.-Amino-n-caproic acid, DTXSID0020070, .epsilon.-Amino-n-hexanoic acid, CHEBI:79212, CTK1D8393, HMS501L13, KBio1_000551, KBio2_000398, KBio2_002966, KBio2_005534, MolPort-001-779-881, NINDS_000551, HMS1570P22, HMS1920C07, HMS2091I07, HMS2097P22, HMS2231F21, HMS3260A06, HMS3373F09, HMS3655M17, HMS3714P22, Pharmakon1600-01500114, ALBB-022460, BCP24729, BCP27495, EBD17973, HY-B0236, KS-00000AE0, ZINC1529425, Tox21_110081, Tox21_500082, AC-035, ANW-33472, BBL007716, BDBM50357211, CCG-38935, LMFA01100035, MFCD00008238, NSC212532, NSC755867, s1671, SBB015068, STK246894, 6-Aminohexanoic acid, 99% 100g, AKOS000118734, Tox21_110081_1, AM82438, CS-2204, DB00513, KS-5276, LP00082, LS-7191, MCULE-3640363033, NE10566, NSC-212532, NSC-400230, NSC-755867, RP19960, RTR-020850, TRA0081138, IDI1_000551, pound 6- pound(c)|A-Aminocaproic acid, 6-Aminocaproic acid, BioUltra, >=99%, Epsillon-Aminocaproic acid' Epsilcapramin, NCGC00015092-01, NCGC00015092-03, NCGC00015092-04, NCGC00015092-05, NCGC00015092-06, NCGC00015092-07, NCGC00015092-09, NCGC00015092-10, NCGC00093587-01, NCGC00093587-02, NCGC00093587-03, NCGC00093587-04, NCGC00260767-01, 6-Aminohexanoic acid, >=98.5% (NT), AJ-26594, AMINOCAPROIC ACID (aminocaproic acid)., AN-16229, BC204341, BP-20395, KB-44629, SC-10067, ST075413, 008e238, SBI-0050070.P004, AB2000208, TL8003819, TR-020850, A0312, AB00051911, EU-0100082, FT-0620933, ST24045109, A15677, C02378, D00160, AB00051911-08, AB00051911_09, AB00051911_10, 101172-EP2302382A2, 101172-EP2302383A2, 319A820, 6-Aminocaproic acid, >=99% (titration), powder, 6-Aminocaproic acid, SAJ special grade, >=99.0%, SR-01000075688-1, SR-01000075688-3, SR-01000075688-6, F2191-0201, Amicar;|A-amino caproic acid;|A-Ahx;6-aminohexanoic acid, C3BDD377-8F43-4BEC-900A-D5850050BA82, Aminocaproic acid, European Pharmacopoeia (EP) Reference Standard, Aminocaproic acid, United States Pharmacopeia (USP) Reference Standard, InChI=1/C6H13NO2/c7-5-3-1-2-4-6(8)9/h1-5,7H2,(H,8,9, Amicar, A-amino caproic acid, A-Ahx, 6-aminohexanoic acid, Aminocaproic acid, Aminocaproic acid, Pharmaceutical Secondary Standard; Certified Reference Material, 87867-96-7, 93208-38-9, 6-azaniumylhexanoate, 6-aminocapronate, 6-ammoniohexanoate, AC1LANTE, epsilon-amino-N-caproate, 6-aminohexanoic acid zwitterion, CHEBI:57826, CJ-05179, CJ-23892


ID: 2107

chemical graph of compound 2107



InChIKey: SLYPOVJCSQHITR-UHFFFAOYSA-N
SMILES: C1=CC2=C(C=C1O)OC(=O)S2

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 72139
synonyms found at PubChem are:
Tioxolone, 4991-65-5, 6-Hydroxy-1,3-benzoxathiol-2-one, Thioxolone, 6-hydroxybenzo[d][1,3]oxathiol-2-one, Camyna, Tioxolon, Thioxalone, Tioxolona, Tioxolonum, 1,3-Benzoxathiol-2-one, 6-hydroxy-, Acnosan, Tioxolonum [INN-Latin], UNII-S0FAJ1R9CD, Tioxolona [INN-Spanish], 6-Hydro-2-oxo-1,3-benzoxathiole, C7H4O3S, 6-hydroxy-2H-1,3-benzoxathiol-2-one, EINECS 225-653-0, S0FAJ1R9CD, CHEMBL442687, CHEBI:568021, SLYPOVJCSQHITR-UHFFFAOYSA-N, NCGC00095003-01, 5-Hydroxy-1,3-benzothioxol-2-one, 6-hydroxybenzo[d]1,3-oxathiolen-2-one, SMR000718631, Tioxolone [INN:DCF], thidoxol, thioxolon, Tioxolone [INN:BAN:DCF], Psoil (Salt/Mix), Spectrum_001358, ACMC-209kiz, Tioxolone (INN/BAN), SpecPlus_000901, AC1L2HHM, AC1Q6HLN, Spectrum2_000450, Spectrum3_001025, Spectrum4_001156, Spectrum5_001539, D0M8UY, DSSTox_CID_25885, DSSTox_RID_81199, DSSTox_GSID_45885, SCHEMBL36433, 6-Hydroxy-2-oxobenzoxathiole, BSPBio_002809, KBioGR_001731, KBioSS_001838, cid_72139, MLS000766887, MLS002207047, MLS006011819, DivK1c_006997, SPECTRUM1503094, SPBio_000500, AC1Q798W, ZINC2181, DTXSID5045885, CTK8B1755, KBio1_001941, KBio2_001838, KBio2_004406, KBio2_006974, KBio3_002029, SLYPOVJCSQHITR-UHFFFAOYSA-, MolPort-000-198-907, HMS1922E09, HMS2233I16, HMS3656G22, Pharmakon1600-01503094, BCP27320, HY-B0483, KS-000013FH, Tox21_111384, ANW-30873, BBL027543, BDBM50252093, CCG-39965, NSC758240, s2603, SBB071406, STK525157, AKOS000120818, CS-2598, MCULE-4750186509, NE10413, NSC-758240, VZ30766, NCGC00095003-02, NCGC00095003-03, NCGC00095003-05, NCGC00095003-06, NCGC00178457-01, AJ-08140, KB-45519, LS-41601, SC-92492, ST088470, ZB000497, CAS-4991-65-5, SBI-0051902.P002, AB2000692, DB-051701, TC-060798, FT-0635501, ST24029784, V1364, 6-Hydroxy-1,3-benzoxathiol-2-one, >=98%, A15598, D07211, AB00052428-08, AB00052428-10, AB00052428_11, AB00052428_12, SR-01000842162, I06-1249, J-518772, SR-01000842162-2, BRD-K41876534-001-02-0, F0001-1301, Z955123730, InChI=1/C7H4O3S/c8-4-1-2-6-5(3-4)10-7(9)11-6/h1-3,8H


ID: 2108

chemical graph of compound 2108



InChIKey: SMDHCQAYESWHAE-UHFFFAOYSA-N
SMILES: CCCCN(CC)C1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 2319
synonyms found at PubChem are:
benfluralin, Bethrodine, Balan, BENEFIN, 1861-40-1, Benfluraline, Banafine, Benalan, Benefex, Benephin, Binnell, Bonalan, Carpidor, Flubalex, Balfin, Emblem, Quilan, N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline, Blulan, EL-110, Caswell No. 130, Benefin [WITHDRAWN], Benfluralin [BSI:ISO], N-Butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)benzenamine, Benfluraline [ISO-French], N-Butyl-2,6-dinitro-N-ethyl-4-trifluoromethylaniline, UNII-28224BUY6R, HSDB 407, Benzenamine, N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)-, N-Butyl-N-ethyl-2,6-dinitro-4-trifluoromethylaniline, BINNELL(R), QUILAN(R), EINECS 217-465-2, L 54521, EPA Pesticide Chemical Code 084301, BRN 2821329, N-Butyl-N-ethyl-alpha,alpha,alpha-trifluoro-2,6-dinitro-p-toluidine, SMDHCQAYESWHAE-UHFFFAOYSA-N, 28224BUY6R, alpha,alpha,alpha-Trifluoro-2,6-dinitro-N,N-ethylbutyl-p-toluidine, N-Butyl N-ethyl-2,6-dinitro-4-(trifluoromethyl)benzeneamine, DSSTox_CID_3899, p-Toluidine, N-butyl-N-ethyl-.alpha.,.alpha.,.alpha.-trifluoro-2,6-dinitro-, DSSTox_RID_77223, DSSTox_GSID_23899, N-BUTYL-N-ETHYL-A,A,A-TRIFLUORO-2,6-DINITRO-P-TOLUIDINE, p-Toluidine, N-butyl-N-ethyl-alpha,alpha,alpha-trifluoro-2,6-dinitro-, CAS-1861-40-1, team, Benafine, Benefine, Bhulan, CCRIS 9242, Pel-Tech, xl-2g, Spectrum_001829, BENEFIN(R), SpecPlus_000430, AC1L1DEU, BALAN(R), Spectrum2_001883, Spectrum3_000825, Spectrum4_000665, Spectrum5_001962, AC1Q1YN3, SCHEMBL55008, BSPBio_002349, KBioGR_001069, KBioSS_002334, SPECTRUM330033, DivK1c_006526, SPBio_001786, n-butyl-n-ethyl-2,6-dinitro-4-(trifluormethyl)anilin, CHEMBL1256668, DTXSID3023899, KBio1_001470, KBio2_002331, KBio2_004899, KBio2_007467, KBio3_001849, CHEBI:132878, ZINC3871674, Tox21_202270, Tox21_300774, CCG-39421, EL 110, AKOS015890700, ACM1861401, KF10035, NCGC00094527-01, NCGC00094527-02, NCGC00094527-03, NCGC00094527-04, NCGC00094527-05, NCGC00094527-06, NCGC00094527-07, NCGC00254678-01, NCGC00259819-01, AJ-46352, AN-50005, CC-24273, M011, AX8115326, LS-154330, FT-0603576, Benfluralin, PESTANAL(R), analytical standard, C21273, 861B401, C-20186, I01-8049, J-011946, 4-Trifluoromethyl-2,6-dinitro-N-ethyl-N-butylaniline, N-Butyl-N-ethyl-4-trifluoromethyl-2,6-trinitroaniline, N-Ethyl-N-butyl-2,6-dinitro-4-trifluoromethylaniline, 2,6-Dinitro-4-trifluoromethyl-N-n-butyl-N-ethylaniline, N-n-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)aniline, N-Butyl-N-ethyl-|A,|A,|A-trifluoro-2,6-dinitro-p-toluidine, .alpha.,.alpha.,.alpha.-Trifluoro-2,6-dinitro-N,N-ethylbutyl-p-toluidine, Benzenamine, N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)- (9CI), N-Butyl-N-ethyl-.alpha.,.alpha.,.alpha.-trifluoro-2,6-dinitro-p-toluidine


ID: 2109

chemical graph of compound 2109



InChIKey: SMEROWZSTRWXGI-HVATVPOCSA-N
SMILES: C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 9903
synonyms found at PubChem are:
LITHOCHOLIC ACID, 434-13-9, Lithocolic acid, Lithocholate, 3alpha-Hydroxy-5beta-cholanic acid, 3alpha-Hydroxy-5beta-cholan-24-oic acid, 3-Hydroxycholan-24-oic acid, 3alpha-Hydroxycholanic acid, 3-alpha-Hydroxycholanic acid, 5beta-Cholanic acid-3alpha-ol, NCI-C03861, 3alpha-Hydroxy-5beta-cholanoic acid, (3alpha,5beta)-3-hydroxycholan-24-oic acid, 3-alpha-Hydroxy-5-beta-cholanic acid, CCRIS 363, UNII-5QU0I8393U, 3alpha-Hydroxy-5beta-cholanate, 5-beta-Cholanic acid, 3-alpha-hydroxy-, Cholan-24-oic acid, 3-hydroxy-, (3alpha,5beta)-, HSDB 4113, 5beta-Cholan-24-oic acid, 3alpha-hydroxy-, EINECS 207-099-1, NSC683770, (3-alpha,5-beta)-3-Hydroxycholan-24-oic acid, NSC 657956, BRN 3217757, CHEMBL1478, 17beta-(1-Methyl-3-carboxypropyl)etiocholan-3alpha-ol, 17-beta-(1-Methyl-3-carboxypropyl)ethiocholan-3-alpha-ol, 3|A-Hydroxy-5|A-cholanic acid, CHEBI:16325, 5-beta-Cholan-24-oic acid, 3-alpha-hydroxy-, SMEROWZSTRWXGI-HVATVPOCSA-N, 5QU0I8393U, 5beta-Cholan-24-oic acid-3alpha-ol, NSC 683770, ST069335, DSSTox_CID_779, Cholan-24-oic acid, 3-hydroxy-, (3a,5b)-, DSSTox_RID_75786, DSSTox_GSID_20779, (4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid, Litocholic acid, Cholan-24-oic acid, 3-hydroxy-, (3-alpha,5-beta)- (9CI), (4S)-4-((1S,2S,11S,5R,7R,10R,14R,15R)-5-hydroxy-2,15-dimethyltetracyclo[8.7.0. 0<2,7>.0<11,15>]heptadec-14-yl)pentanoic acid, (R)-4-((3R,5R,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid, SR-05000000450, (3beta,5beta,14beta,17alpha)-3-Hydroxycholan-24-Oic Acid, NSC657956, NSC-683770, Prestwick_88, 4OA, CAS-434-13-9, Lithocholic Acid,(S), 4q0a, Prestwick0_000796, Prestwick1_000796, Prestwick2_000796, Prestwick3_000796, Spectrum5_002021, Bevacizumab + Trastuzumab, 3|A-Hydroxycholanic Acid, bmse000686, D04SLF, D0K9CR, UPCMLD-DP153, AC1L1U2Z, cid_9903, Lithocholic acid, >=95%, BIDD:PXR0054, SCHEMBL28449, BSPBio_000932, GTPL611, 4-10-00-00785 (Beilstein Handbook Reference), MLS002154006, 3.alpha.-Hydroxycholanic acid, 3a-Hydroxy-5 -cholanic acid, SPBio_002871, BPBio1_001026, 3a-hydroxy-5b-cholan-24-oate, DTXSID6020779, UPCMLD-DP153:001, 3alphahydroxy-5beta-cholanic acid, BIA0111, 3|A-Hydroxy-5|A-cholanoic Acid, MolPort-001-794-648, ZX-AFC000913, HMS1570O14, HMS2097O14, HMS2269C14, HMS3714O14, 5 --Cholan-24-oic acid-3a-ol, 3|A-Hydroxy-5|A-cholan-24-oate, 3a-hydroxy-5b-cholan-24-oic acid, HY-B0172, ZINC3918156, 5|A-Cholan-24-oic acid-3|A-ol, Tox21_201868, Tox21_302791, 3a-Hydroxy-5 -cholan-24-oic acid, 5.beta.-Cholanic acid-3.alpha.-ol, BDBM50236238, LMST04010003, LS-118, MFCD00003682, s4003, SBB012598, (3a,5b)-3-hydroxy-cholan-24-oate, AKOS016010251, 3|A-Hydroxy-5|A-cholan-24-oic acid, CCG-220796, CS-2049, DS-3878, 3.alpha.-Hydroxy-5.beta.-cholanic acid, NCGC00091272-01, NCGC00091272-04, NCGC00091272-06, NCGC00091272-07, NCGC00091272-08, NCGC00256451-01, NCGC00259417-01, (3a,5b)-3-hydroxy-cholan-24-oic acid, 3.alpha.-Hydroxy-5.beta.-cholanoic acid, AJ-47431, AK114674, M622, NCI60_028903, NCI60_030095, SC-90635, SMR000112168, (3|A,5|A)-3-Hydroxycholan-24-oic Acid, 5.beta.-Cholan-24-oic acid-3.alpha.-ol, AX8136511, TR-016841, L0089, 5-.beta.-Cholanic acid, 3-.alpha.-hydroxy-, 3.alpha.-Hydroxy-5.beta.-cholan-24-oic acid, C03990, 5.beta.-Cholan-24-oic acid, 3.alpha.-hydroxy-, C-30015, 17|A-(1-Methyl-3-carboxypropyl)etiocholan-3|A-ol, SR-05000000450-2, SR-05000000450-4, SR-05000000450-5, cho lan-24-oic acid, 3-hydroxy-, (3alpha,5beta)-, Cholan-24-oic acid, 3-hydroxy-, (3-alpha,5-beta)-, UNII-JIY1ILR284 component SMEROWZSTRWXGI-HVATVPOCSA-N, 17-.beta.-(1-Methyl-3-carboxypropyl)ethiocholan-3-.alpha.-ol, Cholan-24-oic acid, 3-hydroxy-, (3-.alpha., 5-.beta.)-, (3alpha,5alpha,8alpha,14beta,17alpha)-3-hydroxycholan-24-oic acid, Lithocholic acid, European Pharmacopoeia (EP) Reference Standard, AC268B61-0548-4391-90E9-546636926870, Lithocholic acid, 50 mug/mL in methanol, certified reference material, (4R)-4-((3R,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid, LCA


ID: 2110

chemical graph of compound 2110



InChIKey: SMOFGXHPWCTYQD-UHFFFAOYSA-N
SMILES: COC1=C(C(=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3)O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5318834
synonyms found at PubChem are:
Koparin, 65048-75-1, 3-(2,3-dihydroxy-4-methoxyphenyl)-7-hydroxy-4H-chromen-4-one, AC1NSXC6, Spectrum2_000299, SPECTRUM200422, SPBio_000238, SCHEMBL5723673, CHEMBL1354502, CCG-39857, LMPK12050086, SDCCGMLS-0066413.P001, NCGC00095474-01, SR-05000002555, SR-05000002555-1, BRD-K62331715-001-02-1, 3-(2,3-dihydroxy-4-methoxyphenyl)-7-hydroxychromen-4-one


ID: 2111

chemical graph of compound 2111



InChIKey: SMQUZDBALVYZAC-UHFFFAOYSA-N
SMILES: C1=CC=C(C(=C1)C=O)O

biological descriptors:

CFTR relevance: inactive

Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown

reference list:

"MH Nantz" "LJ Galietta" "K By" "EJ Niedzinski" "M Eda" "MF Springsteel" "MJ Haddadin" "MJ Kurth" "AS Verkman"


CID is 6998
synonyms found at PubChem are:
SALICYLALDEHYDE, 2-Hydroxybenzaldehyde, 90-02-8, o-Hydroxybenzaldehyde, o-Formylphenol, Salicylal, 2-Formylphenol, Benzaldehyde, 2-hydroxy-, Salicylic aldehyde, Salicyladehyde, 2-HYDROXY-BENZALDEHYDE, Benzaldehyde, o-hydroxy-, Salicylaldehyd, Salizylaldehyd, Benzaldehyde, hydroxy-, NSC 49178, UNII-17K64GZH20, FEMA No. 3004, CCRIS 7451, HSDB 721, 2-hydroxy benzaldehyde, EINECS 201-961-0, BRN 0471388, AI3-02174, CHEMBL108925, CHEBI:16008, SMQUZDBALVYZAC-UHFFFAOYSA-N, 17K64GZH20, DSSTox_CID_1792, DSSTox_RID_76329, 2,4-Cyclohexadien-1-one, 6-(hydroxymethylene)-, DSSTox_GSID_21792, 28777-87-9, Hydroxybenzaldehyde, CAS-90-02-8, 111268-93-0, NK, salicyl aldehyde, hydroxylbenzaldehyde, hydroxy benzaldehyde, hydroxyl benzaldehyde, 2-hyroxy-benzaldehyde, 2-oxidanylbenzaldehyde, Salicylaldehyde, 8CI, 2- hydroxybenzaldehyde, ACMC-20me6q, AC1L1NRV, WLN: VHR BQ, bmse000677, EC 201-961-0, SCHEMBL15395, 4-08-00-00176 (Beilstein Handbook Reference), KSC204S9R, AC1Q6Q92, AC1Q78A0, Salicylaldehyde, >=98%, FG, Salicylaldehyde, 99% 100g, DTXSID1021792, CTK0D4077, CTK1A4998, FEMA 3004, MolPort-000-871-199, Salicylaldehyde, p.a., 99.0%, ZINC896073, ACMC-209783, CS-D1188, NSC49178, Salicylaldehyde, analytical standard, Tox21_201737, Tox21_302929, ANW-13633, BBL027432, BDBM50139367, MFCD00003317, NSC-49178, NSC187662, RW2543, Salicylaldehyde, reagent grade, 98%, SBB040225, STL194289, AKOS000119187, 2-hydroxybenzaldehyde (salicylaldehyde), AS03003, EBD2205190, LS-3090, MCULE-8965879140, NSC-187662, RL05659, RTR-038301, TRA0028440, KS-0000005P, NCGC00249108-01, NCGC00256460-01, NCGC00259286-01, AJ-24221, AN-24183, AS-13997, K615, SC-18113, ZB015070, KB-230927, ST2410040, TR-038301, FT-0648915, S0004, S0275, Salicylaldehyde, redist., >=99.0% (GC), ST50213374, 7293-EP2270014A1, 7293-EP2281563A1, 7293-EP2301933A1, 7293-EP2308872A1, 7293-EP2311807A1, 7293-EP2311827A1, 7293-EP2316459A1, 7293-EP2316829A1, 90S028, C06202, H-3700, 96428-EP2295429A1, 96428-EP2305629A1, 116358-EP2374783A1, 116358-EP2377841A1, A843413, I01-4510, F2190-0607, InChI=1/C7H6O2/c8-5-6-3-1-2-4-7(6)9/h1-5,9, 27761-48-4


ID: 2112

chemical graph of compound 2112



InChIKey: SNGGBKYQZVAQKA-UHFFFAOYSA-N
SMILES: C1CC(CN(C1)CCC=C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)O.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6917797
synonyms found at PubChem are:
85375-15-1, SKF 89976A hydrochloride, 1-(4,4-Diphenylbut-3-en-1-yl)piperidine-3-carboxylic acid hydrochloride, SKF-89976A, 1-(4,4-Diphenyl-3-butenyl)-3-piperidinecarboxylic acid hydrochloride, SKF 89976A HCl, SKF89976A (hydrochloride), 1-(4,4-diphenylbut-3-enyl)piperidine-3-carboxylic acid hydrochloride, C22H26ClNO2, 1-(4,4-Diphenyl-3-buten-1-yl)-3-piperidinecarboxylic acid hydrochloride, CHEMBL543557, SMR000326919, SR-01000076217, AC1OCEO0, EU-0101151, SKF89976A(hydrochloride), MLS000860061, MLS006010709, SCHEMBL10964540, CTK8C4819, KS-00001CLC, DTXSID60426065, SK&F 89976-A, hydrochloride, MolPort-003-959-631, SNGGBKYQZVAQKA-UHFFFAOYSA-N, BCP02921, SK&F-89976A, Tox21_501151, ANW-73232, BN0612, MFCD01321071, AKOS016008496, API0008304, CS-6040, HY-100228A, LP01151, TRA0077645, NCGC00094414-01, NCGC00261836-01, AC-27756, BCP0726000297, AX8050759, KB-214138, LS-114699, TC-161977, SKF-89976A, >98% (HPLC), solid, ST24037269, X6861, S 9066, SR-01000076217-1, SR-01000076217-3, 1-(4,4-diphenyl-3-butenyl)-3-piperidine carboxylic acid hydrochloride, 1-(4,4-diphenyl-3-butenyl)-3-piperidinecarboxylic acid hydrochloride?SKF 89976A HCl


ID: 2113

chemical graph of compound 2113



InChIKey: SNHRLVCMMWUAJD-SUYDQAKGSA-N
SMILES: CCCCC(=O)O[C@@]1([C@H](C[C@@H]2[C@@]1(C[C@@H]([C@]3([C@H]2CCC4=CC(=O)C=C[C@@]43C)F)O)C)C)C(=O)CO

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 16533
synonyms found at PubChem are:
BETAMETHASONE VALERATE, Betamethasone 17-valerate, 2152-44-5, Betnovate, Betaderm, Luxiq, beta-Val, Celestoderm, Bedermin, Betatrex, Bextasol, Valnac, Betnovateat, Dermovaleas, Betneval, Dermosol, Tokuderm, Betamethasone-17-valerate, Celeston valerate, beta-Methasone 17-valerate, Ecoval 70, Topagen (Veterinary), Gentocin (Veterinary), UNII-9IFA5XM7R2, 9IFA5XM7R2, C27H37FO6, CHEBI:31277, SNHRLVCMMWUAJD-SUYDQAKGSA-N, Betamethasone valerate (Betnovate), EINECS 218-439-3, [(8S,9R,10S,11S,13S,14S,16S,17R)-9-fluoro-11-hydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] pentanoate, Pregna-1,4-diene-3,20-dione, 9-fluoro-11,21-dihydroxy-16-methyl-17-((1-oxopentyl)oxy)-, (11beta,16beta)-, 9alpha-Fluoro-16beta-methylprednisolone 17-valerate, 1,4-Pregnadiene-11beta,17alpha,21-triol-9alpha-fluoro-16beta-methyl-3,20-dione 17-valerate, 9-Fluoro-11-beta,17,21-trihydroxy-16-beta-methylpregna-1,4-diene-3,20-dione-17-valerate, 9-Fluoro-11beta,17,21-trihydroxy-16beta-methylpregna-1,4-diene-3,20-dione 17-valerate, 9-Fluoro-11beta,17,21-trihydroxy-16beta-methylpregna-1,4-diene-3,20-dione-17-valerate, 9-fluoro-11beta,21-dihydroxy-16beta-methyl-3,20-dioxopregna-1,4-dien-17-yl pentanoate, 9-fluoro-11beta,21-dihydroxy-16beta-methyl-3,20-dioxopregna-1,4-dien-17-yl valerate, Flubenisolonvalerate, (2S,10S,11S,13S,15S,17S,1R,14R)-1-fluoro-17-hydroxy-14-(2-hydroxyacetyl)-2,13, 15-trimethyl-5-oxotetracyclo[8.7.0.0<2,7>.0<11,15>]heptadeca-3,6-dien-14-yl pe ntanoate, 9alpha-Fluoro-16beta-methyl-11beta,17alpha,21-trihydroxy-1,4-pregnadiene-3,20-dione 17-valerate, Betamethasone Valerate (Betamethasone 17-Valerate), entanoate, Bettamousse, Betaval, Fuciderm, Stanoval, Betoid, Celestoderm V, Celestoderm-V, Betnesol V, Betnesol-V, Celestan V, Celestan-V, Celestane V, Rinderon V, NCGC00274064-01, Rinderon-V (TN), Luxiq (TN), Topagen (Salt/Mix), Beta-Val (TN), Betatrex (Salt/Mix), Gentocin (Salt/Mix), Chlorophytum Borivilanum, Betamethason-17-valerate, DSSTox_CID_2673, Betamethasone 17a-valerate, D03SXE, SCHEMBL7270, CHEMBL1497, DSSTox_RID_76684, DSSTox_GSID_22673, Betamethasone 17alpha-valerate, AC1L285F, DTXSID7022673, MolPort-003-933-651, Betnovate;Celestone;Betaderm;Luxiq, ZINC3882052, Betamethasone valerate (JP17/USP), Tox21_302288, MFCD00867446, s1690, AKOS015994704, KS-1198, RL02645, Betamethasone valerate [USAN:BAN:JAN], Betamethasone valerate [USAN:USP:JAN], NCGC00255185-01, AN-14218, ST075178, CAS-2152-44-5, AB2000222, LS-118456, D01357, AB01274710-01, AB01274710_02, 152M445, BRD-K34032314-001-04-1, (11.beta.,16.beta.)-9.alpha.-Fluoro-11,17,21-trihydroxy-16-methylpregna-1,4-diene-3,20-dione 17.alpha.-valerate, (11beta,16beta)-9-fluoro-11,21-dihydroxy-16-methyl-3,20-dioxopregna-1,4-dien-17-yl pentanoate, (8S,9R,10S,11S,13S,14S,16S,17R)-9-fluoro-11-hydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-3-oxo-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-17-yl p, (8S,9R,10S,11S,13S,14S,16S,17R)-9-fluoro-11-hydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-3-oxo-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-17-yl pentanoate, 12772-60-0, 149665-14-5, 9-Fluoro-11.beta.,17,21-trihydroxy-16.beta.-methylpregna-1,4-diene-3,20-dione 17-valerate, 9-Fluoro-11.beta.,21-dihydroxy-16.beta.-methyl-3,20-dioxopregna-1,4-dien-17-yl pentanoate #, 944728-94-3, Pregna-1,4-diene-3,20-dione, 9-fluoro-11,21-dihydroxy-16-methyl-17-((1-oxopentyl)oxy)-,(11-beta,16-beta)-


ID: 2114

chemical graph of compound 2114



InChIKey: SNJIJYKMYQRHRC-UHFFFAOYSA-M
SMILES: CC(CC1=CC=C(C=C1)OCC(=O)[O-])NCC(C2=CC(=CC=C2)Cl)O.[Na+]

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 2436
synonyms found at PubChem are:
BRL 37344 sodium, BRL 37344 sodium salt, 127299-93-8, AC1L1DO8, CHEMBL1445411, CTK8E7228, DTXSID80274368, HMS3260H15, Tox21_500197, AKOS025294254, CCG-204292, LP00197, amino]propyl]phenoxy]-acetic acid sodium, NCGC00015133-02, NCGC00015133-03, NCGC00015133-04, NCGC00093673-01, NCGC00093673-02, NCGC00260882-01, RT-011817, B-169, EU-0100197, J-005478, ( inverted question mark)-(R*,R*)-[4-[2-[[2-(3-Chlorophenyl)-2-hydroxyethyl], sodium 2-[4-[2-[[2-(3-chlorophenyl)-2-hydroxyethyl]amino]propyl]phenoxy]acetate


ID: 2115

chemical graph of compound 2115



InChIKey: SNPLKNRPJHDVJA-ZETCQYMHSA-N
SMILES: CC(C)(CO)[C@H](C(=O)NCCCO)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 131204
synonyms found at PubChem are:
Dexpanthenol, D-Panthenol, Pantothenol, 81-13-0, Bepanthen, D-Pantothenyl alcohol, Ilopan, (+)-Panthenol, Bepanthene, Bepantol, Thenalton, Zentinic, Cozyme, Motilyn, Panadon, Pantol, Provitamin B, Panthoderm, Pantothenyl alcohol, panthenol, Synapan, D-P-A Injection, D(+)-Panthenol, Pantenyl, D(+)-Pantothenyl alcohol, d-Pantothenol, d panthenol, D-Panthenol 50, (R)-2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide, N-Pantoyl-propanolamine, Urupan, Panthenol (D), Propanolamine, N-pantoyl-, (2R)-2,4-dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide, UNII-1O6C93RI7Z, Panthenol (JAN), Pantothenylol, Intrapan, Prestwick_529, Ilopan (TN), D-(+)-2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutyramide, Provitamin B5, Dextro pantothenyl alcohol, Alcopan-250, NSC 302962, Butanamide, 2,4-dihydroxy-N-(3-hydroxypropyl)-3,3-dimethyl-, (2R)-, Dexpantenol, Dexpanthenolum, 1O6C93RI7Z, CHEBI:27373, Pantothenol, D-, SNPLKNRPJHDVJA-ZETCQYMHSA-N, Pro-itamin B5, component of Pantho-F, NCGC00142622-03, 2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide, (R)-, 2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutyramide, D-(+)-, Butanamide, 2,4-dihydroxy-N-(3-hydroxypropyl)-3,3-dimethyl-, (R)-, Butyramide, 2,4-dihydroxy-N-(3-hydroxypropyl)-3,3-dimethyl-, D-(+)-, DSSTox_CID_2906, Dexpantenol [INN-Spanish], Dexpanthenolum [INN-Latin], DSSTox_RID_76783, DSSTox_GSID_22906, Q-201048, CCRIS 3947, HSDB 296, (R)-2,4-Dihydroxy-3,3-dimethylbutyric 3-hydroxypropylamide, Sinecort, (R)-2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutyramide, EINECS 201-327-3, component of Zentinic, Panthenol, (+)-, BRN 1724947, N-Pantoyl-3-propanolamine, (R)-2,4-Dihydroxy-N-(3-hydroxy-propyl)-3,3-dimethylbutanamide, Dexpanthenol;, NSC302962, D(+)-alpha,gamma-Dihydroxy-N-(3-hydroxypropyl)-beta,beta-dimethylbutyramide, alpha,gamma-Dihydroxy-N-(3-hydroxypropyl)-beta,beta-dimethylbutyramide, D-(+)-, CAS-81-13-0, NCGC00186658-01, Dexpanthenol [USAN:USP:INN:BAN], Dexpanthenol (USP), I notEuEOO- B, BAY 81-2996, Panthenol, (+ )-, AC1L2YRI, Prestwick0_000022, Prestwick1_000022, Prestwick2_000022, Prestwick3_000022, Dexpanthenol (USP/INN), D-Panthenol USP/BP/IP, bmse000445, EC 201-327-3, AC1Q5PG6, OOEthy. masculine (1/4), SCHEMBL15861, BSPBio_000083, 4-04-00-01652 (Beilstein Handbook Reference), SPBio_002004, (R)-(+)-2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutyramide, BPBio1_000093, Butanamide, 2,4-dihydroxy-N-(3-hydroxypropyl)-3,3-dimethyl-, (theta)-, CHEMBL1200979, Dexpanthenol - USP/FCC Kosher, DTXSID3022906, CTK0H4656, MolPort-003-666-677, Dexpanthenol (Pantothenyl Alcohol), HMS1568E05, HMS2094E09, HMS2095E05, HMS3712E05, OOEthy. masculineo pound (1/4), HY-B1391, ZINC1530303, D-Panthenol, >=98.0% (NT), Tox21_111563, LMFA08020198, MFCD00065006, s4695, SBB012405, AKOS015841507, AKOS015901947, Calcium D-Pantothenate USP/BP/EP/IP, Tox21_111563_1, API0002283, CCG-213429, CS-8175, DB09357, KS-00000L92, NCGC00142622-01, NCGC00142622-04, AJ-26649, AK113720, AS-14732, BC219267, CC-26375, CJ-23957, M365, SC-18189, ST072186, Dexpanthenol, tested according to Ph.Eur., SBI-0206936.P001, AX8043145, KB-209778, ST2414430, TC-165573, D-Panthenol, Vetec(TM) reagent grade, 98%, FT-0625596, P0692, C05944, D00193, C-27429, I14-13305, A6CF1A81-5B98-4C28-A379-EA28FA9DD210, (R)-3-(2,4-Dihydroxy-3,3-dimethylbutyramido)-1-propanol, UNII-WV9CM0O67Z component SNPLKNRPJHDVJA-ZETCQYMHSA-N, Dexpanthenol, European Pharmacopoeia (EP) Reference Standard, (2R)-2,4-dihydroxy-N-(3-hydroxypropyl)-3,3-dimethyl-butanamide, (R)-()-2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutyramide, (R)-(+)-2,4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutanamide, (R)-2,4-Dihydroxy-N-(3-hydroxy-propyl)-3,3-dimethyl-butyramide, d(+)-2,4-dihydroxy-n-(3-hydroxypropyl)-3,3-dimethylbutyramide, D-(+)-2,4-Dihydroxy-3,3-dimethyl-N-(3-hydroxypropyl)butyramide, D-Panthenol, >=98% (perchloric acid titration), >=98% (TLC), Dexpanthenol, United States Pharmacopeia (USP) Reference Standard, (D)-(+)-2, 4-Dihydroxy-N-(3-hydroxypropyl)-3,3-dimethylbutyramide, Dexpanthenol, Pharmaceutical Secondary Standard; Certified Reference Material, (R)-(+)-2,4- paragraph signthornoC>>u-N-(3-oC>>u+/-u>>u)-3,3- paragraph signthorn(1/4)x>>u paragraph sign inverted exclamation marko pound degrees ., 17307-32-3, 50584-68-4


ID: 2116

chemical graph of compound 2116



InChIKey: SNUHZNCSBAQVJV-DPGSLPGRSA-N
SMILES: CC(=O)/C=C\[C@@H]1[C@]2(CCCC(C2CC[C@@]1(C)O)(C)C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6857787
synonyms found at PubChem are:
8-HYDROXY-15,16-BISNOR-11-LABDEN-13-ONE, AC1OAH7A, Spectrum5_001614, BSPBio_002855, SPECTRUM300060, CHEMBL3039484, CCG-38554, SDCCGMLS-0066873.P001, NCGC00178431-01, SR-05000002526, SR-05000002526-1, BRD-A61864215-001-02-9, (Z)-4-[(1R,2R,8aS)-2-hydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]but-3-en-2-one


ID: 2117

chemical graph of compound 2117



InChIKey: SOEDEYVDCDYMMH-UHFFFAOYSA-N
SMILES: C1=CC2=C(C=C1O)OC(=C(C2=O)O)C3=CC(=C(C(=C3)O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5281692
synonyms found at PubChem are:
Robinetin, 490-31-3, Norkanugin, 3,7-Dihydroxy-2-(3,4,5-trihydroxyphenyl)-4H-chromen-4-one, 5-Deoxymyricetin, 5-Hydroxyfisetin, 4H-1-Benzopyran-4-one, 3,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-, UNII-KJ6DBC4U7E, 3,7,3',4',5'-pentahydroxyflavone, 3,3',4',5',7-Pentahydroxyflavone, NSC 407331, NSC 656274, CCRIS 7520, EINECS 207-709-6, KJ6DBC4U7E, NSC-407331, BRN 0308905, CHEBI:8876, CHEMBL170405, FLAVONE, 3,3',4',5',7-PENTAHYDROXY-, NSC656274, 3,7-Dihydroxy-2-(3,4,5-trihydroxyphenyl)-4-benzopyrone, 3,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)chromen-4-one, 3,7-Dihydroxy-2-(3,4,5-trihydroxy-phenyl)-chromen-4-one, 3,7,3',4',5'-Pentahydroxuflavone, AC1NQYWM, D07NAY, 5-18-05-00562 (Beilstein Handbook Reference), SCHEMBL217743, DTXSID30197654, MolPort-004-960-055, SOEDEYVDCDYMMH-UHFFFAOYSA-N, ZINC4098600, 3,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-4H-1-benzopyran-4-one, BDBM50033767, LMPK12111577, NSC407331, AKOS016009494, Flavone,3',4',5',7-pentahydroxy-, CCG-208323, MCULE-2330347941, NSC-656274, NCGC00163615-01, 4CN-0354, AJ-48014, AK112322, LS-69031, 3,7,3'',4'',5''-Pentahydroxyflavone, 3,3'',4'',5'',7-pentahydroxy flavone, AX8150478, KB-234373, FT-0724738, ST24041297, W1691, C10177, WLN: T66 BO EVJ CR CQ DQ EQ& DQ IQ, SR-05000002311, SR-05000002311-2, 4H-1-Benzopyran-4-one, 3,7-dihydroxy-2-(3,4,5-trihydroxyphenyl), 4H-1-Benzopyran-4-one, 3,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)- (9CI)


ID: 2118

chemical graph of compound 2118



InChIKey: SORAZNWVQFKAFD-JBDLWBSISA-N
SMILES: CCN(CC)C(=O)N[C@@H]1CC2C(CC3=CNC4=CC=CC2=C34)N(C1)C.C(=C\C(=O)O)\C(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 45105101
synonyms found at PubChem are:
S(-)-terguride hydrogen maleate, HMS1570J16


ID: 2119

chemical graph of compound 2119



InChIKey: SOYAGMVKMXZVNZ-UHFFFAOYSA-N
SMILES: CCC(C(C1=CC(=C(C=C1)O)O)O)NC(C)C.CS(=O)(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 23702
synonyms found at PubChem are:
Isoetharine mesylate salt, ISOETHARINE MESYLATE, 7279-75-6, Isotharine mesylate, Isoetarine mesilate, C13H21NO3.CH4O3S, MLS000069674, SMR000058457, Bronkometer (TN), EINECS 230-695-8, 4-[1-Hydroxy-2-[(1-methylethyl)amino]butyl]-1,2-benzenediol mesylate salt, 4-[1-HYDROXY-2-([1-METHYLETHYL]AMINO)BUTYL]-1,2-BENZENEDIOL METHANESULFONATE, Isoetharine mesylate (USP), SR-01000000183, Isoetharine mesylate [USAN:BAN], 3,4-Dihydroxy-alpha-(1-(isopropylamino)propyl)benzyl alcohol methanesulfonate (salt), NCGC00017071-01, CAS-7279-75-6, Prestwick_1003, 4-[1-hydroxy-2-(propan-2-ylamino)butyl]benzene-1,2-diol;methanesulfonic acid, Opera_ID_1465, AC1L2MV5, DSSTox_CID_25571, DSSTox_RID_80968, DSSTox_GSID_45571, MLS001146940, SCHEMBL212005, REGID_for_CID_23702, CHEMBL1201153, DTXSID2045571, CTK8G0377, 1,2-Benzenediol, 4-(1-hydroxy-2-((1-methylethyl)amino)-butyl)-, methanesulfonate (salt), HMS1570E20, HMS2093J16, HMS2097E20, HMS2230F06, HMS3262G03, HMS3714E20, Pharmakon1600-01505977, Tox21_110768, Tox21_500671, 2481AH, MFCD00133422, NSC759286, AKOS015889242, API0008431, CCG-213584, LP00671, NSC-759286, NCGC00016157-02, NCGC00094032-01, NCGC00261356-01, LS-176993, EU-0100671, D04626, I 3639, SR-01000000183-2, SR-01000000183-4, SR-01000000183-6, I01-18976, 4-(1-hydroxy-2-(isopropylamino)butyl)benzene-1,2-diol methanesulfonate, 4-[1-Hydroxy-2-[(1-methylethyl)amino]butyl]-1,2-benzenediol mesylate, 4-[1-hydroxy-2-(propan-2-ylamino)butyl]benzene-1,2-diol; methanesulfonic acid


ID: 2120

chemical graph of compound 2120



InChIKey: SPIFQXPRSJKRAO-UHFFFAOYSA-N
SMILES: CCCC(=O)NCCC1=C2C3=CC=CC=C3CCCN2C4=C1C=C(C=C4)OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5311198
synonyms found at PubChem are:
K 185, K185, CHEMBL274438, 32223-82-8, K-185, N-[2-(11-methoxy-6,7-dihydro-5H-indolo[2,1-a][2]benzazepin-13-yl)ethyl]butanamide, K 185, solid, AC1NSK6Z, Lopac-K-1888, D0WE4C, Lopac0_000696, GTPL1359, CTK8G0422, DTXSID80415512, SPIFQXPRSJKRAO-UHFFFAOYSA-N, HMS3262K13, ZINC2511691, Tox21_500696, BDBM50086001, CCG-204781, LP00696, NCGC00015579-01, NCGC00015579-02, NCGC00015579-03, NCGC00015579-04, NCGC00094050-01, NCGC00094050-02, NCGC00261381-01, EU-0100696, K 1888, L000326, SR-01000075950, SR-01000075950-1, N-[2-(10-Methoxy-6,7-dihydro-5H-7a-azadibenzo[a,e]azulene-12-yl)ethyl]butanamide, N-[2-(11-Methoxy-6,7-dihydro-5H-benzo[3,4]azepino[1,2-a]indol-13-yl)-ethyl]-butyramide, N-Butanoyl 2-(5,6,7-trihydro-11-methoxybenzo[c]cyclohept-[2,1-a]-indol-13-yl)ethanamine, N-Butanoyl 2-(5,6,7-trihydro-11-methoxybenzo[c]cyclohept[2,1-a]indol-13-yl)ethanamine


ID: 2121

chemical graph of compound 2121



InChIKey: SPXACGZWWVIDGR-SPZWACKZSA-N
SMILES: CC(C)[C@@]1(C(=O)N2[C@H](C(=O)N3CCC[C@H]3[C@@]2(O1)O)CC4=CC=CC=C4)NC(=O)[C@@H]5C[C@H]6[C@@H](CC7=CNC8=CC=CC6=C78)N(C5)C.CS(=O)(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 444034
synonyms found at PubChem are:
DIHYDROERGOCRISTINE MESYLATE, 24730-10-7, Dihydroergocristinmesilat, UNII-DS7CL18UAM, Dihydroergocristine mesilate, MLS000069354, 9,10-Dihydroergocristine methanesulfonate, DS7CL18UAM, SMR000058240, CHEBI:31490, Dihydroergocristine methanesulfonate salt, 5'alpha-Benzyl-9,10alpha-dihydro-12'-hydroxy-2'-isopropylergotaman-3',6',18-trione monomethanesulphonate, Dihydroergocristine methanesulfonate, SR-01000075381, Diertine (TN), Prestwick_745, Opera_ID_1422, AC1L9FL7, MLS001076298, MLS001333686, MLS002222256, SCHEMBL178144, cid_444034, CHEMBL1255837, BDBM30706, DTXSID20872322, 9,10-dihydroergocristine mesilate, 9,10-dihydroergocristine mesylate, MolPort-000-763-385, HMS1569B06, HMS2096B06, HMS2233K22, Dihydroergocristine mesilate (BAN), AKOS024458318, CCG-208194, NCGC00025380-03, AN-18718, ST056345, D-155, EU-0100409, MLS000069354-02, C13168, D07833, SR-01000000009, J-015650, SR-01000000009-2, SR-01000075381-1, UNII-X3S33EX3KW component SPXACGZWWVIDGR-SPZWACKZSA-N, Dihydroergocristine mesilate, European Pharmacopoeia (EP) Reference Standard, (10alphaH)-5'alpha-benzyl-12'-hydroxy-3',6',18-trioxo-2'-(propan-2-yl)-9,10-dihydroergotaman methanesulfonate, (5'?,10?)-9,10-Dihydro-12'-hydroxy-2'-(1-methylethyl)-5'-(phenylmethyl)-ergotaman-3',6',18-trione mesylate, (6aR,9R,10aR)-N-((2R,5S,10aS,10bS)-5-benzyl-10b-hydroxy-2-isopropyl-3,6-dioxooctahydro-2H-oxazolo[3,2-a]pyrrolo[2,1-c]pyrazin-2-yl)-7-methyl-4,6,6a,7,8,9,10,10a-octahydroindolo[4,3-fg]quinoline-9-carboxamide methanesulfonate, (6aR,9R,10aR)-N-[(2R,5S,10aS,10bS)-5-Benzyl-10b-hydroxy-2-(1-methylethyl)-3,6-dioxo-octahydro-8H-oxazolo[3,2-a]pyrrolo[2,1-c]pyrazin-2-yl]-7-methyl-4,6,6a,7,8,9,10,10a-octahydroindolo[4,3-fg]quinoline, 22288-21-7, 25377-54-2, 27400-83-5


ID: 2122

chemical graph of compound 2122



InChIKey: SQFSKOYWJBQGKQ-UHFFFAOYSA-N
SMILES: COC1=CC=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5281666
synonyms found at PubChem are:
Kaempferide, 491-54-3, Kaempferid, 4'-Methylkaempferol, 4'-O-Methylkaempferol, Kaempferol 4'-methyl ether, Campheride, Kaemperide, Kempferide, UNII-508XL61MPD, 4'-Methoxy-3,5,7-trihydroxyflavone, NSC 407294, KAMPFERIDE, 4H-1-Benzopyran-4-one, 3,5,7-trihydroxy-2-(4-methoxyphenyl)-, 5,7-Dihydroxy-4'-methoxyflavonol, 3,5,7-Trihydroxy-2-(4-methoxyphenyl)-4H-chromen-4-one, EINECS 207-738-4, BRN 0305378, 3,5,7-Trihydroxy-2-(4-methoxyphenyl)-4-benzopyrone, CHEMBL40919, Flavone, 3,5,7-trihydroxy-4'-methoxy-, 508XL61MPD, CHEBI:6099, FLAVANONE, 4'-METHOXY-3,5,7-TRIHYDROXY-, 3,5,7-trihydroxy-2-(4-methoxyphenyl)chromen-4-one, 3,5,7-Trihydroxy-4'-methoxyflavone, NSC407294, NSC-407294, 3,5,7-TRIHYDROXY-2-(4-METHOXY-PHENYL)-CHROMEN-4-ONE, 4'-Methoxykaempferol, Kaemferide, Kampheride, Kaempferol 4'-O-methyl ether, 4'-Methoxy-3',5,7-trihydroxyflavone, AC1NQYUM, D04DYO, Kaempferol 4''-methyl ether, 5-18-05-00253 (Beilstein Handbook Reference), SCHEMBL426774, Kaempferide, analytical standard, DTXSID9034155, CTK7A3406, MolPort-000-165-394, SQFSKOYWJBQGKQ-UHFFFAOYSA-N, BCP20573, ZINC6411540, BDBM50084978, CK-008, LMPK12110563, 3 5 7-trihydroxy-4'-methoxyflavone, Flavone,5,7-trihydroxy-4'-methoxy-, AKOS015903441, 3,5,7-Trihydroxy-4'-methoxy-Flavone, API0003064, CS-0957, MCULE-9836342232, VA11124, KS-00000I07, 4'-Methoxy-3,5,7-trihydroxy-Flavanone, 4CN-0210, HY-15449, LS-68935, ST085668, AB0102453, FT-0625213, N1286, WLN: T66 BO EVJ CR DO1& DQ GQ IQ, C10098, W-5043, A827662, I14-19013, 1.3,5,7-Trihydroxy-2-(4-methoxyphenyl)-4-benzopyrone, 2-(4-methoxyphenyl)-3,5,7-tris(oxidanyl)chromen-4-one, 3,5,7-trihydroxy-2-(4-methoxyphenyl)-1-benzopyran-4-one, 3,5,7-Trihydroxy-2-(4-methoxyphenyl)-4H-chromen-4-one #, 4H-1-Benzopyran-4-one,3,5,7-trihydroxy-2-(4-methoxyphenyl)-, 4H-1-Benzopyran-4-one,5,7-trihydroxy-2-(4-methoxyphenyl)-, 3,5,7-Trihydroxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one, 9CI, 4H-1-Benzopyran-4-one, 3,5,7-trihydroxy-2-(4-methoxyphenyl)- (9CI)


ID: 2123

chemical graph of compound 2123



InChIKey: SQMWSBKSHWARHU-SDBHATRESA-N
SMILES: C1CCC(C1)NC2=NC=NC3=C2N=CN3[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 657378
synonyms found at PubChem are:
N6-Cyclopentyladenosine, 41552-82-3, (2R,3R,4S,5R)-2-(6-(Cyclopentylamino)-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol, Cyclopentyladenosine, n-cyclopentyladenosine, CHEMBL68738, MLS000028368, N(6)-Cyclopentyladenosine, SMR000058639, (2R,3R,4S,5R)-2-[6-(cyclopentylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol, Adenosine, N-cyclopentyl-, N6-CyclopentylAdo, n-cyclopentyl-adenosine, n6-cyclopentyl-adenosine, AC1LCWG1, Opera_ID_1056, D03RFA, GTPL380, MLS001077332, MLS002153196, SCHEMBL120481, N6-cyclopentyladenosine (CPA), N6-Cyclopentyladenosine, solid, cid_657378, BDBM25400, CTK1D5898, MolPort-023-276-193, SQMWSBKSHWARHU-SDBHATRESA-N, HMS2232M15, ZINC3995996, 5720AB, MFCD00036845, PDSP1_001069, PDSP2_001053, AKOS016009596, NCGC00023909-04, NCGC00023909-05, NCGC00023909-06, AC-27402, AJ-47612, LS-15119, AX8142877, KB-206470, ST24026157, J-523544, (2R,3R,4S,5R)-2-[6-(cyclopentylamino)-9H-purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol, 3GU


ID: 2124

chemical graph of compound 2124



InChIKey: SRGKFVAASLQVBO-BTJKTKAUSA-N
SMILES: CN(C)CCC(C1=CC=C(C=C1)Br)C2=CC=CC=N2.C(=C\C(=O)O)\C(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5281067
synonyms found at PubChem are:
Brompheniramine maleate, 980-71-2, Brompheniramine hydrogen maleate, Dimetane, Rolabromophen, Dimotane, Drauxin, Gammistin, Nagemid, Spentane, Allent, Ebalin, Dimetane-ten, Parabromdylamine maleate, Veltane, Ilvin, Drixoral Syrup, Brompheniramine (maleate), Dimetapp Allergy, Dimetane Extentabs, Lodrane, Brompheniramine maleate [USP], EINECS 213-562-9, MLS000028423, CHEBI:3184, (+/-)-Brompheniramine maleate salt, SMR000058417, 2-(p-Bromo-alpha-(2-(dimethylamino)ethyl)benzyl)pyridine maleate, 2-(p-Bromo-alpha-(2-(dimethylamino)ethyl)benzyl)pyridine maleate (1:1), 2-Pyridinepropanamine, gamma-(4-bromophenyl)-N,N-dimethyl-, (+-)-, (Z)-2-butenedioate (1:1), 2-Pyridinepropanamine, gamma-(4-bromophenyl)-N,N-dimethyl-, (Z)-butenedioate (1:1), W-100095, (+-)-2-p-Bromo-alpha-2-(dimethylamino)ethylbenzylpyridine maleate (1:1), Pyridine, 2-(p-bromo-alpha-(2-(dimethylamino)ethyl)benzyl)-, maleate (1:1), 2-Pyridinepropanamine, gamma-(4-bromophenyl)-N,N-dimethyl-, (+-)-, (Z)-butenedioate (1:1), 2-Pyridinepropanamine, gamma-(4-bromophenyl)-N,N-dimethyl-, (2Z)-2-butenedioate (1:1), d-Brompheniramine maleate, l-Brompheniramine maleate, Bromopheniramine maleate, SR-01000003057, Brompheniramine d-form maleate, EINECS 219-236-2, 3-(4-bromophenyl)-N,N-dimethyl-3-pyridin-2-ylpropan-1-amine;(Z)-but-2-enedioic acid, Dimetane (TN), Prestwick_913, 3-(4-bromophenyl)-N,N-dimethyl-3-(pyridin-2-yl)propan-1-amine maleate, Brompheniramine fumarate, Opera_ID_399, AC1NQXZ5, (y)-Brompheniramine maleate, brompheniramine; maleic acid, (?)-Brompheniramine maleate, SCHEMBL41913, MLS001148196, 86-22-6 (Parent), SPECTRUM1503985, 980-71-2 (maleate), (+/-)-Brompheniramine maleate, Brompheniramine maleate (USAN), (+)-2-(p-Bromo-alpha-(2-(dimethylamino)ethyl)benzyl)pyridine maleate, (-)-2-(p-Bromo-alpha-(2-(dimethylamino)ethyl)benzyl)pyridine maleate, Bioompheniramine hydrogen maleate, CHEMBL1200961, DTXSID2052657, (A+/-)-Brompheniramine maleate, (+)-2-(p-Bromo-alpha-(2-(dimethylamino)ethyl)benzyl)pyridine maleate (1:1), (S)-2-(p-Bromo-alpha-(2-(dimethylamino)ethyl)benzyl)pyridinium (Z)-maleate (1:1), MolPort-003-666-520, Pyridine, 2-(p-bromo-alpha-(2-(dimethylamino)ethyl)benzyl)-, maleate (1:1), (-)-, Pyridine, 2-(p-bromo-alpha-(2-(dimethylamino)ethyl)benzyl)-, maleate (1:1), (S)-, BCPP000315, HMS1569O12, HMS1922O16, HMS2093O07, HMS2096O12, HMS2230I21, HMS2234D14, HMS3260J03, HMS3713O12, Pharmakon1600-01503985, 2-Pyridinepropanamine, gamma-(4-bromophenyl)-N,N-dimethyl-, (S)-, (Z)-2-butenedioate (1:1), HY-B0480, Tox21_500201, CCG-39068, NSC758652, s2585, AKOS015855858, AC-1311, BCP9000453, CS-2595, LP00201, NSC-758652, NCGC00093676-01, NCGC00093676-02, NCGC00093676-03, NCGC00093676-04, NCGC00093676-05, NCGC00260886-01, AN-15069, AS-14101, BC214875, SMR000653459, BCP0726000240, AB2000679, LS-130306, LS-130307, LS-130309, LS-130310, EU-0100201, B 2390, D00663, ( inverted question mark)-Brompheniramine maleate, SR-01000003057-2, SR-01000003057-4, SR-01000003057-5, SR-01000003057-8, 2- p-Bromo-a-2-(dimethylamino)ethylbenzylpyridine maleate, 2-(p-bromo-alpha-(2-dimethylaminoethyl)benzyl)pyridine maleate, Brompheniramine Maleate 1.0 mg/ml in Methanol (as free base), 1-(p-bromophenyl)-1-(2-pyridyl)-3-dimethylaminopropane maleate, 3-(p-bromophenyl)-3-(2-pyridyl)-N,N-dimethylpropylamine maleate, 3-(4-bromophenyl)-N,N-dimethyl-3-(2-pyridinyl)-1-propanamine maleate, 3-(4-bromophenyl)-N,N-dimethyl-3-(2-pyridyl)propan-1-amine; maleic acid, Brompheniramine maleate, United States Pharmacopeia (USP) Reference Standard, 3-(4-bromophenyl)-N,N-dimethyl-3-(pyridin-2-yl)propan-1-amine (2Z)-but-2-enedioate, 3-(4-bromophenyl)-N,N-dimethyl-3-pyridin-2-ylpropan-1-amine; (Z)-but-2-enedioic acid, Brompheniramine Maleate, Pharmaceutical Secondary Standard; Certified Reference Material, 32865-01-3, 8055-73-0


ID: 2125

chemical graph of compound 2125



InChIKey: SRJOCJYGOFTFLH-UHFFFAOYSA-N
SMILES: C1CNCCC1C(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3773
synonyms found at PubChem are:
Isonipecotic acid, Piperidine-4-carboxylic acid, 498-94-2, 4-Piperidinecarboxylic acid, 4-Carboxypiperidine, Hexahydroisonicotinic acid, dl-isopipecolinic acid, Isonicotinic acid, hexahydro-, h-inp-oh, Acide isonipecotique, 4-Hexahydroisonicotinic acid, NSC 61049, UNII-M5TZP1RWIE, iso-nipecotic acid, Acide isonipecotique [French], Acide piperidine-carboxylique-4, h-pic(4)-oh, M5TZP1RWIE, EINECS 207-872-3, BRN 0112553, 4-Piperidine carboxylic acid, Acide piperidine-carboxylique-4 [French], CHEMBL279998, SRJOCJYGOFTFLH-UHFFFAOYSA-N, isonipecotic acid (piperidine-4-carboxylic acid), 4-Piperidinecarboxylic acid; Hexahydroisonicotinic acid, isonipecolinic acid, 4-carboxy-piperidine, PubChem7718, INP-OH, ACMC-1AHKL, AC1L1GOH, Isonipecotic acid, 97%, H-DL-INP-OH, Lopac-I18008, 4-piperidincarboxylic acid, D0AC2H, D0L6EM, 4-piperidinylcarboxylic acid, Piperidin-4-carboxylic acid, Lopac0_000705, MLS000069407, Piperidinecarboxylic acid-(4), SCHEMBL104297, AC1Q74O2, GTPL4227, DTXSID9060100, CTK1D6355, MolPort-000-145-904, HMS3262M11, ZINC156973, ACT02073, CS-D1472, KS-000000PX, NSC61049, Tox21_500705, AB2970, ANW-30868, BBL005463, BDBM50000106, FC1298, MFCD00006004, NSC-61049, SBB004231, STK498304, AKOS000118858, AB00566, CCG-204790, LP00705, LS20782, MCULE-7477545245, PS-5850, RP00909, RTC-010227, TRA0085282, TRA0089230, NCGC00015573-01, NCGC00015573-02, NCGC00015573-03, NCGC00015573-04, NCGC00015573-05, NCGC00093373-02, NCGC00093373-03, NCGC00261390-01, AC-22478, AJ-13925, AN-45340, BC202249, BR-47605, KB-59750, LS-85056, SC-04843, SMR000059085, SY001425, TL806100, AB1002739, DB-014830, AM20100215, C3382, EU-0100705, FT-0602398, I0256, ST24033220, ST50213929, A16063, B-8175, I18008, Piperidine-4-carboxylic acid(isonipecotic acid), 65148-EP2281823A2, 65148-EP2305660A1, 65148-EP2308812A2, 65148-EP2308869A1, Piperidine-4-carboxylic acid (Isonipecotic acid), SR-01000075617, I12-0039, SR-01000075617-1, W-106001, I14-23645, F2191-0187, AC1OC3FP, piperidin-1-ium-4-carboxylate, CJ-01564, ZB006493


ID: 2126

chemical graph of compound 2126



InChIKey: SRVVUYIJVBLEJI-UHFFFAOYSA-N
SMILES: CC1=C(C=CC(=C1)C2=NOC(=N2)C)C3=CC=C(C=C3)C(=O)NC4=CC(=C(C=C4)OC)N5CCN(CC5)C.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 11497466
synonyms found at PubChem are:
GR 127935 hydrochloride, GR127935 hydrochloride, 148642-42-6, GR 127935 hydrochloride hydrate, CHEBI:64111, N-[4-Methoxy-3-(4-methyl-1-piperazinyl)phenyl]-2'-methyl-4'-(5-methyl-1,2,4-oxadiazol-3-yl)-1,1'-biphenyl-4-carboxamide hydrochloride, N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]-2'-methyl-4'-(5-methyl-1,2,4-oxadiazol-3-yl)biphenyl-4-carboxamide hydrochloride, MLS002153332, 4-[2-methoxy-5-({[2'-methyl-4'-(5-methyl-1,2,4-oxadiazol-3-yl)biphenyl-4-yl]carbonyl}amino)phenyl]-1-methylpiperazin-1-ium chloride, SR-01000076115, SMR001230745, EU-0100790, GR-127935 hydrochloride, SCHEMBL6017123, CHEMBL1256656, DTXSID0042587, MolPort-023-276-117, BCP19014, Tox21_500790, ABP001016, AKOS024456623, CCG-222094, LP00790, NCGC00094125-01, NCGC00261475-01, B6754, G 5793, J-008498, SR-01000076115-1, SR-01000076115-3


ID: 2127

chemical graph of compound 2127



InChIKey: SRWHWJLUDSYHLO-LUKAEVKMSA-N
SMILES: C[C@@]12CCC3[C@]4(C=CC(=O)C(C4CC(=O)[C@]3(C1=CC(=O)O[C@H]2C5=COC=C5)C)(C)C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6708577
synonyms found at PubChem are:
SPBio_000066, Spectrum_000650, SpecPlus_000161, Spectrum2_000253, Spectrum3_000042, Spectrum4_001324, Spectrum5_000167, AC1O8FE2, BSPBio_001763, KBioGR_001787, KBioSS_001130, DivK1c_006257, SCHEMBL12998455, KBio1_001201, KBio2_001130, KBio2_003698, KBio2_006266, KBio3_000923, CCG-39814, 7-DEACETOXY-7-OXODEOXYGEDUNIN, NCGC00179027-01, BRD-A37523642-001-02-5, (1R,4bR,10aS,12aR)-1-(furan-3-yl)-4b,7,7,10a,12a-pentamethyl-1,6,6a,10b,11,12-hexahydronaphtho[2,1-f]isochromene-3,5,8-trione


ID: 2128

chemical graph of compound 2128



InChIKey: SRZNHPXWXCNNDU-RHBCBLIFSA-N
SMILES: CN1C(=NN=N1)SCC2=C(N3[C@@H]([C@@](C3=O)(NC(=O)C4SC(=C(C(=O)N)C(=O)O)S4)OC)SC2)C(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 53025
synonyms found at PubChem are:
cefotetan, 69712-56-7, Cefotetanum, Apacef, ICI 156834, MLS002153829, CHEBI:3499, Cefotetanum [INN-Latin], (6R,7S)-7-({[4-(2-amino-1-carboxy-2-oxoethylidene)-1,3-dithietan-2-yl]carbonyl}amino)-7-methoxy-3-{[(1-methyl-1H-tetrazol-5-yl)sulfanyl]methyl}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, SMR001233197, Cefotan (TN), ICI-156834, (6R,7S)-7-(4-(Carbamoylcarboxymethylene)-1,3-dithiethane-2-carboxamido)-7-methoxy-3-(((1-methyl-1H-tetrazol-5-yl)thio)methyl)-8-oxo-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7beta-({[4-(2-amino-1-carboxy-2-oxoethylidene)-1,3-dithietan-2-yl]carbonyl}amino)-7alpha-methoxy-3-{[(1-methyl-1H-tetrazol-5-yl)sulfanyl]methyl}-3,4-didehydrocepham-4-carboxylic acid, W-104601, C17H17N7O8S4, EINECS 274-093-3, BRN 1208088, ICI 156,834, (6R,7S)-7-(4-(carbamoylcarboxymethylene)-1,3-dithiethane-2-carboxamido)-7-methoxy-3-(((1-methyl-1H-tetrazol-5- yl)thio)methyl)-8-oxo-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2- carboxylic acid, (6R,7S)-7-[[4-(1-amino-3-hydroxy-1,3-dioxopropan-2-ylidene)-1,3-dithietane-2-carbonyl]amino]-7-methoxy-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, UNII-48SPP0PA9Q, Cefotetan [USAN:USP:INN:BAN], NCGC00016914-01, (6R,7S)-4-((2-Carboxy-7-methoxy-3-(((1-methyl-1H-tetrazol-5-yl)thio)methyl)-8-oxo-5-thia-1-azabicyclo(4.2.0)oct-2-en-7-yl)carbamoyl)-1,3-dithietane-delta(sup 2,alpha)-malonamic acid, 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7-(((4-(2-amino-1-carboxy-2-oxoethylidene)-1,3-dithietan-2-yl)carbonyl)amino)-7-methoxy-3-(((1-methyl-1H-tetrazol-5-yl)thio)methyl)-8-oxo-, (6R-(6alpha,7alpha))-, Cefotetan free acid, Apatef (TN), CAS-69712-56-7, Prestwick0_000473, Prestwick1_000473, Prestwick2_000473, Prestwick3_000473, DSSTox_CID_2762, D0AP9T, 48SPP0PA9Q, DSSTox_RID_76720, DSSTox_GSID_22762, SCHEMBL61376, BSPBio_000606, cid_53025, SPBio_002545, Cefotetan (JP15/USP/INN), Cefotetan (JP17/USP/INN), AC1L1E33, BPBio1_000668, CHEMBL474579, DTXSID1022762, BDBM80643, MolPort-005-935-573, ZX-AFC002959, HMS1569O08, HMS2096O08, HMS2234C15, HMS3713O08, BCP10745, ZINC3830441, Tox21_110681, AKOS015896100, AC-2141, CCG-220473, DB01330, 74356-00-6 (di-hydrochloride salt), NCGC00179507-01, CC-25578, KB-277446, AB00513847, FT-0603035, A-8477, C06886, D00260, Cefotetan, Antibiotic for Culture Media Use Only, 712C567, C-23677, SR-01000842155, I06-1743, SR-01000842155-3, (6R,7S)-7-(4-(2-amino-1-carboxy-2-oxoethylidene)-1,3-dithietane-2-carboxamido)-7-methoxy-3-((1-methyl-1H-tetrazol-5-ylthio)methyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, (6R,7S)-7-[[[4-(2-amino-1-carboxy-2-oxoethylidene)-1,3-dithietan-2-yl]-oxomethyl]amino]-7-methoxy-3-[[(1-methyl-5-tetrazolyl)thio]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, (6R,7S)-7-[[[4-(2-Amino-1-carboxy-2-oxoethylidene)-1,3-dithietan-2-yl]carbonyl]amino]-7-methoxy-3-[[(1-methyl-1H-tetrazol-5-yl)thio]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic Acid, (6R,7S)-7-[[4-(1-carbamoyl-2-hydroxy-2-oxo-ethylidene)1,3-dithietane-2-carbonyl]amino]-7-methoxy-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, (6R,7S)-7-[[4-(2-amino-1-carboxy-2-keto-ethylidene)-1,3-dithietane-2-carbonyl]amino]-8-keto-7-methoxy-3-[[(1-methyltetrazol-5-yl)thio]methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, (6R,7S)-7-[[4-(2-amino-1-carboxy-2-oxoethylidene)-1,3-dithietane-2-carbonyl]amino]-7-methoxy-3-[(1-methyltetrazol-5-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, (6R,7S)-7-[[4-[1-azanyl-3-oxidanyl-1,3-bis(oxidanylidene)propan-2-ylidene]-1,3-dithietan-2-yl]carbonylamino]-7-methoxy-3-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid


ID: 2129

chemical graph of compound 2129



InChIKey: SSAJNPNVUYMUCI-UHFFFAOYSA-N
SMILES: CCN(CC)CCOC(=O)C(CC1CCCO1)CC2=CC=CC3=CC=CC=C32.C(=O)(C(=O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 18542
synonyms found at PubChem are:
Dubimax, Dusodril, Gevatran, Praxilene, Iridus, Nafronyl acid oxalate, Naphtidrofuryl oxalate, Nafronyl oxalate [USAN], EINECS 221-703-0, NSC 225233, LS 121, EU-1806, 2-(Diethylamino)ethyl tetrahydro-alpha-(1-naphthylmethyl)-2-furanpropionate oxalate (1:1), 2-Furanpropanoic acid, tetrahydro-alpha-(1-naphthalenylmethyl)-, 2-(diethylamino)ethyl ester, ethanedioate (1:1), 2-Furanpropionic acid, tetrahydro-alpha-(1-naphthylmethyl)-, 2-(diethylamino)ethyl ester, oxalate (1:1), Diethyl(2-(2-(1-naphthylmethyl)-3-(tetrahydro-2-furyl)propionyloxy)ethyl)ammonium hydrogen oxalate, LS-121, AC1L2CA6, C24H33NO3.C2H2O4, MolPort-000-815-884, MCULE-2856913118, LS-70565, 2-Furanpropionic acid, tetrahydro-alpha-(1-naphthylmethyl)-, 2-(diethylamino)ethyl ester,oxalate (1:1), 26263-44-5, diethyl-[2-[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoyl]oxyethyl]azanium; 2-hydroxy-2-oxoacetate, Nafronyl oxalate, 3200-06-4, Naftidrofuryl oxalate, Nafronyl oxalate salt, Naftidrofuryl (oxalate), 2-(Diethylamino)ethyl 3-(naphthalen-1-yl)-2-((tetrahydrofuran-2-yl)methyl)propanoate oxalate, DSSTox_CID_25533, DSSTox_RID_80935, DSSTox_GSID_45533, naftidrofuryl hydrogen oxalate, alpha-[1-Naphthylmethyl]-2-tetrahydrofuranpropionic acid diethylaminoethyl ester, CHEMBL1439099, Nafronyl oxalate salt, analytical standard, SMR000539007, CAS-3200-06-4, NSC225233, SR-01000789261, Clarantin, 2-(diethylamino)ethyl 2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoate;oxalic acid, Naftidrofuryloxalate, Praxilene (TN), Prestwick_696, Naftidrofuryl(oxalate), 2-(Diethylamino)ethyl tetrahydro-.alpha.-(1-naphthylmethyl)-2-furanpropionate oxalate (1:1), AC1L7MCR, naftidrofuryl; oxalic acid, NCGC00016982-01, MLS000766889, MLS001032044, MLS001173344, MLS002222244, SCHEMBL123848, SPECTRUM1503419, DTXSID6045533, CTK8C4926, HMS501A20, KS-00001FAU, MolPort-003-666-484, HMS1569K15, HMS1922C14, HMS2093E15, HMS2096K15, HMS2875A08, HMS3713K15, Pharmakon1600-01503419, BCP19865, HY-B1107, Tox21_110724, ANW-73527, CCG-40305, NSC758462, AKOS015960731, Tox21_110724_1, API0006883, CS-4704, NSC-225233, NSC-758462, NCGC00095050-01, NCGC00095050-02, NCGC00178213-05, 4,4-Diaminostilbene-2,3-Disulfonic Acid, AC-12093, O219, KB-224003, ST2409387, TC-162272, FT-0629863, D05107, C-54995, J-018595, SR-01000789261-2, SR-01000789261-3, 2-Furanpropionic acid, 2-(diethylamino)ethyl ester oxalate (1:1), 2-Furanpropionic acid, 2-(diethylamino)ethyl esteroxalate (1:1), 2-Furanpropanoic acid, 2-(diethylamino)ethyl ester, ethanedioate (1:1), 2-(diethylamino)ethyl 2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoate,oxalic acid, 2-diethylaminoethyl 2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoate; oxalic acid


ID: 2130

chemical graph of compound 2130



InChIKey: SSKFWBSXNIWCBH-VCHYOVAHSA-N
SMILES: C1CN(CCN1/C=C/CC2=CC=CC=C2)C(C3=CC=CC=C3)C4=CC=CC=C4

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5353532
synonyms found at PubChem are:
cinnarazine, AC1NS4AP, Spectrum5_001056, BSPBio_002339, SPECTRUM1503204, SCHEMBL7860447, CHEMBL1370236, HMS502H10, CHEBI:109557, HMS1922I05, HMS2092N08, Pharmakon1600-01503204, CCG-39309, NSC758400, NSC-758400, IDI1_000788, NCGC00095014-01, NCGC00095014-02, NCGC00095014-03, SBI-0051784.P002, AB00052324_02, SR-05000001831, SR-05000001831-1, 1-benzhydryl-4-[(E)-3-phenylprop-1-enyl]piperazine, BRD-K32256916-001-02-4, BRD-K32256916-001-03-2


ID: 2131

chemical graph of compound 2131



InChIKey: SSMIFVHARFVINF-UHFFFAOYSA-N
SMILES: C1=CC2=C(C=CC3=C2C(=C1)C(=O)NC3=O)N

biological descriptors:

CFTR relevance: PARP-1 inhibitor

Category:
Influence on CFTR function enhances CFTR function
Order of interaction indirect
subcellular compartment Nucleus (Transcription)

reference list:

"J Liao" "HM Sampson" "F Dantzer" "R Phillipe" "DL Zhang" "R Robert" "SM Anjos" "P Ferraro" "DY Thomas" "JW Hanrahan" "J Goepp" "H Balghi" "D Waller" "GW Carlile" "F Ciciriello" "P Lesimple"
"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 1720
synonyms found at PubChem are:
4-Amino-1,8-naphthalimide, 1742-95-6, 4-Aminonaphthalimide, 6-AMINO-BENZO[DE]ISOQUINOLINE-1,3-DIONE, 6-Amino-1H-benzo[de]isoquinoline-1,3(2H)-dione, 4-Aminonaphthalene-1,8-dicarboximide, Naphthalimide, 4-amino-, DFP 1, 1H-Benz[de]isoquinoline-1,3(2H)-dione, 6-amino-, EINECS 217-110-1, 6-aminobenzo[de]isoquinoline-1,3-dione, BRN 0177185, PARP Inhibitor V, 4-ANI, CHEMBL338790, CHEBI:40071, SSMIFVHARFVINF-UHFFFAOYSA-N, 4-AMINO-1,8 NAPHTHALIMIDE, 6-Amino-1H-benz(de)isoquinoline-1,3(2H)-dione, 1H-Benz(de)isoquinoline-1,3(2H)-dione, 6-amino-, 4AN, 2pax, AC1Q6JKU, Lopac-A-0966, D03JTS, D09VUP, 4-ANI, Lopac0_000063, SCHEMBL21124, BSPBio_001430, KBioGR_000150, KBioSS_000150, 4-22-00-06603 (Beilstein Handbook Reference), AC1L1C36, ZINC8558, DTXSID6061941, BCBcMAP01_000231, BDBM27498, CTK8F5667, KBio2_000150, KBio2_002718, KBio2_005286, KBio3_000299, KBio3_000300, MolPort-002-499-717, Bio1_000370, Bio1_000859, Bio1_001348, Bio2_000150, Bio2_000630, HMS1361H12, HMS1791H12, HMS1989H12, HMS3260M07, HMS3402H12, BB_SC-07136, 4-Amino-1,8-naphthalimide, 96%, Tox21_500063, BBL027625, MFCD00006921, SBB003425, STK934866, AKOS005664748, AC-6718, CCG-204158, DB07096, LP00063, MCULE-5608953652, IDI1_033900, NCGC00015035-01, NCGC00015035-02, NCGC00015035-03, NCGC00015035-04, NCGC00015035-05, NCGC00015035-06, NCGC00015035-07, NCGC00093577-01, NCGC00093577-02, NCGC00093577-03, NCGC00093577-04, NCGC00093577-05, NCGC00260748-01, AJ-08314, AN-20710, AS-35824, CC-17680, LS-33496, ZB000667, AX8093535, A8840, EU-0100063, FT-0633814, ST50825610, A 0966, A-2606, 6-amino-1H-benz[de]-isoquinoline-1,3(2H)-dione, 7-Amino-3-hydroxy-1H-benzo[de]isoquinolin-1-one, C-30851, SR-01000075200, J-010976, SR-01000075200-1, 6-Amino-1H-benzo[de]isoquinoline-1,3(2H)-dione #, BRD-K50214219-001-02-4, I14-18437, 10-amino-3-azatricyclo[7.3.1.0^{5,13}]trideca-1(13),5,7,9,11-pentaene-2,4-dione, 4-aminonaphthalene-1,8-dicarboxylic anhydride;6-Aminobenz[de]isochromene-1,3-dione


ID: 2132

chemical graph of compound 2132



InChIKey: SSOXZAQUVINQSA-BTJKTKAUSA-N
SMILES: CN(C)CCC(C1=CC=CC=C1)C2=CC=CC=N2.C(=C\C(=O)O)\C(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5282139
synonyms found at PubChem are:
PHENIRAMINE MALEATE, 132-20-7, Inhiston, Trimetose, Daneral, Naphcon a, Avil-retard, Pheniramine hydrogen maleate, Pheniramine (Maleate), Pheniramine maleate salt, Prophenpyridamine maleate, PM 241, CCRIS 6265, EINECS 205-051-4, HO 11513, 1-Phenyl-1-(2-pyridyl)-3-dimethylaminopropane maleate, CHEBI:31990, 2-(alpha-(2-(Dimethylamino)ethyl)benzyl)pyridine, maleate, 2-(alpha-(2-(Dimethylamino)ethyl)benzyl)pyridine, bimaleate, Phenyl(2-pyridyl)(beta-N,N-dimethylaminomethyl) methane maleate, 1-(N,N-Dimethylamino)-3-(phenyl-3-alpha-pyridyl)propane maleate, 2-Pyridinepropanamine, N,N-dimethyl-gamma-phenyl-, (Z)-2-butenedioate (1:1), 2-(alpha-(2-Dimethylaminoethyl)benzyl)pyridine bimaleate, N,N-Dimethyl-3-phenyl-3-(2-pyridyl)propylamine hydrogen maleate, Pyridine, 2-(alpha-(2-(dimethylamino)ethyl)benzyl)-, maleate (1:1), (2Z)-but-2-enedioic acid; dimethyl[3-phenyl-3-(pyridin-2-yl)propyl]amine, 2-Pyridinepropanamine, N,N-dimethyl-gamma-phenyl-, (2Z)-2-butenedioate (1:1), SR-01000075263, Pheniramine maleate [USAN], Antolozine, Fervex, Pheniramine maleate [USAN:USP], (Z)-but-2-enedioic acid;N,N-dimethyl-3-phenyl-3-pyridin-2-ylpropan-1-amine, C16H20N2.C4H4O4, Prestwick_769, AC1NQZJE, CHEMBL1653, SCHEMBL25318, MLS001148181, 86-21-5 (Parent), SPECTRUM1500478, AC1Q71E7, Pheniramine maleate (JAN/USP), HMS500L17, MolPort-003-666-259, HMS1568K19, HMS1920F22, HMS2091P04, HMS2095K19, HMS2232I20, HMS3263E03, HMS3712K19, Pharmakon1600-01500478, HY-B0971, Tox21_500981, CCG-39109, LS-753, MFCD00079250, NSC757270, AKOS026749878, CS-4460, LP00981, NSC-757270, NCGC00094281-01, NCGC00094281-02, NCGC00094281-03, NCGC00094281-04, NCGC00094281-05, NCGC00261666-01, AS-12971, SMR000653458, EU-0100981, P2271, S4045, C12574, D01174, P 6902, I14-6763, J-006144, SR-01000075263-1, SR-01000075263-4, SR-01000075263-7, 2-[|A-[2-(Dimethylamino)ethyl]benzyl]pyridine Maleate, PHENIRAMINE MALEATE (SEE ALSOPHENIRAMINE 86-21-5), N,N-Dimethyl-|A-phenyl-2-pyridinepropanamine (2Z)-2-Butenedioate, Pheniramine maleate, European Pharmacopoeia (EP) Reference Standard, Pheniramine maleate, United States Pharmacopeia (USP) Reference Standard, (Z)-but-2-enedioic acid; N,N-dimethyl-3-phenyl-3-pyridin-2-ylpropan-1-amine, 155683-11-7, DSSTox_CID_5866, DSSTox_RID_77955, DSSTox_GSID_25866, Pheniramine maleate2-[3-(dimethylammonio)-1-phenylpropyl]pyridinium (2Z)-but-2-enedioate, DTXSID0025866, Tox21_111188, Tox21_201074, Tox21_111188_1, NCGC00015831-06, NCGC00258627-01, A806397, (Z)-2-butenedioate; dimethyl-[3-phenyl-3-(2-pyridin-1-iumyl)propyl]ammonium, (Z)-but-2-enedioate; dimethyl-(3-phenyl-3-pyridin-1-ium-2-yl-propyl)azanium


ID: 2133

chemical graph of compound 2133



InChIKey: SSRCYGATNWFTBJ-UHFFFAOYSA-N
SMILES: COC1=CC(=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3)O)OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5781145
synonyms found at PubChem are:
2'-methoxyformononetin, 2'-METHOXYFORMONETIN, KBio2_001217, AC1NXHQP, Spectrum_000737, SpecPlus_000117, Spectrum2_000188, Spectrum3_000212, Spectrum4_001614, Spectrum5_000367, BSPBio_001823, KBioGR_001987, KBioSS_001217, SPECTRUM201310, DivK1c_006213, SCHEMBL234355, SPBio_000115, CHEMBL1087126, KBio1_001157, KBio2_003785, KBio2_006353, KBio3_001323, SSRCYGATNWFTBJ-UHFFFAOYSA-N, CCG-38396, SDCCGMLS-0066420.P001, NCGC00095503-01, NCGC00095503-02, NCGC00178978-01, 3-(2,4-dimethoxyphenyl)-7-hydroxychromen-4-one, 3-(2,4-dimethoxy-phenyl)-7-hydroxy-chromen-4-one, BRD-K84390227-001-02-2, BRD-K84390227-001-03-0, 3-(2,4-Dimethoxyphenyl)-7-hydroxy-4H-1-benzopyran-4-one


ID: 2134

chemical graph of compound 2134



InChIKey: SSTXWOBEGIONBB-UHFFFAOYSA-N
SMILES: CC1=C2C(=C3C=CC(=CC3=N2)OC)CCN1.O.O.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6097179
synonyms found at PubChem are:
Harmaline hydrochloride dihydrate, 6027-98-1, UNII-5B4DGH2M9R, 5B4DGH2M9R, CCRIS 7891, 63885-08-5, HARMALINE, HYDROCHLORIDE, DIHYDRATE, 7-methoxy-1-methyl-3,4-dihydrobeta-carboline, chloride, hydrate, hydrate, Prestwick_251, 1-Methyl-7-methoxy-3,4-dihydro-beta-carboline hydrochloride, AC1O1IIS, CHEMBL1494278, HMS1569J22, MFCD00150052, AKOS027382834, API0008352, NCGC00017054-01, Harmaline hydrochloride dihydrate, >=95%, KB-77673, ST081355, CAS-6027-98-1, FT-0635945, ST50309261, 1-Methyl-7-methoxy-3,4-dihydro-|A-carboline hydrochloride, 7-methoxy-1-methyl-3,4-dihydro-2H-pyrido[3,4-b]indole dihydrate hydrochloride, 7-Methoxy-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole hydrochloride dihydrate


ID: 2135

chemical graph of compound 2135



InChIKey: STTADZBLEUMJRG-IKNOHUQMSA-N
SMILES: CN1CC[C@@]23CCCC[C@@H]2[C@@H]1CC4=C3C=C(C=C4)OC.O.Br

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5462351
synonyms found at PubChem are:
Dextromethorphan hydrobromide monohydrate, 6700-34-1, Dextromethorphan hydrobromide, Methorate, Drixoral Cough, PediaCare 1, Dextromethorphan hydrobromide hydrate, Benylin DM, Dextromethorphan (hydrobromide hydrate), Hold, St. Joseph Cough Syrup, Chloraseptic DM, UNII-9D2RTI9KYH, Romilar, Tylenol Cough Liquid, Endotussin-NN Pediatric, Robitussin Cough Calmers, 9D2RTI9KYH, Robitussin Pediatric Cough, Dextromethorphan hydrobromide OROS Tablets, Drixoral Cough & Sore Throat, Robitussin Maximum Strength Cough, d-3-Methoxy-N-methylmorphinan hydrobromide, Dextromethorphan Hydrobromide, Monohydrate, Dextromethorphan HBr, 3-Methoxy-17-methyl-9alpha,13alpha,14alpha-morphinan hydrobromide monohydrate, d-3-Methoxy-N-methylmorphinan hydrobromide monohydrate, (9S,13S,14S)-3-Methoxy-17-methylmorphinan hydrobromide, 125-71-3 (Parent), Morphinan, 3-methoxy-17-methyl-, (9alpha,13alpha,14alpha)-, hydrobromide, monohydrate, SMR000326694, Prestwick_686, Benylin DM (TN), Dextromethorphan hydrobromide [BAN:JAN], C18H25NO.HBr.H2O, (9?,13?,14?)-3-Methoxy-17-methylmorphinan hydrobromide monohydrate, NCGC00017066-01, CAS-6700-34-1, Dextromethorphan+quinidine, Dextromethorphan hydrobromide [USP:BAN:JAN], D0J8RR, C18H25NO.HCl, Dextromethorphan hydrobromicum, MLS000758303, MLS001056752, MLS001401442, MLS002153263, MLS002207070, SCHEMBL121923, CHEMBL1256818, S4617 Dextromethorphan hydrobrom, STTADZBLEUMJRG-IKNOHUQMSA-N, HMS1569G19, BCP06073, Dextromethorphan hydrobromide (USP), HY-B1333, CD0144, MFCD02173901, s4617, AKOS015915877, API0002199, CCG-100762, CS-4457, Dextromethorphan HydrobromideMonohydrate, NC00012, NCGC00017066-02, CPD000326694, SAM001247062, LS-176564, Dextromethorphan hydrobromide hydrate (JP17), FT-0636242, ST24046434, X3585, D00848, C-21122, I14-54102, (+)-3-Methoxy-N-methylmorphinan Hydrobromide Monohydrate, Dextromethorphan hydrobromide monohydrate, >=99% (TLC), Dextromethorphan hydrobromide, meets USP testing specifications, 3-Methoxy-17-methyl-9|A,13|A,14|A-morphinan Hydrobromide Hydrate, (9|A,13|A,14|A)-3-Methoxy-17-methylmorphinan Hydrobromide Hydrate, Dextromethorphan hydrobromide monohydrate, tested according to Ph.Eur., Dextromethorphan HBr, Pharmaceutical Secondary Standard; Certified Reference Material, Dextromethorphan Hydrobromide Monohydrate 1.0 mg/ml in Methanol (as anhydrous free base), Dextromethorphan hydrobromide, European Pharmacopoeia (EP) Reference Standard, Dextromethorphan hydrobromide, United States Pharmacopeia (USP) Reference Standard


ID: 2136

chemical graph of compound 2136



InChIKey: STVVMTBJNDTZBF-VIFPVBQESA-N
SMILES: C1=CC=C(C=C1)C[C@@H](CO)N

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 447213
synonyms found at PubChem are:
L-Phenylalaninol, 3182-95-4, (S)-2-amino-3-phenylpropan-1-ol, (S)-2-Amino-3-phenyl-1-propanol, (S)-(-)-2-Amino-3-phenyl-1-propanol, H-Phenylalaninol, (2S)-2-amino-3-phenylpropan-1-ol, Phenylalaninol, (-)-l-phenylalaninol, l-phenyl alaninol, h-phe-ol, (s)-phenylalaninol, (s)-(-)-phenylalaninol, CHEMBL1235287, STVVMTBJNDTZBF-VIFPVBQESA-N, MFCD00004732, (s)-(-)-2-amino-3-phenyl-propanol, L(-)-2-Amino-3-Phenyl-1-Propanol, l-(-)-phenylalaninol, HPH, D-2-PHENYLALANINOL, 2-Amino-3-phenyl-1-propanol #, l-benzylglycinol, L-Phenylalanoil, 1-phenylalaninol, l-2-phenylalaninol, (L)-phenylalaninol, (-)-phenylalaninol, zlchem 565, L(-)-Phenylalaninol, l-(s)-phenylalaninol, PubChem5724, Benzenepropanol, .beta.-amino-, (S)-, AC1L9KLG, Spectrum2_000830, Spectrum3_001978, PHENYLALANINOL GROUP, D03TUX, AC1Q4UB5, SCHEMBL81769, BSPBio_003578, KSC491Q3N, MLS002207066, SPECTRUM1505339, SPBio_000759, GTPL4752, Jsp005915, CTK3J1836, KBio3_002959, ZLC0430, MolPort-001-794-232, 2-(S)-amino-3-phenyl-1-propanol, ACT02363, BCP17030, CS-D1142, ZINC6731693, (1S)-1-Benzyl-2-hydroxyethylamine, ANW-27208, BDBM50367058, CCG-40282, FC1218, RW1866, (2S)-2-amino-3-phenyl-1-propanol, (S)-2-amino-3-phenyl-propan-1-ol, AKOS005259774, AC-5650, DB04484, RTC-062187, (S)(-)-2-amino-3-phenyl-1-propanol, KS-0000024M, (S)-1-hydroxymethyl-2-phenyl-ethylamine, D-(+)-2-Amino-3-phenyl-1-propanol?, NCGC00177983-01, AC-16295, AC-22383, AJ-56752, BP-20243, KB-15842, KB-79975, SC-03394, SMR001306708, TS-01999, (S)-(-)-2-arnino-3-phenyl-1-propanol, AB0066057, AB1000213, DB-016162, ST2408301, TC-062187, AM20040161, BB 0262987, FT-0082699, FT-0605249, P1028, 67P641, A-2109, P-3550, P-3551, J-520201, BRD-K44204252-001-02-2, BRD-K44204252-001-04-8, Z1741982891, (S)-(-)-2-Amino-3-phenyl-1-propanol, 98%, optical purity ee: 99% (HPLC)


ID: 2137

chemical graph of compound 2137



InChIKey: SUBDBMMJDZJVOS-UHFFFAOYSA-N
SMILES: CC1=CN=C(C(=C1OC)C)CS(=O)C2=NC3=C(N2)C=C(C=C3)OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 4594
synonyms found at PubChem are:
omeprazole, 73590-58-6, Losec, Prilosec, Antra, Esomeprazole, Omeprazon, Audazol, Omapren, Omepral, Parizac, Zegerid, Mopral, Miol, Belmazol, Ceprandal, Dizprazol, Dudencer, Emeproton, Epirazole, Gastrimut, Gastroloc, Gibancer, Indurgan, Inhibitron, Inhipump, Logastric, Pepticum, Peptilcer, Prazidec, Sanamidol, Secrepina, Ulcometion, Mepral, Miracid, Omeprol, Omezol, Omisec, Omizac, Ompanyt, Ozoken, Prysma, Ramezol, Ulceral, Ulcesep, Ulcozol, Zefxon, Zoltum, Desec, Elgam, Lomac, Ulsen, Ultop, Zimor, Ocid, Omed, Omid, OMEP, Demeprazol, Nopramin, Omeprazol, Omezolan, Paprazol, Pepticus, Prazentol, Prazolit, Procelac, Regulacid, Danlox, Erbolin, Lensor, Morecon, Nilsec, Olexin, Omegast, Omesek, Ortanol, Osiren, Proclor, Result, Ulcsep, Victrix, Zepral, Exter, Gasec, Ulzol, Omebeta 20, Tedec Ulceral, AULCER, Antra MUPS, Omeprazolum, Omez, Prilosec OTC, Omepradex, Omerprazole, Nexium IV, H 168/68, Omeprazol [INN-Spanish], Omeprazolum [INN-Latin], Esomperazole, Gastrogard, Nuclosina, Emilok, r-omeprazole, Omeprazole magnesium, ( -)-Omeprazole, Omeprazone, Omesec, Omeprazole delayed-release, Prilosec (TN), Prestwick_808, OMEPRAZOLE SODIUM, CCRIS 7099, OMZ, CHEBI:77260, HSDB 3575, Esomeprazole sodium salt, Omeprazole [USAN:INN:BAN:JAN], 5-Methoxy-2-(((4-methoxy-3,5-dimethyl-2-pyridyl)methyl)sulfinyl)benzimidazole, Nexium, H-168/68, CHEMBL1503, Nexiam, 1H-Benzimidazole, 5-methoxy-2-(((4-methoxy-3,5-dimethyl-2-pyridinyl)methyl)sulfinyl)-, 5-methoxy-2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methanesulfinyl]-1H-1,3-benzodiazole, 5-Methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]sulfinyl]-1H-benzimidazole, 5-methoxy-2-{[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl]sulfinyl}-1H-benzimidazole, MLS000069373, SAN-15, C17H19N3O3S, AGI-010, SUBDBMMJDZJVOS-UHFFFAOYSA-N, (+)-omeprazole, H 168-68, 2-(((3,5-Dimethyl-4-methoxy-2-pyridyl)methyl)sulfinyl)-5-methoxy-1H-benzimidazole, DM-3458, NCGC00016925-06, SMR000058847, CAS-73590-58-6, Esomeprazole Sodium, O0359, DSSTox_CID_1080, 5-Methoxy-2[(4-methoxy-3,5-dimethyl-2-pyridyl)methylsulfinyl]-1H-benzimidazole, 2-({[3,5-dimethyl-4-(methyloxy)pyridin-2-yl]methyl}sulfinyl)-5-(methyloxy)-1H-benzimidazole, 6-methoxy-2-(((4-methoxy-3,5-dimethylpyridin-2-yl)methyl)sulfinyl)-1H-benzo[d]imidazole, DSSTox_RID_75929, UNII-S51HU491WJ, DSSTox_GSID_21080, Omebeta, Olit, Omeprazen, 5-methoxy-2-((4-methoxy-3,5-dimethylpyridin-2-yl)methylsulfinyl)-1H-benzo[d]imidazole, 5-methoxy-2-[(4-methoxy-3,5-dimethyl-2-pyridyl)methylsulfinyl]-1H-benzimidazole, 6-methoxy-2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methylsulfinyl]-1H-benzimidazole, (R)-Esomeprazole, (+-)-Omeprazole, Omeprazole, (R)-, Omeprazole (JAN/USP/INN), SR-01000003003, R-Omeprazole [USP-RS], S51HU491WJ, Omperazole, 161796-78-7, Omeprazole, solid, 5-methoxy-2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methylsulfinyl]-1H-benzimidazole, 6-methoxy-2-[(4-methoxy-3,5-dimethyl-2-pyridyl)methylsulfinyl]-1H-benzimidazole, Omeprazole Pellets, Omeprazole,(S), Losec (TN), Losec, Omesec, Prilosec, Zegerid, Omeprazole, Omeprazole [USAN:USP:INN:BAN:JAN], (s)-omeprazole sodium, Omeprazole (Prilosec), ACMC-20p1du, AC1L1IIJ, Maybridge4_002645, Opera_ID_1863, Prestwick0_000493, Prestwick1_000493, Prestwick2_000493, Prestwick3_000493, (.+/-.)-Omeprazole, Omeprazole, 98% 1g, D01XNB, UPCMLD-DP075, cid_4594, SCHEMBL1191, omeprazole sodium bicarbonate, BSPBio_000385, MLS001076112, MLS001424148, MLS006010400, MLS006011759, BIDD:GT0189, SPBio_002306, BPBio1_000425, GTPL4279, Omeprazole (JP17/USP/INN), Esomeprazole sodium salt hydrate, DTXSID6021080, SCHEMBL11995456, UPCMLD-DP075:001, CHEBI:91766, CTK8I2124, CTK9A5793, MolPort-003-666-741, MolPort-003-849-702, HMS1528I05, HMS1569D07, HMS2052G17, HMS2090E16, HMS2090F11, HMS2096D07, HMS2232B21, HMS3269D17, HMS3394G17, HMS3651A11, HMS3713D07, Pharmakon1600-01505693, (S)-Omeprazole sodium salt hydrate, BCP05852, BCP13592, BCP21299, HY-B0113, KS-000001KH, 2,3,5-Trimethylpyridine/Omeprazole, Tox21_110686, Tox21_200509, AC-401, BBL028172, BDBM50103597, BDBM50241343, CO0037, DL-462, MFCD00083192, NSC751450, NSC759192, s1389, STK623746, 119141-88-7 (base), AKOS005066653, AKOS015895343, Tox21_110686_1, AC-4676, CCG-101130, CCG-213517, CS-1868, DB00338, HS-0055, LS-7629, MCULE-3224208952, NC00380, NE55490, NSC-751450, NSC-759192, 1H-Benzimidazole, 6-methoxy-2-((R)-((4-methoxy-3,5-dimethyl-2-pyridinyl)methyl)sulfinyl)-, IDI1_032523, NCGC00016925-01, NCGC00016925-02, NCGC00016925-03, NCGC00016925-04, NCGC00016925-05, NCGC00016925-07, NCGC00016925-08, NCGC00016925-10, NCGC00016925-11, NCGC00021522-03, NCGC00021522-04, NCGC00021522-05, NCGC00258063-01, Omeprazole, analytical reference material, AN-11759, AN-15878, BC203197, BC226373, CPD000058847, K253, KB-63582, SAM001246900, SC-15162, SBI-0206896.P001, AB0014122, AB1009257, TL8005099, FT-0601585, FT-0652860, FT-0653294, H 199, ST24048844, A19447, C07324, D00455, J10125, 668985-31-7 (Mg), 141O887, A837865, H168/68, I06-0705, SR-01000003003-4, SR-01000003003-7, SR-01000003003-8, 5-methoxy-2-((4-methoxy-3,5-dimethylpyridin-2-yl), BRD-A55962179-001-04-9, BRD-A55962179-001-08-0, BRD-A55962179-001-20-5, BRD-A88691025-001-07-4, I14-40975, F0001-2386, Z1672902589, Omeprazole, European Pharmacopoeia (EP) Reference Standard, Omeprazole, United States Pharmacopeia (USP) Reference Standard, 2-(3-methoxy-2,4-dimethylbenzylsulfinyl)-6-methoxy-1H-benzo[d]imidazole, 5-Methoxy-2-((S)-((4-methoxy-3,5-dimethyl-2- pyridinyl)methyl)sulfinyl)-, Omeprazole, Pharmaceutical Secondary Standard; Certified Reference Material, (+)-5-methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-sulfinyl]-1h-benzimidazole, (-)-5-methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-sulfinyl]-1h-benzimidazole, (RS)-5-Methoxy-2-(4-methoxy-3,5-dimethyl-2-pyridylmethylsulphinyl)benzimidazole, 5-methoxy 2-[[(4-methoxy-3,5-dimethyl-2-pyrdinyl)-methyl]sulfinyl]-1H-benzimidazole, 5-methoxy 2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)-methyl]sulfinyl]-1 H-benzimidazole, 5-methoxy 2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)-methyl]sulfinyl]-1H-benzimidazole, 5-methoxy-2-(((4-methoxy-3,5-dimethylpyridin-2-yl)methyl)sulfinyl)-1H-benzo[d]imidazole, 5-methoxy-2-(2-(4-methoxy-3,5-dimethylpyridin-2-yl)ethylsulfinyl)-1H-benzo[d]imidazole, 5-Methoxy-2-(4-methoxy-3,5-dimethyl-pyridin-2-ylmethanesulfinyl)-1H-benzoimidazole, 5-methoxy-2-[(4-methoxy-3,5-dimethyl-2-pyridyl)methyl]sulfinyl- 1H-benzimidazole, 5-methoxy-2-[(4-methoxy-3,5-dimethyl-pyridin-2-yl)methylsulfinyl]-3H-benzoimidazole, 5-methoxy-2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methanesulfinyl]-3H-1,3-benzodiazole, 5-Methoxy-2-[(RS)-[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl]sulfinyl]-1H-benzimidazole, 5-methoxy-2-[[(3,5-dimethyl-4-methoxy-2-pyridyl)methyl]sulfinyl]-1H-benzimidazole, 5-methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]sulphinyl]-1H-benzimidazole, 5-methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridyl)methyl]sulfinyl]-benzimidazole, 5-Methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridyl)methyl]sulfonyl]benzimidazole, 5-methoxy-2-[[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl]sulphinyl]1H-benzimidazole, 5-methoxy-2-{[(4-methoxy-3,5-dimethylpyridin-2-yl)methane]sulfinyl}-1H-1,3-benzodiazole, 6-methoxy-2-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methylsulfinyl]-1H-benzimidazole, 6-methoxy-2-[(4-methoxy-3,5-dimethyl-pyridin-2-yl)methylsulfinyl]-1H-benzimidazole, 6-methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)-methyl]sulfinyl]-1h-benzimidazole, 6-methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]sulfinyl]-1h-benzimidazole, 6-methoxy-2-[[(4-methoxy-3,5dimethyl-2-pyridinyl)-methyl]sulfinyl]-1h-benzimidazole, 6-methoxy-2-[[(4-methoxy3,5-dimethyl-2-pyridinyl)-methyl]sulfinyl]-1h-benzimidazole, 6-methoxy-2-[[(4methoxy-3,5-dimethyl2-pyridinyl)methyl]sulfinyl]-1h-benzimidazole, 6-methoxy-2-{[(4-methoxy-3,5-dimethylpyridin-2-yl)methane]sulfinyl}-1H-1,3-benzodiazole, Omeprazole for peak identification, European Pharmacopoeia (EP) Reference Standard, Omeprazole solution, 1.0 mg/mL in methanol, ampule of 1 mL, certified reference material, (omeprazole)5-Methoxy-2-(4-methoxy-3,5-dimethyl-pyridin-2-ylmethanesulfinyl)-1H-benzoimidazole, (RS)-6-methoxy-2-((4-methoxy-3,5-dimethylpyridin-2-yl) methylsulfinyl)-1H-benzo[d]imidazole, 131959-78-9, 172964-80-6, 177541-02-5, 5-Methoxy-2-(4-methoxy-3,5-dimethyl-pyridin-2-ylmethanesulfinyl)-1H-benzoimidazole (omeprazole), 5-Methoxy-2-(4-methoxy-3,5-dimethyl-pyridin-2-ylmethanesulfinyl)-1H-benzoimidazole(Omeprazole), 5-Methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]sulfinyl]-1H-benzimidazole; Antra; Losec, 6-Methoxy-2-[(S)-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]sulfinyl]-1H-benzimidazole sodium salt


ID: 2138

chemical graph of compound 2138



InChIKey: SUGXUUGGLDCZKB-UHFFFAOYSA-N
SMILES: C1=CC=C2C(=C1)C(=C(OC2=O)Cl)Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 1609
synonyms found at PubChem are:
3,4-dichloroisocoumarin, 51050-59-0, 3,4-Dcl, 1H-2-Benzopyran-1-one,3,4-dichloro-, 3,4-DCI, 3,4 dichloroisocoumarin, 3,4-Dichloro-1H-isochromen-1-one, 3,4-Dichloro-1H-2-benzopyran-1-one, 1H-2-Benzopyran-1-one, 3,4-dichloro-, CHEMBL24983, 3,4-dichloroisochromen-1-one, 3,4-Dichloro-2-benzopyran-1-one, C9H4Cl2O2, Lopac-D-7910, D0F3CA, AC1L1BU9, AC1Q3H9V, cid_1609, Lopac0_000442, BSPBio_001549, KBioGR_000269, KBioSS_000269, MLS002153325, SCHEMBL106901, 3,4-Dichloro-isochromen-1-one, CTK4J3543, KBio2_000269, KBio2_002837, KBio2_005405, KBio3_000537, KBio3_000538, DTXSID70199056, CHEBI:109540, MolPort-003-930-823, SUGXUUGGLDCZKB-UHFFFAOYSA-N, Bio2_000269, Bio2_000749, HMS1361N11, HMS1791N11, HMS1989N11, HMS3261I06, HMS3402N11, ZINC388510, Tox21_500442, BDBM50199883, HSCI1_000089, MFCD00036960, NSC727363, PI-110, 3,4-Dichloro-1H-isochromen-1-one #, CCG-204534, DB04459, LP00442, NSC-727363, IDI1_034019, KS-000019D7, QTL1_000002, NCGC00015369-01, NCGC00015369-02, NCGC00015369-03, NCGC00015369-04, NCGC00015369-05, NCGC00015369-06, NCGC00093859-01, NCGC00093859-02, NCGC00093859-03, NCGC00261127-01, AN-41326, KB-70099, SMR001230738, LS-175220, EU-0100442, D 7910, 3,4-Dichloroisocoumarin serine protease inhibitor, 050D590, 3,4-Dichloroisocoumarin, serine protease inhibitor, SR-01000075831, SR-01000075831-1, BRD-K23704908-001-02-4, BRD-K23704908-001-03-2


ID: 2139

chemical graph of compound 2139



InChIKey: SULYEHHGGXARJS-UHFFFAOYSA-N
SMILES: CC(=O)C1=C(C=C(C=C1)O)O

biological descriptors:

CFTR relevance: inactive

Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown

reference list:

"MH Nantz" "LJ Galietta" "K By" "EJ Niedzinski" "M Eda" "MF Springsteel" "MJ Haddadin" "MJ Kurth" "AS Verkman"


CID is 6990
synonyms found at PubChem are:
89-84-9, 2',4'-DIHYDROXYACETOPHENONE, 2,4-Dihydroxyacetophenone, 1-(2,4-Dihydroxyphenyl)ethanone, Resacetophenone, 4-Acetylresorcinol, Resoacetophenone, Ethanone, 1-(2,4-dihydroxyphenyl)-, 1-Acetyl-2,4-dihydroxybenzene, Resorcinol, 4-acetyl-, 1-(2,4-dihydroxyphenyl)ethan-1-one, Acetophenone, 2',4'-dihydroxy-, UNII-UC3V356VZC, NSC 10883, .beta.-Resacetophenone, 1-(2,4-dihydroxy-phenyl)-ethanone, EINECS 201-945-3, 4-Acetyl-1,3-benzenediol, 2,4-Dihydroxy Acetophenone, BRN 1282505, UC3V356VZC, 2',4'-Dihydroxy-acetophenone, AI3-00866, CHEMBL243374, CHEBI:18414, SULYEHHGGXARJS-UHFFFAOYSA-N, WLN: QR CQ DV1, 2',4'-Dihydroxyacetophenon, dihydroxyacetophenon, beta-Resacetophenone, 4-Acetyl-Resorcinol, PubChem3375, 2,4-dihyroxyacetophenone, AC1Q1JHT, 2,4-dihydroxy actophenone, 2'4'-dihydroxyacetophenone, 2,4,-dihydroxyacetophenone, 1-Acetylbenzene-2,4-diol, AC1L1NR7, AC1Q5ED3, SCHEMBL26357, 4-08-00-01792 (Beilstein Handbook Reference), KSC448A9T, BIDD:ER0659, ACMC-209r36, 1,3-Dihydroxy-4-acetylbenzene, 2'',4''-dihydroxyacetophenone, 2\',4\'-dihydroxyacetophenone, DTXSID4058998, CTK3E8099, TIMTEC-BB SBB040836, ZINC38028, MolPort-000-482-777, 2,4-DIHYDROOXYACETOPHENONE, AKOS 90593, 1-(2,4-Dihydroxyphenyl)-ethanone, NSC10883, NSC37559, STR03384, AKOS BBS-00004294, UKRORGSYN-BB BBR-007146, 2',4'-Dihydroxyacetophenone, 99%, ANW-39376, BBL012128, BDBM50241221, MFCD00002279, NSC-10883, NSC-37559, SBB040836, STK084318, AKOS000119522, AC-1105, AS01140, CS-W008599, FS-3456, MCULE-8687773185, RL05645, RTC-067541, TRA0025245, 1-(2,4-Dihydroxyphenyl)ethanone, 9CI, KS-00000C03, 4CN-0699, AJ-08777, AN-15263, BC676988, CJ-00226, KB-17586, LS-13469, SC-07232, ST053782, ZB001051, AB0000224, AB1002103, ST2414924, TC-067541, TL8005791, AM20041337, D0561, FT-0610122, C03663, S-1332, I01-2131, W-100356, Z57101026, F1995-0239, 1-Acetyl-2,4-dihydroxybenzene; 4-Acetylresorcinol; Resacetophenone, InChI=1/C8H8O3/c1-5(9)7-3-2-6(10)4-8(7)11/h2-4,10-11H,1H


ID: 2140

chemical graph of compound 2140



InChIKey: SUNSHHXMTAVPFW-UHFFFAOYSA-N
SMILES: C1=CC=C2C(=C1)C(=CC3=CC=CC=[N+]32)O.[Br-]

biological descriptors:

CFTR relevance: inactive

Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown

reference list:

"MH Nantz" "LJ Galietta" "K By" "EJ Niedzinski" "M Eda" "MF Springsteel" "MJ Haddadin" "MJ Kurth" "AS Verkman"


CID is 10423554
synonyms found at PubChem are:
CHEMBL368363


ID: 2141

chemical graph of compound 2141



InChIKey: SUPBGWCBZUZDOP-KAYWLYCHSA-N
SMILES: COC1=CC(=C2C[C@H]([C@H](OC2=C1)C3=CC(=C(C(=C3)OC)OC)OC)OC(=O)C4=CC(=C(C(=C4)OC)OC)OC)OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6708757
synonyms found at PubChem are:
CHEMBL1631996, KBio2_000776, Spectrum_000296, SpecPlus_000732, Spectrum4_001170, Spectrum5_001775, AC1O8FN5, KBioGR_001779, KBioSS_000776, DivK1c_006828, KBio1_001772, KBio2_003344, KBio2_005912, BDBM50091083, EPIGALLOCATECHIN OCTAMETHYL ETHER, [(2R,3R)-5,7-dimethoxy-2-(3,4,5-trimethoxyphenyl)-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trimethoxybenzoate, 3,4,5-Trimethoxybenzoic acid (2R)-2alpha-(3,4,5-trimethoxyphenyl)-5,7-dimethoxychroman-3alpha-yl ester


ID: 2142

chemical graph of compound 2142



InChIKey: SUQFMFHTLHMZNM-SLBLICBISA-N
SMILES: CC(=O)O[C@H]1C[C@H](C(C2[C@]1(C3CC[C@]4([C@@H](OC(=O)C=C4[C@@]3([C@@H](C2)OC(=O)C)C)C5=COC=C5)C)C)(C)C)OC(=O)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6708722
synonyms found at PubChem are:
KBio2_006264, DEOXYKHIVORIN, Spectrum_000648, SpecPlus_000625, AC1O8FLK, Spectrum2_000251, Spectrum3_000041, Spectrum4_001323, Spectrum5_000165, BSPBio_001761, KBioGR_001785, KBioSS_001128, SPECTRUM100139, DivK1c_006721, SPBio_000062, SCHEMBL14196996, KBio1_001665, KBio2_001128, KBio2_003696, KBio3_000921, CCG-39812, SDCCGMLS-0066330.P001, NCGC00179028-01, SR-05000002755, SR-05000002755-1, BRD-A39660642-001-02-3, BRD-A39660642-001-03-1, [(1R,4bR,5R,8R,10S,10aS,12aR)-8,10-diacetyloxy-1-(furan-3-yl)-4b,7,7,10a,12a-pentamethyl-3-oxo-1,5,6,6a,8,9,10,10b,11,12-decahydronaphtho[2,1-f]isochromen-5-yl] acetate


ID: 2143

chemical graph of compound 2143



InChIKey: SUWREQRNTXCCBL-UHFFFAOYSA-N
SMILES: C1CNCC=C1C(=O)O.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 155107
synonyms found at PubChem are:
ISOGUVACINE HYDROCHLORIDE, 68547-97-7, 1,2,3,6-Tetrahydro-4-pyridinecarboxylic acid hydrochloride, 1,2,3,6-tetrahydropyridine-4-carboxylic acid hydrochloride, 4-Pyridinecarboxylic acid, 1,2,3,6-tetrahydro-, hydrochloride, Isoguvacine (hydrochloride), 1,2,3,6-Tetrahydro-pyridine-4-carboxylic acid hydrochloride, 1,2,5,6,-Tetrahydroisonicotinic acid Hydrochloride, 1,2,3,6-TETRAHYDRO-4-PYRIDINECARBOXYLIC ACID HCL, SR-01000075611, Isoguvacine HCl, AC1L4DMR, MLS000859962, SPECTRUM1502129, CHEMBL540303, SCHEMBL7958625, Isoguvacine hydrochloride, solid, 1,2,3,6-tetrahydro-4-pyridinecarboxylicacidhydrochloride, KS-00000AIF, DTXSID00218663, MolPort-003-983-601, SUWREQRNTXCCBL-UHFFFAOYSA-N, 64603-90-3 (Parent), Tox21_500561, BN0277, MFCD00055192, AKOS015847455, AKOS025243370, CCG-221865, CS-6967, LP00561, TRA0081918, NCGC00093946-01, NCGC00093946-02, NCGC00093946-03, NCGC00261246-01, AK154352, AS-31641, SC-49604, SC-49605, SMR000326821, SY012592, AX8223448, HY-100810, TR-022104, B6230, EU-0100561, FT-0670465, G-002, I0871, Z-2044, 1,2,5,6-tetrahydroisonicotinic acid hydrochloride, I02-4338, SR-01000075611-1, SR-01000075611-3, 1,2,3,6-Tetrahydro-pyridine-4-carboxylic acid hydr, 1,2,3,6-Tetrahydro-pyridine-4-carboxylic acidhydrochloride, SCHEMBL15260680


ID: 2144

chemical graph of compound 2144



InChIKey: SUYVUBYJARFZHO-UHFFFAOYSA-N
SMILES: C1C(C(OC1N2C=NC3=C2N=CN=C3N)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O

biological descriptors:

CFTR relevance: CFTR activator

Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown

reference list:

"M Li" "H Miki" "SG Bompadre" "Z Zhou" "TC Hwang"


CID is 622
synonyms found at PubChem are:
2'-Deoxyadenosine 5'-triphosphate disodium salt(dATP), SCHEMBL889289, AC1L19N7, AC1Q6S41, SGCUT00221, CTK8H4367, to_000043, VZ21750, 9-[2-deoxy-5-o-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)pentofuranosyl]-9h-purin-6-amine, L000216, [[5-(6-aminopurin-9-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate


ID: 2145

chemical graph of compound 2145



InChIKey: SVJKYIUJRJEABK-UHFFFAOYSA-L
SMILES: C1=CC2=C3C(=CC(=C2C(=C1)S(=O)(=O)N)[N+](=O)[O-])N=C(C(=N3)[O-])[O-].[Na+].[Na+]

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3272523
synonyms found at PubChem are:
6-Nitro-7-sulfamoylbenzo[f]quinoxaline-2,3-dione, Disodium Salt, 479347-86-9, CTK8E6584, RT-010697, FT-0673006, NBQX disodium salt, NBQX disodium, 1,2,3,4-Tetrahydro-6-nitro-2,3-dioxo-benzo[f]quinoxaline-7-sulfonamide disodium salt, 2,3-DIOXO-6-NITRO-1,2,3,4-TETRAHYDROBENZO[F]QUINOXALINE-7-SULFONAMIDE DISODIUM SALT, disodium 6-nitro-7-sulfamoylbenzo[f]quinoxaline-2,3-diolate, FG9202 disodium, NBQX, Disodium Salt, NCGC00016174-01, Lopac-N-183, AC1O1JFX, AC1MN6K0, CHEMBL1257130, CTK8G1696, MolPort-003-849-601, HMS3262H06, HMS3267C04, Tox21_500912, BN0608, AKOS024418743, CCG-222216, LP00912, MB01142, NCGC00016174-02, NCGC00094223-01, NCGC00261597-01, B6566, EU-0100912, N-183, 2,3-DIHYDROXY-6-NITRO-7-SULPHAMOYLBENZO(F)-QUINOXALINE 2NA, 6-NITRO-7-SULPHAMOYLBENZO(F)-QUINOXALINE-2,3-DIONE 2NA, SODIUM 6-NITRO-7-SULFAMOYLBENZO[F]QUINOXALINE-2,3-BIS(OLATE), 11876-58-7


ID: 2146

chemical graph of compound 2146



InChIKey: SVURIXNDRWRAFU-OGMFBOKVSA-N
SMILES: C[C@@H]1CC[C@@H]2[C@]13CC[C@@]([C@H](C3)C2(C)C)(C)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 65575
synonyms found at PubChem are:
Cedrol, (+)-Cedrol, 77-53-2, alpha-Cedrol, 8betaH-Cedran-8-ol, a-Cedrol, Cedrol (natural), Cedarwood oil alcohols, (8R)-cedran-8-ol, cedar camphor, UNII-63ZM9703BO, Cedrol (6CI,7CI), EINECS 201-035-6, NSC 403883, AI3-02178, CHEMBL1974890, CHEBI:10217, 63ZM9703BO, NSC403883, [3R-(3alpha,3abeta,6alpha,7beta,8aalpha)]-octahydro-3,6,8,8-tetramethyl-1H-3a,7-methanoazulen-6-ol, 1H-3a,7-Methanoazulen-6-ol, octahydro-3,6,8,8-tetramethyl-, (3R,3aS,6R,7R,8aS)-, .alpha.-Cedrol, (1S,2R,5S,7R,8R)-2,6,6,8-Tetramethyltricyclo[5.3.1.01.5]undecan-8-ol, (3R-(3alpha,3Abeta,6alpha,7beta,8aalpha))-octahydro-3,6,8,8-tetramethyl-1H-3a,7-methanoazulen-6-ol, 8.beta.H-Cedran-8-ol, Cedrol Crystals, 1H-3a, octahydro-3,6,8,8-tetramethyl-, [3R-(3.alpha.,3a.beta.,6.alpha.,7.beta.,8a.alpha.)]-, Cedrol, redistilled, (+)-Cedryl alcohol, 8-betaH-Cedran-8-ol, AC1Q29DU, DSSTox_CID_21269, DSSTox_RID_79672, DSSTox_GSID_41269, SCHEMBL107488, (7beta,8alpha)-cedran-8-ol, 8betaH-Cedran-8-ol (8CI), AC1L23J2, 8-betaH-Cedran-8-ol (8CI), DTXSID1041269, CTK8F1448, HSDB 8265, (+)-Cedrol, analytical standard, MolPort-003-910-655, SVURIXNDRWRAFU-OGMFBOKVSA-N, NSC46153, ZINC3978626, Tox21_202945, BDBM50430739, MFCD00062952, NSC-46153, AKOS024319138, LMPR0103690007, NSC-403883, CAS-77-53-2, NCGC00260491-01, AN-23913, AS-13700, CC-00086, LS-90492, NCI60_003818, ST2414060, FT-0623526, C09631, J10131, Y-9227, 062C952, C-12442, (+)-Cedrol, >=99.0% (sum of enantiomers, GC), [3R-(3alpha,3abeta,6alpha,7beta,8aalpha)]-Octa-hydro-3,6,8,8-tetramethyl-1H-3a,7-methanoazulen-6-ol, 13567-37-8


ID: 2147

chemical graph of compound 2147



InChIKey: SVUVYHFYZBCYRF-UHFFFAOYSA-N
SMILES: CC(=O)C1=C(C=C2C(=C1)C=CC(O2)(C)C)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 100768
synonyms found at PubChem are:
Eupatoriochromene, 19013-03-7, DEMETHYLENCECALIN, Desmethylencecalin, 7-demethylencecalin, 1-(7-hydroxy-2,2-dimethyl-2H-chromen-6-yl)ethanone, Ethanone, 1-(7-hydroxy-2,2-dimethyl-2H-1-benzopyran-6-yl)-, UNII-O9Y1UY34HC, O9Y1UY34HC, CHEBI:4936, NSC 363789, Spectrum_000670, SpecPlus_000198, AC1L2PFX, Spectrum2_000671, Spectrum3_001246, Spectrum4_001452, Spectrum5_000063, C09006, AC1Q5G9Q, BSPBio_002752, KBioGR_001963, KBioSS_001150, SPECTRUM300061, CHROMENE DERIV (HERZ), DivK1c_006294, SPBio_000761, CHEMBL443462, MEGxp0_001834, KBio1_001238, KBio2_001150, KBio2_003718, KBio2_006286, KBio3_002252, DTXSID70172485, MolPort-001-742-563, SVUVYHFYZBCYRF-UHFFFAOYSA-N, HMS1923G11, ZINC897926, CCG-38569, NSC363789, AKOS022652862, CS-W000239, MCULE-8240932553, NSC-363789, SDCCGMLS-0066474.P001, NCGC00095249-01, NCGC00095249-02, NCGC00095249-03, NCGC00095249-04, 4CN-1407, W1947, W1963, 1-(7-hydroxy-2,2-dimethylchromen-6-yl)ethanone, 1-(7-hydroxy-2,2-dimethyl-chromen-6-yl)ethanone, 6-Acetyl-7-hydroxy-2,2-dimethyl-2H-1-benzopyran, BRD-K55704455-001-02-2, 1-(7-hydroxy-2,2-dimethyl-2H-chromen-6-yl)-ethanone, 1-(7-Hydroxy-2,2-dimethyl-2H-1-benzopyran-6-yl)-ethanone, Ethanone,1-(7-hydroxy-2,2-dimethyl-2H-1- benzopyran-6-yl)-, InChI=1/C13H14O3/c1-8(14)10-6-9-4-5-13(2,3)16-12(9)7-11(10)15/h4-7,15H,1-3H


ID: 2148

chemical graph of compound 2148



InChIKey: SWELIMKTDYHAOY-UHFFFAOYSA-N
SMILES: C1=C(NC(=NC1=O)N)N

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 2944
synonyms found at PubChem are:
2,4-Diamino-6-hydroxypyrimidine, 56-06-4, 2,6-diaminopyrimidin-4-ol, 2,6-Diaminopyrimidin-4(1H)-one, 2,6-Diamino-4-hydroxypyrimidine, 100643-27-4, 2,6-Diamino-4-pyrimidinol, 4(1H)-Pyrimidinone, 2,6-diamino-, 2,6-Diamino-4-pyrimidinone, 2,6-diaminopyrimidin-4(3H)-one, 2,6-Diamino-1H-pyrimidin-4-one, 2,4-Diaminohypoxanthine, 2,6-Diamino-4(1H)-pyrimidinone, 2,6-diamino-3,4-dihydropyrimidin-4-one, 2,6-Diaminopyrimidin-4-one, 4(3H)-pyrimidinone, 2,6-diamino-, 2,4-DAHP, UNII-EDH7CNS75I, 2,6-Diamino-3H-pyrimidin-4-one, 2,6-Diamino-4(3H)-pyrimidinone, NSC 9302, 6-Aminoisocytosine, NSC 44914, 2,4-Diamino-6-pyrimidinone, NSC 680818, 143504-99-8, EINECS 200-254-4, EDH7CNS75I, 2,4-Diaminopyrimidin-6-ol, AI3-52085, NSC9302, 2,4-Diamino-6-hydroxypyrimidiine, SWELIMKTDYHAOY-UHFFFAOYSA-N, NSC680818, NCGC00024607-01, 2,6-diamino-1,4-dihydropyrimidin-4-one, DSSTox_CID_28964, DSSTox_RID_83229, DSSTox_GSID_49038, 4(1H)-Pyrimidinone,6-diamino-, CAS-56-06-4, 2-Aminoisocytosine, SMR001230698, SR-01000076242, DHAP-2,4, PubChem7054, Tocris-0476, AC1L1ETQ, Lopac-D1920-6, AC1Q51QT, 2,4-Diamino-6-pyrimidinol, Lopac0_000419, SCHEMBL94169, 2,6-diamino-4-oxopyrimidine, 2,6-diamino-pyrimidin-4-ol, KSC495S0J, MLS002153230, MLS004491797, ACMC-20976c, 2,6-diamino-4-oxo-pyrimidine, 4-Pyrimidinol, 2,6-diamino-, AC1Q51K9, CHEMBL1255934, DTXSID4049038, SCHEMBL12284066, 2,6-diaminohydropyrimidin-4-one, CTK3J5904, CTK7D5149, CTK7E0733, KS-00000JRQ, 6-Hydroxy-2,4-pyrimidinediamine, 58470-85-2 (sulfate), MolPort-000-875-437, MolPort-001-765-139, 2,4-diamino-6-hydroxy-pyrimidine, HMS2234I21, HMS3261C20, HMS3370M17, AC1Q6931, ALBB-027441, BCP07305, NSC-9302, NSC44914, ZINC8602956, 4-Pyrimidinol,2,6-diamino-(9CI), Tox21_113576, Tox21_500419, ANW-13570, BBL003829, BBL007935, MFCD00006098, NSC-44914, SBB004252, STK387479, STK508805, 2,4-?Diamino-?6-?hydroxypyrimidine, AKOS000120881, AKOS002676346, AKOS016000171, Tox21_113576_1, 2,6-bis(azanyl)-1H-pyrimidin-4-one, 4-Pyrimidinol, 2,6-diamino- (9CI), CCG-204511, EBD1821296, LP00419, MCULE-5011664599, NSC-680818, PS-4212, PS-4458, RTR-037093, TRA0051858, DAHP; 2,4-Diamino-6-hydroxypyrimidine, KS-00002A75, 2,4-Diamino-6-hydroxypyrimidine, 96%, NCGC00015387-01, NCGC00015387-02, NCGC00015387-03, NCGC00015387-04, NCGC00015387-05, NCGC00015387-06, NCGC00024607-02, NCGC00024607-03, NCGC00247666-01, NCGC00261104-01, 2,4-DIAMINO-6(1H)-PYRIMIDINONE, AC-23587, AJ-57700, AJ-57701, AN-24432, BC224587, BP-13216, BR-26131, CJ-13271, HC210088, KB-62342, SC-46582, SC-48881, SC-48904, ST069382, AB0010985, AB0219348, LS-175686, TR-037093, 4(3H)-Pyrimidinone, 2,6-diamino- (9CI), AM20100370, B6314, EU-0100419, FT-0609969, R1730, ST24038789, T7987, KS-00000960, M-7393, 043D013, 4(1H)-Pyrimidinone, 2,6-diamino- (8CI,9CI), A830906, AB-323/25048074, D1920-6, I03-0242, Q-200181, SR-01000076242-1, SR-01000076242-3, I14-13895, F1918-0034, InChI=1/C4H6N4O/c5-2-1-3(9)8-4(6)7-2/h1H,(H5,5,6,7,8,9, 40306-60-3, 41982-31-4, 863767-89-9


ID: 2149

chemical graph of compound 2149



InChIKey: SWIJYDAEGSIQPZ-UHFFFAOYSA-N
SMILES: CCN(CC)CC#CCOC(=O)C(C1CCCCC1)(C2=CC=CC=C2)O.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 91505
synonyms found at PubChem are:
Oxybutynin chloride, Oxybutynin hydrochloride, 1508-65-2, Oxybutynin HCl, Dridase, Tropax, Ditropan Xl, Oxybutynin (chloride), Oxibutinina hydrochloride, EINECS 216-139-7, alpha-Phenylcyclohexaneglycolic acid 4-(diethylamino)-2-butynyl ester hydrochloride, MJ 4309-1, MLS000069688, 4-(Diethylamino)but-2-ynyl cyclohexylphenylglycolate hydrochloride, SMR000058490, (R)-Oxybutynin Chloride, 4-Diethylamino-2-butynyl phenyl(cyclohexyl)glycolate hydrochloride, 4-(Diethylamino)-2-butynyl alpha-phenylcyclohexaneglycolate hydrochloride, C22H32ClNO3, Gelnique, 4-(Diethylamino)-2-butynyl (+-)-alpha-phenylcyclohexaneglycolate hydrochloride, CHEBI:7857, 4-(diethylamino)but-2-ynyl 2-cyclohexyl-2-hydroxy-2-phenylacetate hydrochloride, Cyclohexaneglycolic acid, alpha-phenyl-, 4-(diethylamino)-2-butynyl ester, hydrochloride, Benzeneacetic acid, alpha-cyclohexyl-alpha-hydroxy-, 4-(diethylamino)-2-butynyl ester hydrochloride, Benzeneacetic acid, alpha-cyclohexyl-alpha-hydroxy-, 4-(diethylamino)-2-butynyl ester hydrochloride, (+-)-, SR-01000000184, Oxybutynin chloride [USAN], Oxybutynin chloride [USAN:USP], 4-(diethylamino)but-2-ynyl 2-cyclohexyl-2-hydroxy-2-phenylacetate;hydrochloride, Ditropan (TN), Gelnique (TN), Prestwick_621, Opera_ID_1330, NCGC00016583-01, D05KZK, D0R1DH, Oxybutynin chloride (USP), CAS-1508-65-2, AC1L3M7P, CHEMBL1133, DSSTox_CID_25356, DSSTox_RID_80822, C22H31NO3.HCl, DSSTox_GSID_45356, SCHEMBL25751, MLS001148211, MLS002222232, REGID_for_CID_91505, Oxybutynin hydrochloride (JAN), SMT-D002, Jsp002882, DTXSID3045356, CTK8G2229, HY-B0267A, KS-00000ZDA, 5633-20-5 (Parent), HOB-294, (S)-4-(diethylamino)but-2-ynyl 2-cyclohexyl-2-hydroxy-2-phenylacetate hydrochloride, MolPort-003-666-668, SWIJYDAEGSIQPZ-UHFFFAOYSA-N, HMS1568J16, Pharmakon1600-01505399, (R,S) - Oxybutynin Hydrochloride, BCP12138, Tox21_110507, Tox21_500923, BG0595, MFCD00072150, NSC759108, s3117, AKOS015895349, API0003718, CCG-213420, CS-2256, H33O205, KS-1377, LP00923, MCULE-5193326065, NC00580, NSC-759108, VA11467, NCGC00094234-01, NCGC00094234-02, NCGC00261608-01, AN-49346, CPD000058490, DL-06003, H815, LS-56862, SAM002564226, SC-18892, MJ-4309-1, EU-0100923, FT-0082889, FT-0603563, Oxybutynin chloride, >=98% (TLC), powder, ST24048864, ST51015085, D00722, J10411, O 2881, A809082, C-21602, I06-0708, J-008750, SR-01000000184-2, SR-01000000184-7, Oxybutynin chloride, meets EP, USP testing specifications, Oxybutynin hydrochloride (transdermal patch, overactive bladder), 4-(diethylamino)but-2-ynyl 2-cyclohexyl-2-hydroxy-2-phenylacetate, chloride, Oxybutynin chloride, United States Pharmacopeia (USP) Reference Standard, Oxybutynin hydrochloride (transdermal patch, overactive bladder), Hisamitsu, Oxybutynin hydrochloride, European Pharmacopoeia (EP) Reference Standard, (R)-|A-Phenylcyclohexaneglycolic Acid 4-(Diethylamino)-2-butynyl Ester, Hydrochloride, (S)-|A-Phenylcyclohexaneglycolic Acid 4-(Diethylamino)-2-butynyl Ester, Hydrochloride, 2-cyclohexyl-2-hydroxy-2-phenylacetic acid 4-(diethylamino)but-2-ynyl ester hydrochloride, 4-(diethylamino)but-2-yn-1-yl 2-cyclohexyl-2-hydroxy-2-phenylacetate hydrochloride, 4-(diethylamino)but-2-ynyl 2-cyclohexyl-2-hydroxy-2-phenyl-acetate hydrochloride, 4-(diethylamino)but-2-ynyl 2-cyclohexyl-2-oxidanyl-2-phenyl-ethanoate hydrochloride, AC1LCW7R, AKOS026750014, 4-(diethylamino)but-2-yn-1-yl cyclohexyl(hydroxy)phenylacetate hydrochloride, 4-(diethylamino)but-2-ynyl 2-cyclohexyl-2-hydroxy-2-phenylacetate; hydron; chloride


ID: 2150

chemical graph of compound 2150



InChIKey: SWJLTKXURNHVHE-UPWXJBBJSA-N
SMILES: CC[C@H](C)/C=C(\C)/C=C/C1=CC2=C(C(=O)[C@](C(=O)C2=CO1)(C)OC(=O)C)Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6436015
synonyms found at PubChem are:
Sclerotiorin, UNII-BA54VZ8Z50, BA54VZ8Z50, 549-23-5, AC1O5KXO, MLS000563069, CHEMBL1095515, SCHEMBL17241989, MolPort-008-268-243, SWJLTKXURNHVHE-UPWXJBBJSA-N, HMS2267F03, ZINC5247757, AKOS030213219, (R-(R*,S*-(E,E)))-7-(Acetyloxy)-5-chloro-3-(3,5-dimethyl-1,3-heptadienyl)-7-methyl-6H-2-benzopyrane-6,8(7H)-dione, SMR001215839, [(7R)-5-chloro-3-[(1E,3E,5S)-3,5-dimethylhepta-1,3-dienyl]-7-methyl-6,8-dioxo-isochromen-7-yl] acetate, [(7R)-5-chloro-3-[(1E,3E,5S)-3,5-dimethylhepta-1,3-dienyl]-7-methyl-6,8-dioxoisochromen-7-yl] acetate, 6H-2-Benzopyran-6,8(7H)-dione, 7-(acetyloxy)-5-chloro-3-[(1E,3E,5S)-3,5-dimethyl-1,3-heptadienyl]-7-methyl-, (7R), 6H-2-Benzopyrane-6,8(7H)-dione, 7-(acetyloxy)-5-chloro-3-(3,5-dimethyl-1,3-heptadienyl)-7-methyl-, (R-(R*,S*-(E,E)))-, 7-(Acetyloxy)-5-chloro-3-[(1E,3E,5S)-3,5-dimethyl-1,3-heptadien-1-yl]-7-methyl-6H-2-benzopyran-6,8(7H)-dione


ID: 2151

chemical graph of compound 2151



InChIKey: SWKDMSRRIBZZAY-UHFFFAOYSA-N
SMILES: C1CN=C(N1)CN(CC2=CC=CC=C2)C3=CC=CC=C3.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 17275
synonyms found at PubChem are:
Antazoline hydrochloride, 2508-72-7, Antazoline HCl, Fenazolina, Histazine, Antazoline (hydrochloride), 2-(N-Benzylanilinomethyl)-2-imidazoline hydrochloride, Antazolinium chloratum, Antistine hydrochloride, Phenazoline hydrochloride, UNII-FP8Q8F72JH, EINECS 219-719-8, FP8Q8F72JH, MLS000028599, 2-Phenylbenzylaminomethylimidazoline hydrochloride, 2-(N-Phenyl-N-benzylaminomethyl)imidazoline hydrochloride, SMR000058731, 2-Imidazoline, 2-((N-benzylanilino)methyl)-, monohydrochloride, DSSTox_CID_27762, DSSTox_RID_82539, DSSTox_GSID_47782, 2-(N-Benzylanilino)methyl-2-imidazoline, hydrochloride, 2-IMIDAZOLINE, 2-((N-BENZYLANILINO)METHYL)-, HYDROCHLORIDE, 91-75-8 (Parent), N-benzyl-N-(4,5-dihydro-1H-imidazol-2-ylmethyl)aniline hydrochloride, N-Benzyl-N-((4,5-dihydro-1H-imidazol-2-yl)methyl)aniline hydrochloride, 4,5-Dihydro-N-phenyl-N-(phenylmethyl)-1H-imidazole-2-methanamine hydrochloride, SR-01000000255, NCGC00016613-01, (2-imidazolin-2-ylmethyl)phenylbenzylamine, chloride, CAS-2508-72-7, Antazoline hydrochloride [USP], N-benzyl-N-[(4,5-dihydro-1H-imidazol-2-yl)methyl]aniline hydrochloride, Prestwick_82, Phenazolinum (TN), Antazolinehydrochloride, N-benzyl-N-(4,5-dihydro-1H-imidazol-2-ylmethyl)aniline,hydrochloride, N-benzyl-N-(4,5-dihydro-1H-imidazol-2-ylmethyl)aniline;hydrochloride, Opera_ID_1387, AC1L29OE, Antazoline Hydrochloride,(S), labotest-bb lt00134672, MLS001148371, MLS002153486, MLS002222161, REGID_for_CID_17275, CHEMBL1256819, DTXSID1047782, CTK8B2946, KS-00000VVI, MolPort-003-940-371, HMS1568D18, HY-B1067, Tox21_110524, ANW-41427, MFCD00058145, SBB057007, AKOS015916586, Tox21_110524_1, AC-8174, AN-8292, CCG-220258, CS-4623, MCULE-4468873456, VA10298, NCGC00016613-10, NCGC00180986-01, LS-79573, KB-280871, TR-011484, A2132, ST50993904, D07459, 2-(n-phenyl-n-benzyl-aminomethyl)-imidazoline hcl, SR-01000000255-3, SR-01000000255-6, I14-51834, 2-(N-BENZYLANILINOMETHYL) IMIDAZOLINE HYDROCHLORIDE, Antazoline Hydrochloride 1.0 mg/ml in Methanol (as free base), benzyl-(4,5-dihydro-1h-imidazol-2-ylmethyl)-phenyl-amine hcl, Antazoline hydrochloride, European Pharmacopoeia (EP) Reference Standard, AC1LCWAX, SCHEMBL1649651, AKOS026749787, N-benzyl-N-(4,5-dihydro-1H-imidazol-2-ylmethyl)aniline; hydron; chloride


ID: 2152

chemical graph of compound 2152



InChIKey: SWOUGRBFXFILIB-UHFFFAOYSA-N
SMILES: CN1CCN(CC1)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl.C(CS(=O)(=O)O)S(=O)(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 91499
synonyms found at PubChem are:
Prochlorperazine edisylate, 1257-78-9, Compazine syrup, Compazine Injection, UNII-PG20W5VQZS, Prochlorperazine Edisylate, USP, prochlorperazine ethanedisulfonate, Prochlorperazine ethane disulfonate, EINECS 215-019-1, PG20W5VQZS, Prochlorperazine edisylate [USP], 2-Chloro-10-(3-(1-methyl-4-piperazinyl)propyl)phenothiazine edisylate, 2-Chloro-10-(3-(4-methyl-1-piperazinyl)propyl)phenothiazine 1,2-ethanedisulfonate (1:1), Prochlorperazine edisylate (USP), MLS001148133, Phenothiazine, 2-chloro-10-(3-(1-methyl-4-piperazinyl)propyl)-, ethanedisulfonate, 10H-Phenothiazine, 2-chloro-10-(3-(4-methyl-1-piperazinyl)propyl)-, 1,2-ethanedisulfonate (1:1), Ethane-1,2-disulphonic acid, compound with 2-chloro-10-(3-(4-methylpiperazin-1-yl)propyl)-10H-phenothiazine (1:1), SMR000653454, 2-Chloro-10-[3-(4-methyl-1-piperazinyl)propyl]phenothiazine 1,2-ethanedisulfonate (1:1), Prochlorperazine edisylate [USAN], Compazine syrup (TN), AC1Q6XA2, SCHEMBL40855, C22H30ClN3O6S3, SPECTRUM1500505, AC1L3M77, CHEMBL1201154, DTXSID4074483, HMS501E15, MolPort-003-666-268, HMS1920L08, HMS2092C09, HMS2234E05, HMS3372M12, Pharmakon1600-01500505, BCP15822, C20H25N3S.C2H6O6S2, CCG-39235, NSC665801, NSC757299, AKOS030228220, API0025987, NSC-665801, NSC-757299, KS-000000G8, NCGC00094768-01, NCGC00094768-02, NCGC00094768-03, 1,2-Ethanedisulfonic acid, compd. with 2-chloro-10-(3-(4-methyl-1-piperazinyl)propyl)-10H-phenothiazine (1:1), 7081-50-7, LS-105400, W0065, D02609, SR-05000001704, SR-05000001704-1, 2-chloro-10-[3-(4-methylpiperazin-1-yl)propyl]phenothiazine; ethane-1,2-disulfonic acid


ID: 2153

chemical graph of compound 2153



InChIKey: SWOVVKGLGOOUKI-ZHGGVEMFSA-N
SMILES: CC(C)[C@@]12[C@@H](O1)[C@H]3[C@@]4(O3)[C@]5(CCC6=C([C@@H]5C[C@H]7[C@]4(C2=O)O7)COC6=O)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 65411
synonyms found at PubChem are:
Triptonide, 38647-11-9, (-)-triptonide, Spectrum_001724, SpecPlus_000568, Spectrum2_000477, Spectrum5_001806, KBioSS_002204, DivK1c_006664, Triptolide,14-deoxy-14-oxo, SPBio_000614, AC1L237D, CHEMBL205190, SCHEMBL4884926, Triptonide, >=98% (HPLC), KBio1_001608, KBio2_002204, KBio2_004772, KBio2_007340, Triptolide, 14-deoxy-14-oxo-, CHEBI:132267, MolPort-016-638-464, BCP26007, ZINC8214966, CCG-38708, NSC165677, AKOS015896754, CS-0318, NSC 165677, NSC-165677, NSC 165677;PG 492, HY-32736, NCI60_001273, SC-14013, AB0035809, N2407, ST24050308, Y0208, W-5087, 647T119, I07-0219, Q-100449, (3bS,4aS,5aS,6aS,7aS,7bS,8aS,8bS)-6a-isopropyl-8b-methyl-3b,4,4a,7a,7b,8b,9,10-octahydrotrisoxireno[6,7:8a,9:4b,5]phenanthro[1,2-c]furan-1,6(3H,6aH)-dione


ID: 2154

chemical graph of compound 2154



InChIKey: SWUARLUWKZWEBQ-VQHVLOKHSA-N
SMILES: C1=CC=C(C=C1)CCOC(=O)/C=C/C2=CC(=C(C=C2)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5281787
synonyms found at PubChem are:
Caffeic acid phenethyl ester, Phenethyl caffeate, 104594-70-9, CAPE, Capeee, Phenylethyl caffeate, phenethyl 3-(3,4-dihydroxyphenyl)acrylate, 115610-29-2, UNII-G960R9S5SK, caffeic acid phenylethyl ester, 2-phenylethyl caffeate, Caffeic acid-phenethyl ester, CHEBI:8062, CHEMBL319244, G960R9S5SK, 100981-80-4, Caffeic acid 2-phenylethyl ester, PHENETHYL CAFFEATE (CAPE), SWUARLUWKZWEBQ-VQHVLOKHSA-N, 2-phenylethyl 3-(3,4-dihydroxyphenyl)-2-propenoate, Caffeic Acid Phenethyl Ester, Synthetic, 2-phenylethyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate, (E)-phenethyl 3-(3,4-dihydroxyphenyl)acrylate, 2-phenylethyl 3-(3,4-dihydroxyphenyl)prop-2-enoate, 2-phenylethyl (2E)-3-(3,4-dihydroxyphenyl)acrylate, phenethyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate, 2-Phenylethyl (2e)-3-(3,4-Dihydroxyphenyl)prop-2-Enoate, 3-(3,4-Dihydroxyphenyl)-2-propenoic acid 2-phenylethyl ester, SMR000326751, 2-Propenoic acid, 3-(3,4-dihydroxyphenyl)-, 2-phenylethyl ester, SR-01000075785, phenethyl 3,4-dihydroxycinnamate, QAP, caffeic acidphenethylester, caffeic acid phenethylester, D06YGF, AC1NQZ32, caffeic acid phenylethylester, Lopac0_000269, BSPBio_001560, BSPBio_003586, MLS000859889, MLS002207297, SPECTRUM1502209, ZINC1083, Jsp000448, DTXSID8040987, CHEBI:93478, MolPort-003-665-504, FR102, HMS1361N22, HMS1791N22, HMS1989N22, HMS2233J04, HMS3260F20, HMS3402N22, HMS3649C16, Caffeic acid beta-phenylethyl ester, Trans-Caffeic Acid Phenethyl Ester, BCP27877, Caffeic acid phenethyl ester(CAPE), EBD26363, HY-N0274, Tox21_500269, BDBM50029207, Caffeic acid phenethyl ester (CAPE), CCG-39542, MFCD00866470, s7414, 2-Propenoic acid, 3-(3,4-dihydroxyphenyl)-, 2-phenylethyl ester, (E)-, AKOS015888207, AC-8896, LP00269, RP17623, RTR-001007, IDI1_034030, QTL1_000016, NCGC00093727-01, NCGC00093727-02, NCGC00093727-03, NCGC00093727-04, NCGC00093727-05, NCGC00093727-06, NCGC00093727-07, NCGC00093727-08, NCGC00093727-09, NCGC00260954-01, AJ-07958, AN-33053, AS-14021, I793, SC-19142, ZB000242, LS-123626, TR-001007, CS-0008774, EU-0100269, ST24031525, B-6327, C 8221, C10484, I01-0894, SR-01000075785-1, SR-01000075785-6, SR-01000075785-9, BRD-K84709232-001-02-6, BRD-K96188950-001-02-9, BRD-K96188950-001-04-5, Caffeic acid phenethyl ester, >=97% (HPLC), powder, I14-33952, 3-(3,4-Dihydroxy-phenyl)-acrylic acid phenethyl ester, (E)-3-(3,4-Dihydroxy-phenyl)-acrylic acid phenethyl ester


ID: 2155

chemical graph of compound 2155



InChIKey: SWXXKWPYNMZFTE-UHFFFAOYSA-N
SMILES: CCSC(=N)N.Br

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 200213
synonyms found at PubChem are:
S-Ethylisothiourea hydrobromide, 1071-37-0, 2-Ethyl-2-thiopseudourea hydrobromide, Ethiron, Ethiron bromide, ethyl carbamimidothioate hydrobromide, EIT hydrobromide, S-Ethylthiuronium bromide, S-Ethylisothiouronium hydrobromide, Bromide S-ethylisothiuronium, S-Ethylisothiuronium bromide, USAF EL-18, Isothuron hydrobromide, 2-Ethylisothiourea hydrobomide, Isothurone hydrobromide, WR 539, 2-Ethylisothiourea hydrobromide, (ethylsulfanyl)methanimidamide hydrobromide, Pseudourea, 2-ethyl-2-thio-, hydrobromide, 2-ethylisothiourea, S-Ethyl-ITU, HBr, S-Ethylisothiourea, HBr, NSC 27208, 2-Ethyl-2-thiopseudourea, hydrobromide, Carbamimidothioic acid, ethyl ester, monohydrobromide, S-Ethylisothio Urea, Hydrobromide, C3H8N2S.HBr, EN300-70503, 133514-72-4, SR-01000075856, S-Ethylisothiourea HBr, WLN: SHYZUN2, S-Ethylthioureahydrobromide, ACMC-2098nn, D0V4NQ, Pseudourea, 2-ethyl-2-thio-, monohydrobromide, S-ethylthiourea hydrobromide, AC1L43VD, AC1Q23FK, SCHEMBL18169, Ethyl isothiourea hydrobromide, S-EthylisothioureaHydrobromide, MLS002153234, SPECTRUM1505161, S-ethylisothiourea-hydrobromide, CHEMBL1255945, CTK4A5022, (S)-Ethylisothiourea hydrobromide, 2986-20-1 (Parent), DTXSID90147913, MolPort-002-322-427, SWXXKWPYNMZFTE-UHFFFAOYSA-N, BCP20133, NSC27208, Tox21_500491, 2034AH, 7080AF, ANW-15489, MFCD00012585, NSC-27208, AKOS016353460, CCG-221795, LP00491, MCULE-2161729152, NE10708, KS-000017M3, NCGC00093894-01, NCGC00093894-02, NCGC00261176-01, SC-20585, SC-53442, SMR001230700, 2-Ethyl-2-thio-pseudourea Monohydrobromide, KB-112797, LS-126148, TC-104234, 2-Ethyl-2-thiopseudourea hydrobromide, 98%, B6481, E0182, EU-0100491, FT-0633285, E 3149, Carbamimidothioic Acid Ethyl Ester, Hydrobromide, C-49559, J-001710, SR-01000075856-1, SR-01000075856-3, SR-01000075856-7, Pseudourea, 2-ethyl-2-thio-, monohydrobromide (8CI), Carbamimidothioic acid, ethyl ester, monohydrobromide (9CI), S-ethylthiouronium bromide, SCHEMBL2916648, AKOS023093342


ID: 2156

chemical graph of compound 2156



InChIKey: SXJIZQPZESTWLD-UHFFFAOYSA-N
SMILES: CC(C)SC1=CC2=C(C=C1)N=C(N2)NC(=O)OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6604471
synonyms found at PubChem are:
Methiazole, 74239-55-7, Prestwick-14D11, Prestwick0_001080, Prestwick1_001080, Prestwick2_001080, Prestwick3_001080, AC1O7GJ1, Methiazole, 98% (TLC), BSPBio_001100, MLS002154145, SPBio_003000, BPBio1_001210, SCHEMBL9882802, CHEMBL1354363, CHEBI:94268, CTK8G0826, DTXSID50424979, MolPort-044-562-735, HMS1571G22, HMS2098G22, HMS2231A21, HMS3370O02, HMS3715G22, ZINC4245701, CCG-221080, NCGC00017007-01, NCGC00017007-02, SMR001233449, AB00514034, Methyl 5-(isopropylthio)benzimidazole-2-carbamate, SR-01000841828, SR-01000841828-2, BRD-K02764365-001-03-7, BRD-K02764365-001-05-2, F2173-0224, methyl (5-(isopropylthio)-1H-benzo[d]imidazol-2-yl)carbamate, methyl N-(6-propan-2-ylsulfanyl-1H-benzimidazol-2-yl)carbamate


ID: 2157

chemical graph of compound 2157



InChIKey: SXTAYKAGBXMACB-DPVSGNNYSA-N
SMILES: CS(=N)(=O)CC[C@@H](C(=O)O)N

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 89034
synonyms found at PubChem are:
L-Methionine sulfoximine, 15985-39-4, (2S)-2-amino-4-(S-methylsulfonimidoyl)butanoic acid, L-Methionine [R,S]-Sulfoximine, Methionine sulfoximine (L), Butanoic acid, 2-amino-4-(S-methylsulfonimidoyl)-, (2S)-, CHEBI:28490, L-S-(3-Amino-3-carboxypropyl)-S-methylsulfoximine, MFCD00002621, L-Methionine (R,S)-sulfoximine, (2S)-2-AMINO-4-(METHYLSULFONIMIDOYL)BUTANOIC ACID, L-Methionine-S,R-sulfoximine, Prestwick_805, L-Methionine-Sulfoximine, AC1Q6THF, Prestwick0_000523, Prestwick1_000523, Prestwick2_000523, Prestwick3_000523, Lopac0_000797, BSPBio_000505, SCHEMBL187872, (2S)-2-Amino-4-(S-methylsufonimidoyl)butanoic acid, SPBio_002426, AC1L3H04, BPBio1_000557, CHEMBL143324, CHEMBL1627202, Butanoic acid, 2-amino-4-(S-methylsufonimidoyl)-, (2S)-, MolPort-003-938-161, HMS1569J07, HMS2096J07, HMS3262O16, BCP10104, Tox21_500797, ANW-58082, AKOS015892783, CCG-204881, FCH3468694, LP00797, NCGC00094132-01, NCGC00094132-02, NCGC00094132-03, NCGC00094132-04, NCGC00261482-01, AS-40141, KB-53326, AX8136583, TC-146827, AB00513853, EU-0100797, FT-0084494, FT-0084789, AZ0001-0559, C03510, M 5379, Z-5302, (2S)-2-amino-4-(methylsulfonimidoyl)butyric acid, SR-01000075995, (2S)-2-azanyl-4-(methylsulfonimidoyl)butanoic acid, I04-1120, J-009648, SR-01000075995-1, (2S)-2-Amino-4-(S-methylsufonimidoyl)-butanoic acid, L-Methionine sulfoximine, certified reference material, TraceCERT(R), L-Methionine sulfoximine, PharmaGrade, Manufactured under appropriate GMP controls for pharma or biopharmaceutical production., L-methionine-D,L-sulphoximine, methionine sulfoximine zwitterion, CHEBI:87826, L-methionine sulfoximine zwitterion, (2S)-2-azaniumyl-4-(S-methanesulfonimidoyl)butanoate


ID: 2158

chemical graph of compound 2158



InChIKey: SXYZQZLHAIHKKY-GSTUPEFVSA-N
SMILES: C[C@@H]1C[C@H]2[C@@H]3C[C@@H](C4=CC(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2([C@H]1C(=O)COC(=O)C(C)(C)C)C)O)Cl)C)F

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5282493
synonyms found at PubChem are:
CLOCORTOLONE PIVALATE, 34097-16-0, Clocortolone 21-pivalate, Cloderm, UNII-QBL8IZH14X, QBL8IZH14X, Purantix, MLS002154165, CHEBI:59583, 9-Chloro-6alpha-fluoro-11beta,21-dihydroxy-16alpha-methylpregna-1,4-diene-3,20-dione 21-pivalate, C27H36ClFO5, Cilder, CL 68, EINECS 251-826-5, SH 863, [2-[(6S,8S,9R,10S,11S,13S,14S,16R,17S)-9-chloro-6-fluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-7,8,11,12,14,15,16,17-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 2,2-dimethylpropanoate, 9-chloro-6alpha-fluoro-11beta-hydroxy-16alpha-methyl-3,20-dioxopregna-1,4-dien-21-yl 2,2-dimethylpropanoate, Clocortolone pivalate [USAN:USP], NCGC00016824-01, Cloderm (TN), CAS-34097-16-0, Prestwick0_001119, Prestwick1_001119, Prestwick2_001119, Prestwick3_001119, AC1NR05P, clocortolone trimethylacetate, SCHEMBL5120, DSSTox_CID_25460, DSSTox_RID_80891, Clocortolone pivalate (USP), DSSTox_GSID_45460, BSPBio_001258, SPBio_003119, BPBio1_001383, CHEMBL1200975, DTXSID0045460, HMS1571O20, HMS2098O20, HMS2236M06, HMS3715O20, 9alpha-Chloro-6alpha-fluoro-11beta,21-dihydroxy-16alpha-methylpregna-1,4-diene-3,20-dione 21-pivalate, Pregna-1,4-diene-3,20-dione, 9-chloro-21-(2,2-dimethyl-1-oxopropoxy)-6-fluoro-11-hydroxy-16-methyl-, (6alpha,11beta,16alpha)-, ZINC4212603, Tox21_110632, CCG-221119, NCGC00179239-01, CLOCORTOLONE PIVALATE (200 MG), SMR001233464, AB00514058, Z6141, D02287, SR-01000838872, SR-01000838872-2, BRD-K38003476-001-03-4, 51434-44-7


ID: 2159

chemical graph of compound 2159



InChIKey: SYCBXBCPLUFJID-UHFFFAOYSA-N
SMILES: CCCCOC1=CC=C(C=C1)OCCCN2CCOCC2.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 73957
synonyms found at PubChem are:
Pramoxine hydrochloride, 637-58-1, Pramoxine HCl, Pramocaine hydrochloride, Prax Lotion, Tronolane, Tronothane hydrochloride, Pramocaine (hydrochloride), ProctoFoam-NS, UNII-88AYB867L5, HSDB 7220, EINECS 211-293-1, NSC 25573, Pramoxine hydrochloride [USP], MLS000028604, Morpholine, 4-[3-(4-butoxyphenoxy)propyl]-, hydrochloride, 88AYB867L5, 4-(3-(p-Butoxyphenoxy)propyl)morpholine hydrochloride, p-Butoxyphenyl gamma-morpholinopropyl ether hydrochloride, gamma-Morpholinopropyl 4-n-butoxyphenyl ether hydrochloride, Morpholine, 4-(3-(4-butoxyphenoxy)propyl)-, hydrochloride, SMR000058670, DSSTox_CID_27757, DSSTox_RID_82534, DSSTox_GSID_47777, Pramoxine hydrochloride (USP), Q-100732, 4-[3-(4-butoxyphenoxy)propyl]morpholine hydrochloride, p-Butoxyphenyl gamma-mopholinopropyl ether hydrochloride, Morpholine, 4-(3-(p-butoxyphenoxy)propyl)-, hydrochloride, NCGC00016529-01, CAS-637-58-1, 4-(3-(4-butoxyphenoxy)propyl)morpholine hydrochloride, 4-[3-(4-butoxyphenoxy)propyl]morpholine;hydrochloride, 4-[3-(p-Butoxyphenoxy)propyl]morpholine hydrochloride, SR-01000000243, Pramoxine, HCl, Tronothane (TN), Prestwick_1044, AC1L2KVS, Opera_ID_1593, AC1Q3DO8, MLS002222295, PRAXOMINE HYDROCHLORIDE, SCHEMBL180542, SPECTRUM1501139, CHEBI:8358, 140-65-8 (Parent), CHEMBL1201171, DTXSID2047777, KS-00000KOH, MolPort-003-666-364, HMS1570O13, HMS1921J07, Pharmakon1600-01501139, HY-B1319, NSC25573, Tox21_110477, KM0782, NSC-25573, NSC757847, s4092, AKOS015895041, Tox21_110477_1, AC-2094, API0003909, CCG-212937, CS-4643, MCULE-1100217744, NSC-757847, WLN: T6N DOTJ A3OR DO4 &GH, NCGC00016529-07, NCGC00094907-01, NCGC00094907-02, NCGC00094907-03, AN-14282, AS-12691, BC209186, LS-92487, AB0012331, FT-0603501, ST51015106, VU0239834-5, D00739, C-19995, I06-0440, Pramoxine hydrochloride, analytical standard, >=98%, SR-01000000243-3, 4-(3-(p-Butoxyphenoxy) propyl)-morpholine hydrochloride, 4-butoxy-1-(3-morpholin-4-ylpropoxy)benzene, chloride, 4-(3-(p-Butoxyphenoxy) propyl) -morpholine hydrochloride, p-Butoxyphenyl .gamma.-morpholinopropyl ether hydrochloride, .gamma.-Morpholinopropyl 4-N-butoxyphenyl ether hydrochloride, 4-[3-(4-Butoxyphenoxy)propyl]morpholine hydrochloride (1:1), Morpholine, 4-[3-(p-n-butoxyphenoxy )propyl]-, hydrochloride, Morpholine, 4-[3-(4-butoxyphenoxy)propyl]-, hydrochloride (1:1), Pramoxine hydrochloride, United States Pharmacopeia (USP) Reference Standard, Pramoxine hydrochloride, Pharmaceutical Secondary Standard; Certified Reference Material, AC1LAODB, 4-[3-(4-butoxyphenoxy)propyl]morpholin-4-ium chloride, AC1LCW6O, AKOS026749901, 4-[3-(4-butoxyphenoxy)propyl]morpholine; hydron; chloride


ID: 2160

chemical graph of compound 2160



InChIKey: SYDNPHFWTKACIZ-QXUFBKIYSA-N
SMILES: C1=CC=C(C=C1)/C=C/C(=O)C2=C(C=C(C=C2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6857762
synonyms found at PubChem are:
2',4'-DIHYDROXYCHALCONE 4'-GLUCOSIDE, Spectrum5_000572, AC1OAH67, BSPBio_001663, SPECTRUM200258, CHEMBL3039237, HMS1922P20, CCG-38691, SDCCGMLS-0066449.P001, NCGC00179105-01, 4'-(beta-D-Glucopyranosyloxy)-2'-hydroxychalcone, SR-05000002642, SR-05000002642-1, BRD-K55250255-001-02-8, BRD-K55250255-001-03-6, (E)-1-[2-hydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-3-phenylprop-2-en-1-one


ID: 2161

chemical graph of compound 2161



InChIKey: SYRURBPRFQUYQS-RHEJLWEFSA-N
SMILES: C1=CC(=C(C=C1/C=C\2/C(=O)C3=C(O2)C(=C(C=C3)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6450184
synonyms found at PubChem are:
Maritimein, 490-54-0, UNII-4PTU0WDQ7M, Maritimetin-6-O-glucoside, 4PTU0WDQ7M, EINECS 207-712-2, AC1O517A, SCHEMBL1706306, CHEMBL2165570, ZX-AFC002767, ZINC33985284, VA11236, (Z)-2-((3,4-Dihydroxyphenyl)methylene)-6-(beta-D-glucopyranosyloxy)-7-hydroxybenzofuran-3(2H)-one, 3',4'6,7-Tetrahydroxy-6-O-glucosylaurone, 3',4',6,7-Tetrahydroxy-6-O-glucosylaurone, J3.585.376F, 6-O-beta-D-Glucopyranosyl-3',4',6,7-tetrahydroxyaurone, 6-(beta-D-Glucopyranosyloxy)-7-hydroxy-2-(3,4-dihydroxybenzylidene)-3(2H)-benzofuranone, (2Z)-2-(3,4-dihydroxybenzylidene)-7-hydroxy-3-oxo-2,3-dihydro-1-benzofuran-6-yl beta-D-glucopyranoside, (2Z)-2-[(3,4-dihydroxyphenyl)methylidene]-7-hydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1-benzofuran-3-one, 2-[1-(3,4-Dihydroxy-phenyl)-meth-(Z)-ylidene]-7-hydroxy-6-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-benzofuran-3-one, 3(2H)-benzofuranone, 2-[(3,4-dihydroxyphenyl)methylene]-6-(beta-D-glucopyranosyloxy)-7-hydroxy-, (2Z)-, 3(2H)-Benzofuranone,2-[(3,4-dihydroxyphenyl)methylene]-6-(b-D-glucopyranosyloxy)-7-hydroxy-, (2Z)-


ID: 2162

chemical graph of compound 2162



InChIKey: SYTBZMRGLBWNTM-UHFFFAOYSA-N
SMILES: CC(C1=CC(=C(C=C1)C2=CC=CC=C2)F)C(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3394
synonyms found at PubChem are:
flurbiprofen, 5104-49-4, Ansaid, Froben, Antadys, Cebutid, Flurofen, Anside, Flurbiprofene, Flurbiprofeno, Flurbiprofenum, Flubiprofen, Flugalin, Adofeed, 3-Fluoro-4-phenylhydratropic acid, Ocufen, 2-(2-fluorobiphenyl-4-yl)propanoic acid, Flurbiprofene [INN-French], Flurbiprofenum [INN-Latin], Flurbiprofeno [INN-Spanish], BTS 18322, Fluriproben, 2-(3-fluoro-4-phenylphenyl)propanoic acid, Ocuflur, Stayban, Zepolas, Adfeed, Novo-Flurprofen, Nu-Flurbiprofen, Apo-Flurbiprofen, Froben Sr, FP 70, BTS-18322, Anmetarin, Yakuban, U-27182, (+-)-2-Fluoro-alpha-methyl-4-biphenylacetic acid, 2-Fluoro-alpha-methyl-(1,1'-biphenyl)-4-acetic acid, Ansaid (TN), CCRIS 3708, U 27182, 2-(2-Fluorobiphenyl-4-yl)propionic Acid, C15H13FO2, Flurbiprofen [USAN:INN:BAN:JAN], EINECS 225-827-6, IN1332, (+-)-2-(2-Fluoro-4-biphenylyl)propionic acid, CHEMBL563, [+/-]-2-Fluoro-alpha-methyl-4-biphenylacetic acid, U 27,182, (+/-)-FLURBIPROFEN, 2-(2-Fluoro-4-biphenylyl)propionic acid, S-Flurbiprofen, MLS000040873, CHEBI:5130, MKS-11, 2-Fluoro-alpha-methyl-4-biphenylacetic acid, 2-(2-FLUORO-[1,1'-BIPHENYL]-4-YL)PROPANOIC ACID, SYTBZMRGLBWNTM-UHFFFAOYSA-N, (+/-)-2-Fluoro-alpha-methyl-4-biphenylacetic acid, L-790,330, (1)-2-Fluoro-alpha-methyl(1,1'-biphenyl)-4-acetic acid, (1,1'-Biphenyl)-4-acetic acid, 2-fluoro-alpha-methyl-, SMR000042823, 2-(3-fluoro-4-phenyl-phenyl)propanoic acid, F0371, 4-Biphenylacetic acid, 2-fluoro-alpha-methyl-, DSSTox_CID_17231, DSSTox_RID_79310, DSSTox_GSID_37231, Flurwood, Urbifen, AO-295/42284050, 2-(2-fluoro-[1,1'-biphenyl-4-yl])propanoic acid, Q-201129, (1,1'-Biphenyl)-4-acetic acid, 2-fluoro-alpha-methyl-, (+-)-, (+/-)-2-Fluoro-alpha-methyl[1,1&prime;-biphenyl]-4-acetic Acid, Flurbiprofen (Ansaid), CPD000042823, SR-01000003043, FLP, [1,1'-Biphenyl]-4-acetic acid, 2-fluoro-alpha-methyl-, fluribiprofen, fluroben, 2-FLUORO-ALPHA-METHYL-[1,1'-BIPHENYL]-4-ACETIC ACID, dl-Flurbiprofen, Flurbiprofen O, rac-Flurbiprofen, Flurbiprofen,(S), NCGC00016654-01, CAS-5104-49-4, EINECS 257-262-6, Flurbiprofen(Ansaid), Froben (TN), Ocufen (Salt/Mix), FLURBIPROPHEN, Flurbiprofen [USAN:USP:INN:BAN:JAN], PubChem19809, Spectrum_001096, Opera_ID_777, AC1Q1LGF, Prestwick0_000917, Prestwick1_000917, Prestwick2_000917, Prestwick3_000917, Spectrum2_001025, Spectrum3_000435, Spectrum4_000558, Spectrum5_000720, (.+/-.)-Flurbiprofen, D0A1PX, AC1L1FU5, SCHEMBL2248, flurbiprofen and U-27182, 4-Biphenylacetic acid, 2-fluoro-.alpha.-methyl-, BSPBio_000794, BSPBio_002050, KBioGR_001255, KBioSS_001576, MLS000028441, MLS000758198, MLS001201729, MLS001401361, MLS006011431, MLS006011931, DivK1c_000804, SPECTRUM1500308, SPBio_001209, SPBio_002983, BPBio1_000874, GTPL4194, DTXSID0037231, SCHEMBL10029029, Flurbiprofen (JP15/USP/INN), Flurbiprofen (JP17/USP/INN), HMS502I06, KBio1_000804, KBio2_001576, KBio2_004144, KBio2_006712, KBio3_001270, SYTBZMRGLBWNTM-UHFFFAOYSA-, [1,1'-Biphenyl]-4-acetic acid, 2-fluoro-.alpha.-methyl-, MolPort-000-812-253, NINDS_000804, SYNQUEST 2721-3-Y4, HMS1570H16, HMS1920O20, HMS2051A05, HMS2090I06, HMS2091F21, HMS2097H16, HMS2232I08, HMS3259I12, HMS3268E10, HMS3370N14, HMS3371I05, HMS3393A05, HMS3649K11, HMS3655G19, HMS3714H16, Pharmakon1600-01500308, BCP09086, BCP13426, KS-00000G9R, ZX-AP003721, Tox21_110547, Tox21_302353, BBL010980, BDBM50074922, BG0609, CCG-40243, GA8630, MFCD00079303, NSC685701, NSC757037, PC5245, SBB067242, STK802101, Flurbiprofen, cyclooxygenase inhibitor, AKOS004119934, AKOS016340701, AC-8106, AF10210, AN-8337, API0007620, BTS 18,322, CCG-100759, CS-2208, DB00712, KS-5035, MCULE-4306860727, NC00009, NC00563, NSC-685701, NSC-757037, RL03877, TRA0091146, 2(2-Fluoro-4-biphenylyl)propionic acid, IDI1_000804, NCGC00018157-03, NCGC00018157-04, NCGC00018157-05, NCGC00018157-08, NCGC00018157-11, NCGC00025287-03, NCGC00025287-04, NCGC00255457-01, 51543-38-5, AK163084, BC203869, CC-28514, H523, HY-10582, KB-51897, LS-44091, NCI60_030812, SAM001246961, SAM002564209, SC-12072, (+/-)-2-Fluoro-alpha-methyl[1,1&prime, 2 -(2-fluoro-4-biphenylyl)propionic acid, 2-(2-fluoro-4-biphenylyl)-propionic acid, 2-(2-fluoro-biphenyl-4-yl)propionic acid, SBI-0051387.P003, AB0013094, AB1010910, AX8130642, 2-(2-fluoro-biphenyl-4-yl)-propionic acid, AB00051999, FT-0603668, ST24047217, ST50825909, alpha-methyl-2-fluoro-4-biphenylylacetic acid, (RS)-2-(2-fluorobiphenyl-4-yl)propionic acid, 2-Fluoro-.alpha.-methyl-4-biphenylacetic acid, BIM-0051387.0001, C07013, D00330, J10166, K-9414, 2-(2-FLUORO-4-BIPHENYLYL)PROPANOIC ACID, AB00051999-17, AB00051999_18, 104F494, 2-(2-Fluoro[1,1'-biphenyl]-4-yl)propanoic acid, 2-fluoro--methyl-(1,1'-biphenyl)-4-acetic acid, C-14802, (.+/-.)-2-(2-Fluoro-4-biphenylyl)propionic acid, (r/s)-2-fluoro-alpha-methyl-4-biphenylacetic acid, [1,1'-Biphenyl]-4-aceticacid, 2-fluoro-a-methyl-, 2-Fluoro-?-methyl-[1,1'-biphenyl]-4-acetic acid, Flurbiprofen, Antibiotic for Culture Media Use Only, SR-01000003043-2, SR-01000003043-5, SR-01000003043-6, U-27,182, (RS)-2-(2-FLUORO-4-BIPHENYLYL)PROPIONIC ACID, 2-(2-fluoro-[1,1''-biphenyl-4-yl])propanoic acid, 2-(2-Fluoro[1,1'-biphenyl]-4-yl)propanoic acid #, BRD-A86044036-001-05-9, Flurbiprofen,2-(2-Fluorobiphenyl-4-yl)propanoic acid, I14-60958, SR-01000003043-14, (.+/-.)-2-Fluoro-.alpha.-methyl-4-biphenylacetic acid, 2-Fluoro-.alpha.-methyl(1,1'-biphenyl)-4-acetic acid, 2-fluoro-alpha-methyl-(1,1''-biphenyl)-4-acetic acid, 2-FLUORO-[1,1'-BIPHENYL]-4-(ALPHA-METHYL)ACETIC ACID, Flurbiprofen, European Pharmacopoeia (EP) Reference Standard, (+/-)-2-FLUORO-ALPHA-METHYL[1,1'-BIPHENYL]-4-ACETIC ACID, (1,1'-Biphenyl)-4-acetic acid, 2-fluoro-alpha-methyl-, (+/-)-, Flurbiprofen, United States Pharmacopeia (USP) Reference Standard, [1,1'-Biphenyl]-4-acetic acid, 2-fluoro-.alpha.-methyl-, (.+/-.)-, Flurbiprofen, Pharmaceutical Secondary Standard; Certified Reference Material, InChI=1/C15H13FO2/c1-10(15(17)18)12-7-8-13(14(16)9-12)11-5-3-2-4-6-11/h2-10H,1H3,(H,17,18)


ID: 2163

chemical graph of compound 2163



InChIKey: SZBULDQSDUXAPJ-XNIJJKJLSA-N
SMILES: C1CCC(CC1)NC2=NC=NC3=C2N=CN3[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 9841284
synonyms found at PubChem are:
N6-Cyclohexyladenosine, 36396-99-3, N(6)-Cyclohexyladenosine, (2R,3R,4S,5R)-2-(6-(Cyclohexylamino)-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol, C16H23N5O4, Adenosine, N-cyclohexyl-, CHEMBL45891, (2R,3R,4S,5R)-2-[6-(cyclohexylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol, n-cyclohexyladenosine, N-6-cyclohexyladenosine, N6 -cyclohexyladenosine, N6-Cyclohexylado (CHA), D02JCM, n6-cyclohexyl[3h]adenosine, Lopac0_000331, GTPL423, SCHEMBL145856, MolPort-027-835-536, SZBULDQSDUXAPJ-XNIJJKJLSA-N, HMS3261C03, ZINC4217017, Tox21_500331, 4616AB, BDBM50009552, MFCD00036808, PDSP1_000670, PDSP1_001023, PDSP1_001025, PDSP2_000660, PDSP2_001007, PDSP2_001009, AKOS016009588, CCG-204426, CS-5050, LP00331, NCGC00093771-01, NCGC00093771-02, NCGC00093771-03, NCGC00093771-04, NCGC00261016-01, AC-27401, AJ-48997, HY-18939, AX8142876, KB-206469, EU-0100331, ST24026156, C 9901, SR-01000075797, SR-01000075797-1, 2-[6-Amino-2-(2-morpholin-4-yl-ethylamino)-purin-9-yl]-5-hydroxymethyl-tetrahydro-furan-3,4-diol


ID: 2164

chemical graph of compound 2164



InChIKey: SZINUGQCTHLQAZ-DQYPLSBCSA-N
SMILES: CC(=O)C1=C([C@@H]2[C@@H]3[C@@H](CC4=C5C3=CNC5=CC=C4)C(N2C1=O)(C)C)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 54682463
synonyms found at PubChem are:
cyclopiazonic acid, alpha-Cyclopiazonic acid, 18172-33-3, UNII-X9TLY4580Z, NSC 117181, CCRIS 4942, HSDB 7248, alpha-Cyclopiazonate, X9TLY4580Z, CHEBI:22450, 83136-88-3, C20H20N2O3, cyclopyazonic acid, (6aR,10Z,11aS,11bR)-10-(1-hydroxyethylidene)-7,7-dimethyl-6a,7,11a,11b-tetrahydro-6H-pyrrolo[1',2':2,3]isoindolo[4,5,6-cd]indole-9,11(2H,10H)-dione, 9H-Pyrrolo(1',2':2,3)isoindolo(4,5,6-cd)indol-9-one, 2,6,6a,7,11a,11b-hexahydro-10-acetyl-7,7-dimethyl-11-hydroxy-, (6a-alpha,11a,11b-alpha)-, (6ar,11as,11br)-10-Acetyl-9-Hydroxy-7,7-Dimethyl-2,6,6a,7,11a,11b-Hexahydro-11h-Pyrrolo[1',2':2,3]isoindolo[4,5,6-Cd]indol-11-One, 2o9j, 2oa0, D0K6HL, AC1L22XA, BSPBio_001303, CHEMBL480627, GTPL5350, SCHEMBL1471247, SCHEMBL15049041, CHEBI:17734, MolPort-003-983-745, HMS1791B05, HMS1989B05, HMS3267F17, HMS3402B05, BS0055, MFCD00167445, AKOS024456479, ZINC100061481, ZINC100067111, ZINC110970687, CCG-208182, DB07604, NCGC00163130-01, NCGC00163130-02, NCGC00163130-03, LS-139391, FT-0624278, C03032, J-011619, (2R,3S,9R)-5-acetyl-4-hydroxy-8,8-dimethyl-7,16-diazapentacyclo[9.6.1.0^{2,9}.0^{3,7}.0^{15,18}]octadeca-1(17),4,11(18),12,14-pentaen-6-one, (2R,3S,9R)-5-acetyl-6-hydroxy-8,8-dimethyl-7,16-diazapentacyclo[9.6.1.0^{2,9}.0^{3,7}.0^{15,18}]octadeca-1(17),5,11(18),12,14-pentaen-4-one, (6aR,11aS,11bR)-10-acetyl-11-hydroxy-7,7-dimethyl-2,6,6a,7,11a,11b-hexahydro-9H-pyrrolo[1',2':2,3]isoindolo[4,5,6-cd]indol-9-one, (6aR,11aS,11bR)-rel-10-Acetyl-2,6,6a,7,11a,11b-hexahydro-7,7-dimethyl-9H-pyrrolo[1',2':2,3]isoindolo[4,5,6-cd]indol-9-one, 98718-32-2, 9H-Pyrrolo(1',2':2,3)isoindolo(4,5,6-cd)indol-9-one, 10-acetyl-2,6,6a,7,11a,11b-hexahydro-11-hydroxy-7,7-dimethyl-, (6aalpha,11abeta,11balpha)- (8CI), 9H-Pyrrolo(1',2':2,3)isoindolo(4,5,6-cd)indol-9-one, 10-acetyl-2,6,6a,7,11a,11b-hexahydro-11-hydroxy-7,7-dimethyl-, (6aalpha,11abeta,11balpha)- (8CI)(9CI), 9H-Pyrrolo(1',2':2,3)isoindolo(4,5,6-cd)indol-9-one, 10-acetyl-2,6,6a,7,11a,11b-hexahydro-11-hydroxy-7,7-dimethyl-, (6aR,11aS,11bR)-rel-


ID: 2165

chemical graph of compound 2165



InChIKey: SZLZWPPUNLXJEA-QEGASFHISA-N
SMILES: CO[C@H]1[C@@H](C[C@@H]2CN3CCC4=C([C@H]3C[C@@H]2[C@@H]1C(=O)OC)NC5=C4C=CC(=C5)OC)OC(=O)/C=C/C6=CC(=C(C(=C6)OC)OC)OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5280954
synonyms found at PubChem are:
rescinnamine, Rescinnamin, Moderil, Cinnaloid, Rescisan, Resealoid, Scinnamina, Apoterin, Anaprel, Cartric, 24815-24-5, Cinnasil, Paresinan, Raurescin, Apolon, Rozex, Reserpinine, Normorescina, Cinamine, Cinatabs, Raupyrol, Raurescine, Recitensina, Rescaloid, Rescamin, Rescidan, Rescinpal, Rescitens, Reskinnamin, Tenamine, Rescin, Resipal, Tuareg, Methyl trimethoxycinnamoylreserpate, Reserpinine (C35 alkaloid), Reserpinine (VAN), Rescinamina, Rescinnamina, Rescinnamine (VAN), Rescinnaminum, Rescinnamina [DCIT], Rescinamina [INN-Spanish], Rescinnaminum [INN-Latin], Resepinine (C35 alkaloid), Recinnamine, Reserpinene, Reserpinin, Tsuruselpi S, 3,4,5-Trimethoxycinnamoyl methyl reserpate, UNII-Q6W1F7DJ2D, Rescinnamine [BAN:INN:JAN], Trimethoxy cinnamoyl reserpate de methyl, CCRIS 4711, Tsuruselpi S (TN), 3,4,5-Trimethylcinnamoyl methyl reserpate, HSDB 2176, 3,4,5-Trimethylcinnamic acid, ester with methyl reserpate, NSC15628, EINECS 246-471-8, Rescinnamine (JAN/INN), NSC 15628, 3,4,5-Trimethoxycinnamic acid, methyl reserpate, Trimethoxy cinnamoyl reserpate de methyl [French], Methyl 18-O-(3,4,5-trimethoxycinnamoyl)reserpate, BRN 0075328, Q6W1F7DJ2D, Methyl reserpate 3,4,5-trimethoxycinnamic acid ester, AI3-52763, CHEBI:28572, Trimethoxycinnamoyl methyl reserpate, Yohimban-16-carboxylic acid, 11,17-dimethoxy-18-((1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propenyl)oxy)-, methyl ester, (3beta,16beta,17alpha,18beta,20alpha)-, Anapral, 11,17alpha-Dimethoxy-18beta-((1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propenyl)oxy)-3beta,20alpha-yohimban-16beta-carboxylic acid methyl ester, 3beta,20alpha-Yohimban-16beta-carboxylic acid, 18beta-hydroxy-11,17alpha-dimethoxy-, methyl ester, 3,4,5-trimethoxycinnamate (ester), (E)-, Methyl 1alpha,2beta,3alpha,4,4aalpha,5,7,8,13,13bbeta,14,14aalpha-dodecahydro-2alpha,11-dimethoxy-3beta-(3,4,5-trimethoxycinnamoyloxy)benz(g)indolo(2,3-a)quinolizine-1beta-carboxylate, Yohimban-16-carboxylic acid, 11,17-dimethoxy-18-((1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propenyl)-oxy)-, methyl ester, (3beta,16beta,17alpha,18beta(E),20alpha)-, Reserpic acid methyl ester 3,4,5-trimethoxycinnamate, Apoterin S, O-(3,4,5-Trimethoxy-trans-cinnamoyl) methyl reserpate, Methyl 18beta-hydroxy-11,17alpha-dimethoxy-3beta,20alpha-yohimban-16beta-carboxylate, 3-beta,20-alpha-Yohimban-16-beta-carboxylic acid, 18-beta-hydroxy-11,17-alpha-dimethoxy-, methyl ester, 3,4,5-trimethoxycinnamate (ester), 3beta,20alpha-Yohimban-16beta-carboxylic acid, 18beta-hydroxy-11,17alpha-dimethoxy-, methyl ester, 3,4,5-trimethoxycinnamate (ester), methyl (1R,15S,17R,18R,19S,20S)-6,18-dimethoxy-17-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]oxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate, Rescinnamine [INN:BAN:JAN:NF], Cinnasil (TN), methyl (3beta,16beta,17alpha,18beta,20alpha)-11,17-dimethoxy-18-({(2E)-3-[3,4,5-tris(methyloxy)phenyl]prop-2-enoyl}oxy)yohimban-16-carboxylate, Prestwick_558, Anaprel (TN), Moderil (TN), Prestwick2_000568, Prestwick3_000568, D0G8NJ, CHEMBL1668, BSPBio_000356, 4-25-00-01323 (Beilstein Handbook Reference), MLS002153878, SCHEMBL181966, BPBio1_000392, GTPL7098, MEGxp0_001952, ACon1_002115, CHEBI:92923, MolPort-001-742-634, C35H42N2O9, HMS1569B18, HMS2096B18, HMS2234E08, ZINC4097185, NSC-15628, LS-1060, 3,5-Trimethoxycinnamoyl methyl reserpate, NCGC00179585-04, SMR001233232, NP-011016, 3,5-Trimethoxycinnamic acid, methyl reserpate, C06540, D00198, NCGC00179585-04_C35H42N2O9_Cinnaloid, BRD-K52930707-001-02-2, BRD-K52930707-001-04-8, 11,17-Dimethoxy-18-[[1-oxo-3-3,4,5-trimethoxyphenyl)-2-propenyl]oxy]-3,20-yohimban-16-carboxylic acid methyl ester, 15676-43-4, 15676-44-5, 25460-29-1, 28821-79-6, 3-beta,20-alpha-Yohimban-16-beta-carboxylic acid, 18-beta-hydroxy-11,17-alpha-dimethoxy-,methyl ester, 3,4,5-trimethoxycinnamate (ester), 3.beta., 18.beta.-hydroxy-11,17.alpha.-dimethoxy-, methyl ester, 3,4,5-trimethoxycinnamate (ester), 412909-15-0, 522-78-1, 84-34-4, Benz[g]indolo[2, 1,2,3,4,4a,5,7,8,13,13b,14,14a-dodecahydro-3-hydroxy-2,11-dimethoxy-, methyl ester, 3,4,5-trimethoxycinnamate, methyl (1R,15S,17R,18R,19S,20S)-6,18-dimethoxy-17-{[3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]oxy}-3,13-diazapentacyclo[11.8.0.0;{2,10}.0;{4,9}.0;{15,20}]henicosa-2(10),4,6,8-tetraene-19-carboxylate, methyl 11,17alpha-dimethoxy-18beta-{[(2E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]oxy}-3beta,20alpha-yohimban-16beta-carboxylate, Yohimban-16-carboxylic acid, 11,17-dimethoxy-18-(((2E)-1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propenyl)oxy)-, methyl ester, (3beta,16beta,17alpha,18beta,20alpha)-, Yohimban-16-carboxylic acid, 11,17-dimethoxy-18-[[(2E)-1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propenyl]oxy]-, methyl ester, (3b,16b,17a,18b,20a)-, Yohimban-16-carboxylic acid,17-dimethoxy-18-[[1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propenyl]oxy]-, methyl ester, (3.beta.,16.beta.,17.alpha.,18.beta.,20.alpha.)-, Yohimban-16-carboxylicacid,11,17-dimethoxy-18-[[(2E)-1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propen-1-yl]oxy]-,methyl ester, (3b,16b,17a,18b,20a)-


ID: 2166

chemical graph of compound 2166



InChIKey: SZNLKILVMCHHSD-OZFNKYQOSA-N
SMILES: CC(=CCC/C(=C/CC/C(=C/CC/C(=C/C(=O)O)/C)/C)/C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5275521
synonyms found at PubChem are:
Geranylgeranic acid, Geranylgeranoic acid, CHEBI:84971, 83807-40-3, (2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenoic acid, AC1NQN4U, 3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraenoic acid, SCHEMBL430557, CHEMBL171326, SCHEMBL16221387, SZNLKILVMCHHSD-OZFNKYQOSA-N, (2E,6E,10E)-geranylgeranic acid, AKOS027326390, CCG-208213, NCGC00163653-01, SR-05000002342, SR-05000002342-2, 2,6,10,14-Hexadecatetraenoic acid, 3,7,11,15-tetramethyl-, 2,6,10,14-Hexadecatetraenoic acid, 3,7,11,15-tetramethyl-, (2E,6E,10E)-, 35750-48-2


ID: 2167

chemical graph of compound 2167



InChIKey: SZQIFWWUIBRPBZ-UHFFFAOYSA-N
SMILES: CCN1C(=O)C(NC1=O)C2=CC=CC=C2

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3292
synonyms found at PubChem are:
ethotoin, Peganone, 86-35-1, Ethotoinum, 3-Ethyl-5-phenylhydantoin, Ethotoine, Etotoina, 3-ethyl-5-phenylimidazolidine-2,4-dione, Accenon, Ethotoine [INN-French], Ethotoinum [INN-Latin], Etotoina [INN-Spanish], Pegoanone, 3-Ethyl-5-phenylimidazolidin-2,4-dione, 1-Ethyl-2,5-dioxo-4-phenylimidazolidine, 2,4-Imidazolidinedione, 3-ethyl-5-phenyl-, Hydantoin, 3-ethyl-5-phenyl-, (+-)-3-Ethyl-5-phenylhydantoin, Ethotoin [INN:BAN:JAN], Peganone (TN), Accenon (TN), HSDB 3580, EINECS 201-665-1, Ethotoin (JAN/USP/INN), BRN 0188272, CHEBI:4888, 3-Ethyl-5-phenyl-2,4-imidazolidinedione, 3-ethyl-5-phenyl-imidazolidine-2,4-dione, 2,4-Imidazolidinedione, 3-ethyl-5-phenyl-, (+-)-, Ethotoin [USP:INN:BAN:JAN], CAS-86-35-1, NCGC00016340-01, Abbott brand of ethotoin, AC1L1FLQ, (.+/-.)-Ethotoin, Prestwick0_000696, Prestwick1_000696, Prestwick2_000696, Prestwick3_000696, DSSTox_CID_3020, D05EPM, CHEMBL1095, DSSTox_RID_76833, DSSTox_GSID_23020, Oprea1_374844, SCHEMBL34301, BSPBio_000851, 5-24-08-00005 (Beilstein Handbook Reference), MLS002153961, SPBio_002772, BPBio1_000937, GTPL7183, DTXSID6023020, MolPort-003-666-682, SZQIFWWUIBRPBZ-UHFFFAOYSA-N, HMS1570K13, HMS2097K13, HMS2232M06, HMS3371O03, HMS3714K13, Pharmakon1600-01505428, Tox21_110383, NSC760074, AKOS008947805, API0009008, CCG-213433, DB00754, MCULE-6544505383, NSC-760074, NCGC00179401-01, NCGC00179401-03, LS-76194, NS-02146, SMR001233300, 3-Ethyl-5-phenyl-2,4-imidazolidinedione #, AB00513897, C07839, D00708, AB00513897_07, SR-01000841832, SR-01000841832-2, Z53845223, 1-ethyl-2-hydroxy-4-phenyl-4,5-dihydro-1H-imidazol-5-one


ID: 2168

chemical graph of compound 2168



InChIKey: SZUJJDLBXJCDNT-AQNXPRMDSA-N
SMILES: CCCCCCCCCCCCCC[C@H]([C@H]([C@@H](CO)NC(=O)C)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 10451108
synonyms found at PubChem are:
C2 Phytoceramide, 475995-69-8, CTK8E7779, RT-011877, (2R,3S,4R)-2-(Acetylamino)octadecane-1,3,4-triol


ID: 2169

chemical graph of compound 2169



InChIKey: TTYVYRHNIVBWCB-UHFFFAOYSA-N
SMILES: CC1CCC(C(C1)OC(=O)C2=CC=CC=C2)C(C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 93868
synonyms found at PubChem are:
71617-14-6, TTYVYRHNIVBWCB-UHFFFAOYSA-N, MENTHYL BENZOATE, (5-methyl-2-propan-2-ylcyclohexyl) benzoate, (-)-Menthyl benzoate, 58641-29-5, 6284-35-1, menthylbenzoat, benzoic acid,(-)-menthyl ester, Cyclohexanol, 5-methyl-2-(1-methylethyl)-, 1-benzoate, (1R,2S,5R)-rel-, Cyclohexanol, 5-methyl-2-(1-methylethyl)-, benzoate, (1R,2S,5R)-rel-, 38649-18-2, EINECS 228-505-3, EINECS 261-374-0, EINECS 275-706-7, 2-(Isopropyl)-5-methylcyclohexyl benzoate, 2-5-methylcyclohexylbenzoate, AC1L3R22, AC1Q60U6, SCHEMBL3885473, CTK5B6321, Benzoic acid, (-)-menthyl ester, Benzoic acid p-menthane-3-yl ester, (1S-(1alpha,2beta,5alpha))-2-(Isopropyl)-5-methylcyclohexyl benzoate, Cyclohexanol, 5-methyl-2-(1-methylethyl)-, benzoate, [1R-(1.alpha.,2.beta.,5.alpha.)]-, 2-Isopropyl-5-methylcyclohexyl benzoate #, (2-isopropyl-5-methyl-cyclohexyl) benzoate, Cyclohexanol,5-methyl-2-(1-methylethyl)-, 1-benzoate, (1R,2S,5R)-


ID: 2170

chemical graph of compound 2170



InChIKey: TTZDOBVWBQXGDC-KPKJPENVSA-N
SMILES: C1=CC=C2C(=C1)C(=CN2)/C=C(\C#N)/C(=O)C3=CC(=C(C=C3)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5329275
synonyms found at PubChem are:
Tyrphostin AG 808, NSC650934, AG-808, (E)-2-(3,4-dihydroxybenzoyl)-3-(1H-indol-3-yl)prop-2-enenitrile, Tryphostin AG 808, Tyrphostin AG-808, AC1NS6FZ, AC1Q4QHJ, Lopac-T-5318, Lopac0_001178, CHEMBL68534, Indole-Containing Inhibitor 5, BDBM5171, Tyrphostin AG 808, >=98%, ZINC3927328, IN1964, CCG-205252, NSC-650934, 2-Propenenitrile,4-dihydroxy- benzoyl)-, NCGC00016030-01, NCGC00016030-02, NCGC00016030-03, NCGC00016030-04, NCGC00094433-01, NCGC00094433-02, EU-0101178, T 5318, SR-01000076162, SR-01000076162-1, 2-(3,4-Dihydroxybenzoyl)-3-(1H-indol-3-yl)acrylonitrile, 2-Propenenitrile, 3-(1H-indol-3-yl)-2-(3,4-dihydroxy- benzoyl)-, 2-Cyano-3-(3',4'-dihydroxyphenyl)-1-(3"-indolyl)-3-oxo-1-propene, (2E)-2-[(3,4-dihydroxyphenyl)carbonyl]-3-(1H-indol-3-yl)prop-2-enenitrile, 2-Cyano-3-(3 inverted exclamation marka,4 inverted exclamation marka-dihydroxyphenyl)-1-(3 inverted exclamation marka-indolyl)-3-oxo-1-propene


ID: 2171

chemical graph of compound 2171



InChIKey: TUCIOBMMDDOEMM-RIYZIHGNSA-N
SMILES: C1=CC=C(C=C1)CNC(=O)/C(=C/C2=CC(=C(C=C2)O)O)/C#N

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5328779
synonyms found at PubChem are:
AG-490, 133550-30-8, Tyrphostin B42, AG 490, Tyrphostin AG 490, AG490, (E)-N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)acrylamide, Tyrphostin AG490, tyrphostin AG-490, alpha-Cyano-(3,4-dihydroxy)-N-benzylcinnamide, AG-490 (Tyrphostin B42), N-Benzyl-2-cyano-3-(3,4-dihydroxyphenyl)acrylamide, (2E)-N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide, 134036-52-5, CHEMBL56543, (E)-N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enamide, (2E)-2-CYANO-3-(3,4-DIHYDROXYPHENYL)-N-(PHENYLMETHYL)-2-PROPENAMIDE, (E)-2-CYANO-3-(3,4-DIHYDROPHENYL)-N-(PHENYLMETHYL)-2-PROPENAMIDE, 2-PROPENAMIDE, 2-CYANO-3-(3,4-DIHYDROXYPHENYL)-N-(PHENYLMETHYL)-, (2E)-, SMR001230665, SR-01000076153, 2-Cyano-3-(3,4-dihydroxyphenyl)-N-(phenylmethyl)-2-propenamide, n-benzyl-3,4-dihydroxy-benzylidenecyanoacetamide, Tyrphostin,AG490, N-Benzyl-3,4-dihydroxy-alpha-cyanocinnamide, Tocris-0414, Tyrphostin deriv. 42, AC1NS5BM, BiomolKI_000025, Lopac-T-3434, BiomolKI2_000033, D0FY0R, D0GZ7B, Tyrphostin AG 490, solid, Lopac0_001166, SCHEMBL93682, BMK1-D1, BSPBio_001396, MLS002153172, MLS006011256, BDBM4313, GTPL5916, DTXSID5040960, NOCAS_40960, AOB6474, EX-A118, EX-A464, CHEBI:131968, MolPort-001-761-274, BCPP000424, HMS1361F18, HMS1791F18, HMS1989F18, HMS2231N13, HMS3229M15, HMS3402F18, ZINC2557947, ABP000823, AG-490/AG490, EI-272, s1143, SBB063097, AKOS015888137, BCP9000246, CCG-100629, CS-0108, LP01166, QC-8950, RL01530, IDI1_033866, SMP2_000154, NCGC00016014-01, NCGC00016014-02, NCGC00016014-03, NCGC00016014-04, NCGC00016014-05, NCGC00016014-06, NCGC00016014-07, NCGC00016014-09, NCGC00016014-10, NCGC00024576-01, NCGC00024576-02, NCGC00024576-03, NCGC00024576-04, NCGC00024576-05, NCGC00024576-06, 4CA-0122, 4CA-0125, AJ-40079, AN-16810, HY-12000, KB-02554, KB-276503, RT-016167, EU-0101166, X7479, S-7697, T 3434, alpha-Cyano-(3,4-dihydroxy)-N-benzylcinnamamide, C-18451, I01-0327, J-500741, SR-01000076153-1, SR-01000076153-3, BRD-K47105409-001-05-3, (2E)-N-benzyl-2-cyano-3-(3,4-dihydroxyphenyl)acrylamide, AG-490 , 133550-30-8, (2E)-3-(3,4-dihydroxyphenyl)-2-cyano-N-benzylprop-2-enamide, 2-Propenamide,2-cyano-3-(3,4-dihydroxyphenyl)-N-(phenylmethyl)-, (E)-2-CYANO-3-(3,4-DIHYDROXYPHENYL)-N-(PHENYLMETHYL)-2-PROPENAMIDE


ID: 2172

chemical graph of compound 2172



InChIKey: TUEJFGFQYKDAPM-UHFFFAOYSA-N
SMILES: CC1=CC=C(C=C1)N(CC2=NCCN2)C3=CC(=CC=C3)O.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 657359
synonyms found at PubChem are:
AC1LCWEY, 3-[N-(4,5-dihydro-1H-imidazol-2-ylmethyl)-4-methylanilino]phenol; hydron; chloride, Phentolamine hydrochloride, 73-05-2, Phentolamine HCl, Regitine hydrochloride, UNII-86DRW83R1H, Phentolamine hydrochloride [USP], MLS000028589, 86DRW83R1H, SMR000058252, 3-(((4,5-dihydro-1H-imidazol-2-yl)methyl)(p-tolyl)amino)phenol hydrochloride, C-7337, 50-60-2 (Parent), 2-[N-(3-Hydroxyphenyl)-p-toluidinomethyl]-2-imidazolidine hydrochloride, SR-01000000055, 3-[N-(4,5-dihydro-1H-imidazol-2-ylmethyl)-4-methylanilino]phenol;hydrochloride, Prestwick_386, AC1NWARQ, Opera_ID_1231, MLS001077339, SCHEMBL293522, SPECTRUM1500691, CHEMBL1204146, CTK8G2356, AOB5786, DTXSID40223271, MolPort-003-666-320, HMS1568N21, HMS1921E06, Pharmakon1600-01500691, GP4101, MFCD00079268, NSC757431, AKOS024282662, CCG-212878, MCULE-4568922009, NSC-757431, NCGC00094835-01, NCGC00094835-02, NCGC00094835-03, NCGC00094835-04, AS-16924, ST057378, FT-0673687, 073P052, C-54950, Phentolamine hydrochloride, >=98% (TLC), powder, SR-01000000055-11, 2-[N-(m-Hydroxyphenyl)-p-toluidinomethyl]imidazoline Hydrochloride, 3-[(2-imidazolin-2-ylmethyl)(4-methylphenyl)amino]phenol, chloride, 3-[[(4,5-Dihydro-1H-imidazol-2-yl)methyl](4-methylphenyl)amino]-phenol Hydrochloride, 3-[N-(4,5-dihydro-1H-imidazol-2-ylmethyl)-4-methylanilino]phenol hydrochloride, 3-[N-(4,5-dihydro-1H-imidazol-2-ylmethyl)-4-methylanilino]phenol,hydrochloride, Phenol, m-(N-(2-imidazolin-2-ylmethyl)-p-toluidino)-, monohydrochloride (8CI), Phentolamine hydrochloride, United States Pharmacopeia (USP) Reference Standard


ID: 2173

chemical graph of compound 2173



InChIKey: TUIXDPUEMQXVHO-UHFFFAOYSA-N
SMILES: CCCCNC1=C2C=NN(C2=NC(=C1C(=O)OCC)C)CC.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 24871267
synonyms found at PubChem are:
Tracazolate hydrochloride, 1135210-68-2, DSSTox_CID_25208, DSSTox_RID_80751, DSSTox_GSID_45208, CAS-NOCAS_45208, SR-01000075239, NCGC00015985-03, SCHEMBL1061780, CHEMBL2356666, DTXSID0045208, NOCAS_45208, MolPort-023-276-135, HMS1571C13, Tox21_110273, AKOS024456664, Tox21_110273_1, CCG-220976, ICI 136753, NCGC00015985-08, NCGC00180921-01, B6790, J-002976, SR-01000075239-3, SR-01000075239-6, 4-(Butylamino)-1-ethyl-6-methyl-1H-pyrazolo[3,4-b] pyridine-5-carboxylic acid ethyl ester, ethyl 4-(butylamino)-1-ethyl-6-methyl-1H-pyrazolo[3,4-b]pyridine-5-carboxylate hydrochloride


ID: 2174

chemical graph of compound 2174



InChIKey: TUODPMGCCJSJRH-KWQFWETISA-N
SMILES: C1=CC(=CC=C1C[C@]([C@H](C(=O)O)O)(C(=O)O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6710641
synonyms found at PubChem are:
Piscidic acid, 35388-57-9, Spectrum_000571, AC1O8JTL, Spectrum2_000207, Spectrum3_000180, Spectrum4_001498, Spectrum5_000235, BSPBio_001679, KBioGR_002135, KBioSS_001051, SPECTRUM200427, SPBio_000193, CHEMBL3039078, KBio2_001051, KBio2_003619, KBio2_006187, KBio3_001179, CCG-38411, SDCCGMLS-0066424.P001, NCGC00179095-01, (2S,3R)-2,3-dihydroxy-2-[(4-hydroxyphenyl)methyl]butanedioic acid


ID: 2175

chemical graph of compound 2175



InChIKey: TVUWMSBGMVAHSJ-UHFFFAOYSA-N
SMILES: CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)O)NC(=O)CN

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 4433883
synonyms found at PubChem are:
glycylleucylphenylalanine, AC1NAWNO, Spectrum2_001495, Spectrum3_001936, BSPBio_003536, SPECTRUM1502212, SPBio_001509, SCHEMBL4281369, KBio3_002793, CCG-39208, NCGC00095874-01, NCGC00095874-02, 2-[2-(2-aminoacetamido)-4-methylpentanamido]-3-phenylpropanoic acid, 2-[[2-[(2-aminoacetyl)amino]-4-methylpentanoyl]amino]-3-phenylpropanoic acid


ID: 2176

chemical graph of compound 2176



InChIKey: TWIIVLKQFJBFPW-UHFFFAOYSA-N
SMILES: CC(=O)NC1=CC=C(C=C1)OC(=O)C2=CC=CC=C2O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 1984
synonyms found at PubChem are:
acetaminosalol, Phenetsal, Salophen, 118-57-0, UNII-O3J7H54KMD, p-Acetamidophenyl salicylate, 4-Acetamidophenyl salicylate, O3J7H54KMD, 4'-Hydroxyacetanilide salicylate, 4-(Acetylamino)phenyl salicylate, 4-acetamidophenyl 2-hydroxybenzoate, (4-acetamidophenyl) 2-hydroxybenzoate, NCGC00094917-01, Acetaminosalolo, Acetaminosalolum, Acetaminosalolo [DCIT], Acetaminosalol [INN:DCF], 4-Acetylaminophenyl salicylat, Asalphen, Cetosal, Cetosalol, Phenestal, Phenosol, Salofena, Acetaminosalolum [INN-Latin], 4-Hydroxyacetanilide salicylate, EINECS 204-261-3, Spectrum_000157, AC1L1CNZ, AC1Q1KYS, Spectrum2_001431, Spectrum3_000936, Spectrum4_001035, Spectrum5_001149, 4-Acetaminophenylsalicylate, DSSTox_CID_25865, DSSTox_RID_81185, 2-hydroxybenzoic acid 4-(acetylamino)phenyl ester, DSSTox_GSID_45865, SCHEMBL25220, Acetyl-p-aminophenylsalicylate, KBioGR_001589, KBioSS_000637, p-Acetylaminophenyl salicylate, ZINC865, CHEMBL92590, DivK1c_000629, SPECTRUM1501170, SPBio_001562, DTXSID7045865, CTK8G6514, HMS501P11, KBio1_000629, KBio2_000637, KBio2_003205, KBio2_005773, KBio3_001972, CHEBI:135115, NINDS_000629, TWIIVLKQFJBFPW-UHFFFAOYSA-N, HMS1921L21, Pharmakon1600-01501170, 4-(Acetylamino)phenyl salicylate #, Tox21_111357, CCG-38983, NSC757877, AKOS022179581, MCULE-9919200539, NSC-757877, IDI1_000629, Salicylic acid p-acetylaminophenyl ester, NCGC00094917-02, AJ-07928, CAS-118-57-0, ZB000191, SBI-0051670.P002, 4-ACETYLAMINOPHENYL-2-HYDROXYBENZOATE, AB00052232_02, Salicylic acid, ester with 4'-hydroxyacetanilide, SR-01000872767, SR-01000872767-1, 2-Hydroxybenzoic acid, 4-(acetylamino)phenyl-, ester, BRD-K58464880-001-02-5, Benzoic acid, 2-hydroxy-, 4-(acetylamino)phenyl ester


ID: 2177

chemical graph of compound 2177



InChIKey: TXCGAZHTZHNUAI-UHFFFAOYSA-N
SMILES: CC(C)(C(=O)O)OC1=CC=C(C=C1)Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 2797
synonyms found at PubChem are:
clofibric acid, 882-09-7, 2-(4-Chlorophenoxy)-2-methylpropanoic acid, Chlorofibrinic acid, Clofibrinic acid, Chlorfibrinic acid, Clofibrin, Chlorophibrinic acid, PCIB, 2-(4-CHLOROPHENOXY)-2-METHYLPROPIONIC ACID, Clofibrate free acid, Clofibrinsaeure, Regadrin, Regulipid, PCPIB, 2-(p-Chlorophenoxy)-2-methylpropionic acid, 2-(4-Chlorophenoxy)isobutyric Acid, 4-CPIB, 2-(p-Chlorophenoxy)isobutyric acid, Propanoic acid, 2-(4-chlorophenoxy)-2-methyl-, Fibrates, alpha-(p-Chlorophenoxy)isobutyric acid, Acido clofibrico, Acide clofibrique, Acidum clofibricum, Acidum chlorphibricum, NSC 1149, NSC-1149, p-Chlorophenoxyisobutyric Acid, Clofibrinsaeure [German], Acetic acid, (p-chlorophenoxy)dimethyl-, Clofibric acid [INN:DCF], p-(2,4-Chlorophenoxy)isobutyric acid, (Chlorophenoxy)isobutyric acid, Acide (p-chlorophenoxy)-2 methyl-2 propionique, Propionic acid, 2-(p-chlorophenoxy)-2-methyl-, alpha-(4-Chlorophenoxy)-alpha-methylpropionic acid, Acide clofibrique [INN-French], Acido clofibrico [INN-Spanish], Acidum clofibricum [INN-Latin], UNII-53PF01Q249, EINECS 212-925-9, CHEMBL683, alpha-(4-Chlorophenoxy)isobutyric acid, BRN 1874067, 4-(Chlorophenoxy)isobutyric acid (VAN), C10H11ClO3, (p-Chlorophenoxy)isobutyric acid, 4-(Chlorophenoxy)isobutyric acid, CHEBI:34648, TXCGAZHTZHNUAI-UHFFFAOYSA-N, 53PF01Q249, Acide (p-chlorophenoxy)-2 methyl-2 propionique [French], NCGC00016547-06, .alpha.-(4-Chlorophenoxy)isobutyric acid, .alpha.-(p-Chlorophenoxy)isobutyric acid, 2-(4-chlorophenoxy)-2-methylpropionic acid (clofibric acid), CAS-882-09-7, 2-(p-Chlorophenoxy)-2-methylpropanoic acid, 2-(p-Chlorophenoxy)-2-methyl-propionic acid, DSSTox_CID_20661, DSSTox_RID_79526, DSSTox_GSID_40661, .alpha.-(4-Chlorophenoxy)-.alpha.-methylpropionic acid, SMR000677911, SR-01000597447, p-Chlorophenoxyisobutyrate, Clofibrate Acid, clofibrilic acid, CCRIS 9254, 4-Chlorophenoxy-iso-butyrcc Acid, NSC1149, Prestwick_39, Clofibric acid (INN), Spectrum_000160, Tocris-0825, ACMC-1BKDT, AC1L1EHN, Prestwick0_000783, Prestwick1_000783, Prestwick2_000783, Prestwick3_000783, Spectrum2_000157, Spectrum3_000356, Spectrum4_000293, Spectrum5_001569, Spectrum5_001985, D06RRD, alpha-(4-(Chlorphenoxy)-2-methylpropionsaeure, AC1Q1NP3, BSPBio_000886, BSPBio_002051, KBioGR_000846, KBioSS_000640, KSC448C8J, MLS001183705, MLS001336023, MLS001336024, MLS002153998, DivK1c_000226, SCHEMBL102826, SPECTRUM1500195, SPBio_000294, SPBio_002825, BPBio1_000976, ZINC1187, DTXSID1040661, p-chloro phenoxy isobutyric acid, BDBM28699, CTK3E8184, HMS500L08, KBio1_000226, KBio2_000640, KBio2_003208, KBio2_005776, KBio3_001271, KS-00000CDD, MolPort-000-146-057, NINDS_000226, 2-(4-Chlorophenoxy)isobutyricAcid, HMS1570M08, HMS1920O17, HMS2097M08, HMS2236F05, HMS3266H12, HMS3373E14, HMS3652B13, HMS3714M08, Pharmakon1600-01500195, ALBB-000895, BCP13968, HY-B1415, 2-(p-chlorophenoxy) isobutyric acid, Tox21_110486, Tox21_301680, ANW-38964, BBL009445, CCG-38959, MFCD00004192, NSC756697, s4207, SBB008306, STK141126, AKOS000109304, p-chlorophenoxy-2-methylpropionic acid, Tox21_110486_1, CS-4700, FR-1202, HS-0042, MCULE-3964453066, NSC-756697, RP17511, TRA0093832, VA10614, IDI1_000226, NCGC00016547-01, NCGC00016547-02, NCGC00016547-03, NCGC00016547-04, NCGC00016547-05, NCGC00016547-08, NCGC00024807-01, NCGC00024807-02, NCGC00024807-03, NCGC00024807-04, NCGC00024807-05, NCGC00255701-01, AC-15616, AJ-07972, AN-47918, K985, KB-87740, SBI-0051317.P002, 2-methyl-2-(4-chlorophenoxy)propionic acid, AB1002065, LS-124569, TR-027683, AB00051950, BB 0244890, Clofibric acid, analytical reference material, FT-0623988, R1093, ST24021771, ST50308320, 2-(4-chlorophenoxy)-2-methyl-propanoic acid, 2-(4-chlorophenoxy)-2-methyl-propionic acid, 2-(p-chloro-phenoxy)-2-methyl-propionic acid, 2-(p-Chlorophenoxy)-2-methyl- propionic acid, 2-(4-Chloro-phenoxy)-2-methyl-propionic acid, C13700, D07723, 2-(4-Chloro-phenoxy)-2-methyl-propionic acid, AB00051950_08, AB00051950_09, 2-(p-Chlorophenoxy)-2-methylpropionic acid, 97%, AS-871/13465032, Propanoic acid, 2-methyl, 2-(4-chlorophenyloxy), I01-1841, SR-01000597447-1, SR-01000597447-2, SR-01000597447-5, SR-01000597447-6, W-100413, BRD-K19111024-001-05-0, BRD-K19111024-001-10-0, BRD-K19111024-001-17-5, 2-(4-Chlorophenoxy)-2-methylpropionic acid (Clofibric acid) 10 microg/mL in Acetonitrile


ID: 2178

chemical graph of compound 2178



InChIKey: TXDUTHBFYKGSAH-SFHVURJKSA-N
SMILES: CN1[C@@H]2C3=C(CCN2C(=O)C4=CC=CC=C41)C5=CC=CC=C5N3

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 442088
synonyms found at PubChem are:
Evodiamine, 518-17-2, (+)-Evodiamine, UNII-C01825BVNL, Evodiamine, Evodia rutaecarpa, d-Evodiamine, C01825BVNL, CHEBI:4948, Evodiamine, (+)-, Q-100579, C19H17N3O, (S)-14-methyl-8,13,13b,14-tetrahydroindolo[2',3':3,4]pyrido[2,1-b]quinazolin-5(7H)-one, PubChem18244, Indolo[2',3':3,4]pyrido[2,1-b]quinazolin-5(7H)-one, 8,13,13b,14-tetrahydro-14-methyl-, (13bS)-, AC1L9C8E, Evodiamine,(S), (13bS)-14-methyl-8,13,13b,14-tetrahydroindolo[2',3':3,4]pyrido[2,1-b]quinazolin-5(7H)-one, Evodiamine(Isoevodiamine)/, KSC270Q0P, MLS006011787, SCHEMBL682158, CHEMBL463165, CTK1H0807, MolPort-005-910-652, ZINC898159, BCP02282, HY-N0114, Indol(2',3':3,4)pyrido(2,1-b)quinazolin-5(7H)-one, 8,13,13b,14-tetrahydro-14-methyl-, (13bS)-, Indol(2',3':3,4)pyrido(2,1-b)quinazolin-5(7H)-one, 8,13,13b,14-tetrahydro-14-methyl-, (S)-, ABP000693, BBL033833, MFCD06407824, STK801981, AKOS005622478, CS-6161, MCULE-2788564607, CJ-04510, SC-16015, SMR001934404, FT-0651829, N1600, C09187, 518E172, Evodiamine, European Pharmacopoeia (EP) Reference Standard, (S)-14-methyl-7,8,13b,14-tetrahydroindolo[2',3':3,4]pyrido[2,1-b]quinazolin-5(13H)-one


ID: 2179

chemical graph of compound 2179



InChIKey: TYBARJRCFHUHSN-DMJRSANLSA-N
SMILES: C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@H]2C[C@H]([C@@]3([C@@H]4[C@@H](CC[C@@]3(C2)O)[C@]5(CC[C@@H]([C@]5(C[C@H]4O)C)C6=CC(=O)OC6)O)CO)O)O)O)O.O.O.O.O.O.O.O.O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6364534
synonyms found at PubChem are:
Ouabain octahydrate, 11018-89-6, Ouabain (Octahydrate), UNII-1K0J875G48, Strophantine octahydrate, Quabain octahydrate, 1K0J875G48, 630-60-4, Ouabain [USP], penta[a]phenanthren-17-yl]-2H-furan-5-one;octahydrate, 3-[(1R,3S,5S,8R,9S,10R,11R,13R,14S,17R)-1,5,11,14-tetrahydroxy-10-(hydroxymethyl)-13-methyl-3-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclo, Prestwick_370, C29H44O12.8H2O, AC1O4BRT, Acocantherine;G-Strophanthin, CHEMBL1889436, DTXSID7040730, MolPort-035-395-749, TYBARJRCFHUHSN-DMJRSANLSA-N, HMS1569O04, HMS2096O04, Card-20(22)-enolide, 3-((6-deoxy-alpha-L-mannopyranosyl)oxy)-1,5,11,14,19-pentahydroxy-, octahydrate, (1beta,3beta,5beta,11alpha)-, HY-B0542, 6779AF, MFCD00149240, s4016, CS-2642, NCGC00017394-06, NCGC00094248-05, AB0109331, Ouabain octahydrate, >=95% (HPLC), powder, SR-01000076047-6, Ouabain, European Pharmacopoeia (EP) Reference Standard, 1|A,3|A,5|A,11|A,14,19-Hexahydroxycard-20(22)-enolide 3-(6-deoxy-|A-L-mannopyranoside), 1320-52-1, 1beta,3beta,5beta,11alpha,14,19-Hexahydroxycard-20(22)-enolide 3-(6-deoxy-alpha-L-mannopyranoside), 3-[(1R,3S,5S,8R,9S,10R,11R,13R,14S,17R)-1,5,11,14-tetrahydroxy-10-(hydroxymethyl)-13-methyl-3-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2H-furan-5-one octahydrate


ID: 2180

chemical graph of compound 2180



InChIKey: TYIRELDXFZWDBV-UHFFFAOYSA-N
SMILES: C1CCCC(CCC1)C(CN)O.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 11957507
synonyms found at PubChem are:
2-Cyclooctyl-2-hydroxyethylamine hydrochloride, CHEMBL1204148, 57559-31-6, CONH hydrochloride, EU-0100342, SCHEMBL160732, Tox21_500342, CCG-221646, LP00342, NCGC00093780-01, NCGC00261027-01, C-108, SR-01000075602, SR-01000075602-1, 2-CYCLOOCTYL-2-HYDROXYETHYLAMINE HYDRO-C HLORIDE (CONH)


ID: 2181

chemical graph of compound 2181



InChIKey: TYNLGDBUJLVSMA-UHFFFAOYSA-N
SMILES: CC(=O)OC1=CC=CC2=C1C(=O)C3=C(C=C(C=C3C2=O)C(=O)O)OC(=O)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 26248
synonyms found at PubChem are:
Diacerein, 13739-02-1, Diacetylrhein, Diacerhein, Artrodar, Fisiodar, 1,8-DIACETOXY-3-CARBOXYANTHRAQUINONE, 4,5-Diacetylrhein, DIACERIN, Diacerein [INN], Diacereine [French], Diacereinum [Latin], Diacereina [Spanish], UNII-4HU6J11EL5, SF-277, C19H12O8, EINECS 237-310-2, BRN 2184909, 4,5-diacetyloxy-9,10-dioxoanthracene-2-carboxylic acid, MLS000028577, 4HU6J11EL5, 1,8-Diacetoxyanthraquinone-3-carboxylic acid, Diacerein (INN), 4,5-diacetyloxy-9,10-dioxo-2-anthracenecarboxylic acid, NCGC00018274-04, SMR000058958, 4,5-Diacetoxy-9,10-dihydro-9,10-dioxo-2-anthrylcarbonsaeure, 9,10-Dihydro-4,5-diacetoxy-9,10-2-anthracenecarboxylic acid, 4,5-diacetoxy-9,10-dioxo-9,10-dihydroanthracene-2-carboxylic acid, 9,10-Dihydro-4,5-dihydroxy-9,10-dioxo-2-anthroic acid diacetate, 4,5-Diacetoxyanthraquinone-2-carboxylic Acid, DSSTox_CID_25636, DSSTox_RID_81017, DSSTox_GSID_45636, W-108237, 4,5-diacetoxy-9,10-diketo-anthracene-2-carboxylic acid, Diacereina, Diacereine, Diacereinum, 4,5-diacetyloxy-9,10-bis(oxidanylidene)anthracene-2-carboxylic acid, 9,10-Dihydro-4,5-dihydroxy-9,10-dioxo-2-anthroic acid, diacetate, 2-ANTHROIC ACID, 9,10-DIHYDRO-4,5-DIHYDROXY-9,10-DIOXO-, DIACETATE, CAS-13739-02-1, SR-01000003156, Rhein, diacetate (6CI), Gesamtmatrix, ART 50, 4,5-bis(acetyloxy)-9,10-dioxo-9,10-dihydroanthracene-2-carboxylic acid, Rhein, diacetate, Zondar (TN), Spectrum_001876, SpecPlus_000643, AC1L1AQI, Spectrum2_000823, Spectrum3_000937, Spectrum4_001036, Spectrum5_001819, D0N1FS, 2-Anthracenecarboxylic acid, 4,5-bis(acetyloxy)-9,10-dihydro-9,10-dioxo-, AC1Q62EV, SCHEMBL25784, KBioGR_001591, KBioSS_002400, 3-10-00-04790 (Beilstein Handbook Reference), cid_26248, CHEMBL41286, DivK1c_006739, SPECTRUM1502010, SPBio_000745, Diacerein, >=95% (HPLC), DTXSID4045636, BDBM32018, CHEBI:94708, KBio1_001683, KBio2_002395, KBio2_004963, KBio2_007531, KBio3_001974, MolPort-003-666-392, TYNLGDBUJLVSMA-UHFFFAOYSA-N, HMS3652D06, HMS3714B20, Pharmakon1600-01502010, BCP10834, HY-N0283, ZINC3812842, Tox21_110856, BBL011075, CCG-40287, CD0145, MFCD00468030, NSC758147, s4267, SF 277, STK802271, 4,5-Bis(acetyloxy)-9,10-dihydro-9,10-dioxo-2-anthracenecarboxylic Acid, AKOS005622705, Tox21_110856_1, AN-5359, API0024493, CS-2880, DB11994, KS-5088, KW-4800, MCULE-3526700960, NSC-758147, KS-00000L24, NCGC00018274-01, NCGC00018274-02, NCGC00018274-03, NCGC00018274-05, NCGC00022114-03, AK468692, AM807992, CC-26418, LS-20737, SC-45485, SBI-0052833.P002, AB0012779, TL8000865, B1726, D4061, FT-0603096, D07270, K-4431, AB00053327_14, 739D021, A807252, C-21076, I06-0338, SR-01000003156-2, SR-01000003156-3, SR-01000003156-4, 4,5-diacetoxy-9,10-dioxo-anthracene-2-carboxylic acid, Diacerein, European Pharmacopoeia (EP) Reference Standard, 4,5-diacetoxy-9,10-dihydro-9,10-dioxoanthracene-2-carboxylic acid, 4,5-bis(acetoxy)-9,10-dihydro-9,10-dioxo-2-anthracenecarboxylic acid, 2-Anthracenecarboxylic acid, 4,5-bis(acetyloxy)-9,10-dihydro-9,10-dioxo- (9CI)


ID: 2182

chemical graph of compound 2182



InChIKey: TYNQWWGVEGFKRU-AJDPQWBVSA-N
SMILES: C[C@H]1CC[C@@H]2[C@H]([C@H]3[C@@H](N2C1)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC=C6[C@@]5(CC[C@@H](C6)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O[C@H]8[C@@H]([C@@H]([C@H]([C@@H](O8)C)O)O)O)O)O[C@H]9[C@@H]([C@@H]([C@H]([C@@H](O9)C)O)O)O)C)C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 442971
synonyms found at PubChem are:
alpha-Chaconine, Chaconine, UNII-5QOL0LIM81, 5QOL0LIM81, 20562-03-2, CCRIS 6509, BRN 0077396, AC1L9DRN, 4-21-00-01401 (Beilstein Handbook Reference), CHEBI:10219, MolPort-044-754-049, alpha-Chaconine from potato sprouts, beta-D-Glucopyranoside, (3beta)-solanid-5-en-3-yl O-6-deoxy-alpha-L-mannopyranosyl-(1-2)-O-(6-deoxy-alpha-L-mannopyranosyl-(1-4))-, C10796, UNII-3FYV8328OK component TYNQWWGVEGFKRU-AJDPQWBVSA-N


ID: 2183

chemical graph of compound 2183



InChIKey: TYXAKMAAZJJHCB-XMTFNYHQSA-N
SMILES: CCCCCCCCCCCCN1C[C@@H]([C@H]([C@@H]([C@H]1CO)O)O)O

biological descriptors:

CFTR relevance: CFTR corrector

Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown

reference list:

"S Thibaudeau" "A Kato" "F Becq" "J Désiré" "P Parenti" "A Mingot" "M Forcella" "V Cendret" "J Bertrand" "T Legigan" "Y Blériot" "C Norez" "I Adachi"


CID is 9818954
synonyms found at PubChem are:
N-dodecyldeoxynojirimycin, N-DODECYL-1-DEOXYNOJIRIMYCIN, CHEMBL450985, 79206-22-7, DTXSID20431312, BDBM50242628, ZINC44351037, N-Dodecyl-1-deoxynojirimycin, >=98.0% (TLC), W-203810


ID: 2184

chemical graph of compound 2184



InChIKey: TYYBFXNZMFNZJT-UHFFFAOYSA-N
SMILES: CC(=O)N(C)C1=C(C(=C(C(=C1I)C(=O)NCC(=O)NC2=C(C(=C(C(=C2I)C(=O)O)I)C(=O)NCCO)I)I)C(=O)NC)I

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3742
synonyms found at PubChem are:
ioxaglic acid, Ioxaglate, Hexabrix 160, 59017-64-0, Acido ioxaglico, Acide ioxaglique, Acidum ioxaglicum, UNII-Z40X7EI2AF, P 286 (Contrast medium), Acide ioxaglique [INN-French], Acido ioxaglico [INN-Spanish], Acidum ioxaglicum [INN-Latin], EINECS 261-560-1, Z40X7EI2AF, N-(2-Hydroxyethyl)-2,4,6-triiodo-5-(2-(2,4,6-triiodo-3-(N-methylacetamido)-5-(methylcarbamoyl)benzamido)acetamido)isophthalamic acid, P 286, CHEBI:31718, 3-[(N-{3-[acetyl(methyl)amino]-2,4,6-triiodo-5-(methylcarbamoyl)benzoyl}glycyl)amino]-5-[(2-hydroxyethyl)carbamoyl]-2,4,6-triiodobenzoic acid, NCGC00016886-01, CAS-59017-64-0, Benzoic acid, 3-((((3-(acetylmethylamino)-2,4,6-triiodo-5-((methylamino)carbonyl)benzoyl)amino)acetyl)amino)-5-(((2-hydroxyethyl)amino)carbonyl)-2,4,6-triiodo-, HSDB 8077, Ioxaglic acid [USAN:BAN:INN:JAN], Ioxaglic acid [USAN:USP:INN:BAN:JAN], AC1L1GLZ, Hexabrix 320 (TN), Prestwick0_001062, Prestwick1_001062, Prestwick2_001062, Prestwick3_001062, DSSTox_CID_3166, D0X7IT, DSSTox_RID_76899, DSSTox_GSID_23166, SCHEMBL38073, BSPBio_001044, MLS002154135, SPBio_002962, AC1Q5M04, BPBio1_001150, Ioxaglic acid (JAN/USP/INN), CHEMBL1201291, DTXSID5023166, HMS1571E06, HMS2098E06, HMS2234I18, HMS3371K01, HMS3715E06, IOXAGLIC ACID (100 MG), Tox21_110664, CCG-221062, DB09313, NCGC00016886-02, 67992-58-9 (mono-hydrochloride salt), LS-35517, SMR001233442, AB00514026, FT-0627285, D01761, SR-01000841818, SR-01000841818-2, W-111165, BRD-K79124250-001-03-0, 3-[[2-[[3-[acetyl(methyl)amino]-2,4,6-triiodo-5-(methylcarbamoyl)benzoyl]amino]acetyl]amino]-5-(2-hydroxyethylcarbamoyl)-2,4,6-triiodobenzoic acid, 3-{[N-({3-[acetyl(methyl)amino]-2,4,6-triiodo-5-[(methylamino)carbonyl]phenyl}carbonyl)glycyl]amino}-5-{[(2-hydroxyethyl)amino]carbonyl}-2,4,6-triiodobenzoic acid


ID: 2185

chemical graph of compound 2185



InChIKey: TZGJSWWPNARXQC-UHFFFAOYSA-N
SMILES: CC1=CC(=C2C=C(C(=NC2=C1)NCCNC(=O)C3=CC(=CC=C3)OC)C#N)C

biological descriptors:

CFTR relevance: CFTR Corrector and Potentiator

Category:
Influence on CFTR function enhances CFTR function
Order of interaction binds to CFTR
subcellular compartment Apical membrane & subapical compartment

reference list:

"GL Lukacs" "PW Phuan" "AB Wood" "JM Knapp" "MJ Kurth" "B Yang" "AS Verkman"


CID is 3224090
synonyms found at PubChem are:
ASN 06744166, 606101-83-1, N-(2-((3-Cyano-5,7-dimethylquinolin-2-yl)amino)ethyl)-3-methoxybenzamide, N-[2-[(3-cyano-5,7-dimethylquinolin-2-yl)amino]ethyl]-3-methoxybenzamide, AC1MLOXC, CoPo 22, MLS003674353, CHEMBL2018574, SCHEMBL14125564, CTK5B1828, DTXSID70390480, MolPort-000-101-486, TZGJSWWPNARXQC-UHFFFAOYSA-N, HMS1705K09, ZINC19124383, AKOS000688408, NCGC00386637-01, SMR002353823, KB-301130, N-[2-[(3-cyano-5,7-dimethylquinolin-2-yl)amino]ethyl]-3-meth, N-[2-(3-Cyano-5,7-dimethyl-quinolin-2-ylamino)-ethyl]-3-methoxy-benzamide, N-{2-[(3-Cyano-5,7-dimethyl-2-quinolinyl)amino]ethyl}-3-methoxybenzamide, BENZAMIDE, N-[2-[(3-CYANO-5,7-DIMETHYL-2-QUINOLINYL)AMINO]ETHYL]-3-METHOXY-


ID: 2186

chemical graph of compound 2186



InChIKey: TZJALUIVHRYQQB-XLRXWWTNSA-N
SMILES: C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC2=C(OC3=C(C2=O)C(=CC(=C3CC=C(C)C)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)C5=CC=C(C=C5)OC)O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5318997
synonyms found at PubChem are:
Icariin, 489-32-7, Ieariline, UNII-VNM47R2QSQ, CHEBI:78420, VNM47R2QSQ, Icariine, 3-((6-Deoxymannopyranosyl)oxy)-7-(glucopyranosyloxy)-5-hydroxy-2-(4-methoxyphenyl)-8-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one, 5-hydroxy-2-(4-methoxyphenyl)-8-(3-methylbut-2-en-1-yl)-7-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-3-(((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-4H-chromen-4-one, Icarin, 3-[(6-deoxy-alpha-L-mannopyranosyl)oxy]-5-hydroxy-2-(4-methoxyphenyl)-8-(3-methylbut-2-en-1-yl)-4-oxo-4H-chromen-7-yl beta-D-glucopyranoside, 4H-1-Benzopyran-4-one, 3-((6-deoxy-alpha-L-mannopyranosyl)oxy)-7-(beta-D-glucopyranosyloxy)-5-hydroxy-2-(4-methoxyphenyl)-8-(3-methyl-2-butenyl)-, SMR000466309, Horny goat weed, Icariin;, Epimedium Extract, AC1NSXJE, Spectrum2_001695, Spectrum3_001130, Spectrum4_001975, Spectrum5_000933, Icariin, analytical standard, BSPBio_002599, KBioGR_002475, MLS000759413, MLS001424083, MLS006011789, SCHEMBL312615, SPECTRUM1505257, SPBio_001650, AMBZ0238, CHEMBL553204, Icariin, >=94% (HPLC), KBio3_002099, MolPort-002-507-276, TZJALUIVHRYQQB-XLRXWWTNSA-N, HMS2051J13, HMS2235I20, BCP18807, HY-N0014, ZINC3960893, BBL010487, BDBM50027363, CCG-38780, MFCD00210516, STK801622, AKOS005614005, AM85785, CCG-100955, CS-3675, DB12052, MCULE-2932284439, NC00205, SDCCGMLS-0066754.P001, NCGC00178583-01, AN-45260, BC216261, CC-29461, CPD000466309, SAM001246560, LS-185785, FT-0603423, N1705, hydro-2H-pyran-2-yl)oxy)-4H-chromen-4-one, C17555, AB00639912-06, 489I327, C-23437, SR-01000759346, Q-100549, SR-01000759346-4, BRD-K65639003-001-02-5, BRD-K65639003-001-05-8, BRD-K65639003-001-09-0, 4'-O-methyl-8-gamma,gamma-dimethylallylkaempferol-3-rhamnoside-7-glucoside, 3,5-dihydroxy-4\'-methoxy-6\'\',6\'\'-dimethyl-4\'\',5\'\'-dihydropyrano[2\'\',3\'\':7,8]-flavone, 3-[(6-Deoxy-alpha-L-mannopyranosyl)oxy]-7-(beta-D-glucopyranosyloxy)-5-hydroxy-2-(4-methoxyphenyl)-8-(3-methyl-2-buten-1-yl)-4H-1-benzopyran-4-one, 5-hydroxy-2-(4-methoxyphenyl)-8-(3-methylbut-2-en-1-yl)-7-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-3-(((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetra, 5-hydroxy-2-(4-methoxyphenyl)-8-(3-methylbut-2-enyl)-7-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yloxy)-3-((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yloxy)-4H-chromen-4-one, 5-hydroxy-2-(4-methoxyphenyl)-8-(3-methylbut-2-enyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one, 5-hydroxy-2-(4-methoxyphenyl)-8-(3-methylbut-2-enyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-chromen-4-one


ID: 2187

chemical graph of compound 2187



InChIKey: TZOICBMBENXHNK-UHFFFAOYSA-N
SMILES: COC1=CC=CC=C1N2CCN(CC2)CCN(C3=CC=CC=N3)C(=O)C4=CC=C(C=C4)F.Cl.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 11957633
synonyms found at PubChem are:
p-MPPF dihydrochloride, 223699-41-0, 4-Fluoro-N-(2-[4-(2-methoxyphenyl)1-piperazinyl]ethyl)-N-(2-pyridinyl)benzamide dihydrochloride, EU-0100825, p-MPPF dihydrochloride, solid, CHEMBL1355634, CTK8E8997, DTXSID50474696, MolPort-003-958-670, Tox21_500825, API0008831, CCG-222129, LP00825, NCGC00094156-01, NCGC00261510-01, ACM223699410, RT-014899, FT-0738512, M-226, SR-01000076021, J-014675, SR-01000076021-1, Benzamide, 4-fluoro-N-[2-[4-(2-methoxyphenyl)-1-piperazinyl]ethyl]-N-2-pyridinyl-, dihydrochloride


ID: 2188

chemical graph of compound 2188



InChIKey: UAHGNXFYLAJDIN-IZZDOVSWSA-N
SMILES: C1=CC=C(C=C1)/C=C/C(=O)C2=CC=C(C=C2)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5282362
synonyms found at PubChem are:
4'-Hydroxychalcone, 2657-25-2, Chalcone, 4'-hydroxy-, 1-(4-hydroxyphenyl)-3-phenylprop-2-en-1-one, (2E)-1-(4-hydroxyphenyl)-3-phenylprop-2-en-1-one, p-Cinnamoylphenol, 2-Benzal-4'-hydroxyacetophenone, hydroxychalcone, 4'-, 2-Propen-1-one, 1-(4-hydroxyphenyl)-3-phenyl-, UNII-2K338K8UOA, 2K338K8UOA, CHEMBL276473, CHEBI:34360, (E)-1-(4-hydroxyphenyl)-3-phenyl-prop-2-en-1-one, (E)-1-(4-hydroxyphenyl)-3-phenylprop-2-en-1-one, NSC-170285, NSC-242264, 38239-52-0, (E)-1-(4-hydroxyphenyl)-3-phenyl-2-propen-1-one, CCRIS 2229, 2-Propen-1-one, 1-(4-hydroxyphenyl)-3-phenyl-, (2E)-, 2-Propen-1-one, 1-(4-hydroxyphenyl)-3-phenyl-, (E)-, NSC 242264, 4'-Hydroxy-cis-chalcone, 4/'-Hydroxychalcone, AC1NQZY4, AC1Q5EBZ, Spectrum5_000333, trans-4'-Hydroxychalcone, (E)-4'-Hydroxychalcone, 4'-Hydroxy-trans-chalcone, 4'-Hydroxychalcone, (E)-, BSPBio_001669, SPECTRUM200407, BIDD:ER0083, 4'-hydroxychalcone, AldrichCPR, DTXSID8022458, MolPort-000-156-317, MolPort-028-750-774, UAHGNXFYLAJDIN-IZZDOVSWSA-N, ZINC4175523, 2-Benzylidene-4'-hydroxyacetophenone, BDBM50042986, CCG-38409, NSC170285, NSC242264, SBB061941, AKOS002234858, SDCCGMLS-0066376.P001, VZ27388, NCGC00095473-01, NCGC00095473-02, NCGC00095473-03, AJ-48212, KB-72563, MS-10593, ST095788, 1-(4-Hydroxy-phenyl)-3-phenyl-propenone, J402.938K, KB-147367, TR-012036, ST24021116, (E)-1-(4-Hydroxy-phenyl)-3-phenyl-propenone, C14232, M-1913, A818515, SR-05000002471, J-016479, SR-05000002471-1, (2E)-1-(4-Hydroxyphenyl)-3-phenyl-2-propen-1-one, BRD-K85068298-001-02-7, BRD-K85068298-001-03-5, I14-30945, (2E)-1-(4-Hydroxyphenyl)-3-phenyl-2-propen-1-one #


ID: 2189

chemical graph of compound 2189



InChIKey: UAIYNMRLUHHRMF-AATRIKPKSA-N
SMILES: CC(/C=C/C1=CC(=CC=C1)OC2=CC=C(C=C2)F)N(C(=O)N)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5353454
synonyms found at PubChem are:
BW B70C, BWB70C, 134470-38-5, BW-B70C, BW-B 70C, CHEMBL86676, CHEBI:75307, (E)-N-(3-(3-(4-Fluorophenoxy)phenyl)-1-(R,S)-methylprop-2-enyl)-N-hydroxyurea, 70C, N-(3-(3-(4-Fluorophenoxy)phenyl)-1-methyl-2-propenyl)-N-hydroxyurea, N-[3-[3-4(-Fluorophenoxy)phenyl]-1-methyl-2-propenyl]-N-hydroxyurea, Urea, N-(3-(3-(4-fluorophenoxy)phenyl)-1-methyl-2-propenyl)-N-hydroxy-, C17H17FN2O3, SR-01000075717, (e)-N-{3-[3-(4-fluorophenoxy)phenyl]-1-(r,s)-methylprop-2-enyl}-N-hydroxyurea, D0HJ1Y, Lopac0_000202, BSPBio_001512, AC1NS484, BW-B-70C, SCHEMBL2681949, SCHEMBL2681955, BCBcMAP01_000006, CHEBI:91765, MolPort-003-940-465, UAIYNMRLUHHRMF-AATRIKPKSA-N, EI304, HMS1361L14, HMS1791L14, HMS1989L14, HMS3260J05, HMS3402L14, Tox21_500202, BDBM50281096, MFCD00890868, N-(3-(3-(4-fluorophenoxy)phenyl)-1-methylprop-2-enyl)-N-hydroxyurea, AKOS024456518, CCG-204297, LP00202, BW B70C, >98% (HPLC), solid, IDI1_033982, NCGC00025102-02, NCGC00025102-03, NCGC00025102-04, NCGC00025102-05, NCGC00025102-06, NCGC00260887-01, LS-160261, RT-011840, EU-0100202, B 4558, J-006544, SR-01000075717-1, SR-01000075717-3, BRD-A55946879-001-02-9, BRD-A68891053-001-01-2, 1-[(E)-4-[3-(4-fluorophenoxy)phenyl]but-3-en-2-yl]-1-hydroxyurea, 1-{(3E)-4-[3-(4-fluorophenoxy)phenyl]but-3-en-2-yl}-1-hydroxyurea, N-[3-[3-(-FLUOROPHENOXY)PHENYL]-1-METHYL-2-PROPENYL]-N-HYDROXYUREA, N-{(2E)-3-[3-(4-fluorophenoxy)phenyl]-1-methylprop-2-enyl}-N-hydroxyurea, UREA,N-[3-[3-(4-FLUOROPHENOXY)PHENYL]-1-METHYL-2-PROPEN-1-YL]-N-HYDROXY-


ID: 2190

chemical graph of compound 2190



InChIKey: UAKWLVYMKBWHMX-PTNGSMBKSA-N
SMILES: CN(C)C1=CC=C(C=C1)/C=C\2/C3=CC=CC=C3NC2=O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6450842
synonyms found at PubChem are:
SU 4312, dmbi, 5812-07-7, SU4312, NSC86429, CHEMBL328710, NSC 86429, SU-4312, 3-[[4-(dimethylamino)phenyl]methylene]-1,3-dihydro-2H-indol-2-one, SR-01000076222, 3-(4-(Dimethylamino)benzylidene)-1,3-dihydro-2H-indol-2-one, 3-(4-dimethylamino-benzylidenyl)-2-indolinone, BiomolKI_000054, BiomolKI2_000060, UPCMLD-DP118, Lopac0_001121, BMK1-F6, BSPBio_000998, AC1O52G9, SCHEMBL1982207, UPCMLD-DP118:001, UPCMLD-DP118:002, BDBM17747, 3-[[(4-Dimethyl-amino)phenyl]methylene]-1,3-dihydro-2H-indol-2-one, E/Z mixture, MolPort-003-959-619, HMS1362B19, HMS1792B19, HMS1990B19, HMS3263B03, HMS3403B19, BCP20743, Tox21_501121, BS0190, NSC-86429, STK946565, ZINC12339625, AKOS005640946, CCG-100658, LP01121, SU4312(NSC86429), IDI1_002094, NCGC00025170-02, NCGC00025170-03, NCGC00025170-04, NCGC00025170-05, NCGC00025170-06, NCGC00025170-07, NCGC00025170-08, NCGC00025170-09, NCGC00025170-10, NCGC00025170-11, NCGC00025170-12, NCGC00261806-01, B6746, EU-0101121, S 8567, (Z)-3-(4-(dimethylamino)benzylidene)indolin-2-one, SR-01000076222-1, SR-01000076222-3, BRD-K20287671-001-01-0, (3Z)-3-[(4-dimethylaminophenyl)methylene]indolin-2-one, DMBI; (Z)-3-(4-(dimethylamino)benzylidene)indolin-2-one, (3Z)-3-[(4-dimethylaminophenyl)methylidene]-1H-indol-2-one, (3Z)-3-[4-(dimethylamino)benzylidene]-1,3-dihydro-2H-indol-2-one, (3Z)-3-{[4-(dimethylamino)phenyl]methylidene}-2,3-dihydro-1H-indol-2-one


ID: 2191

chemical graph of compound 2191



InChIKey: UAWVRVFHMOSAPU-UHFFFAOYSA-N
SMILES: C1=CC2=C(C=C1Cl)NC(=CC2=O)C(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 1884
synonyms found at PubChem are:
7-Chlorokynurenic acid, 18000-24-3, 7-Chloro-4-hydroxyquinoline-2-carboxylic acid, 7-Cl-KYNA, 7-Chloro-kynurenic acid, UNII-S7936QON2K, 7-chloro-4-hydroxy-2-carboxyquinoline, EINECS 241-913-6, NSC 149792, 7-CKA, CHEMBL311389, S7936QON2K, CHEBI:63965, 7-chloro-4-hydroxy-2-Quinolinecarboxylic acid, 2-Quinolinecarboxylic acid, 7-chloro-4-hydroxy-, 77474-31-8, 2-Quinolinecarboxylic acid, 7-chloro-1,4-dihydro-4-oxo-, SR-01000076227, CKA, Spectrum_001451, Tocris-0237, SpecPlus_000720, Lopac-C-121, Spectrum2_001470, Spectrum3_001942, Spectrum4_000084, Spectrum5_001162, Biomol-NT_000199, AC1L1CG6, AC1Q3OR9, Lopac0_000362, BSPBio_003542, KBioGR_000348, KBioSS_001931, DivK1c_006816, SCHEMBL157187, SPECTRUM1502059, SPBio_001399, BPBio1_001230, DTXSID7042568, CTK0I2761, KBio1_001760, KBio2_001931, KBio2_004499, KBio2_007067, KBio3_002826, MolPort-000-002-971, MolPort-022-866-506, HMS3266C21, ZINC8660417, BDBM50005001, BN0037, CCG-39180, NSC149792, AKOS022492737, AKOS023250576, NSC-149792, ACM18000243, NCGC00015183-01, NCGC00015183-02, NCGC00015183-03, NCGC00015183-04, NCGC00015183-05, NCGC00015183-06, NCGC00015183-07, NCGC00024511-01, NCGC00024511-02, NCGC00024511-03, NCGC00024511-04, NCGC00024511-05, NCGC00024511-06, AJ-75029, AS-52646, SC-49055, DB-065303, HY-100811, KB-249719, LS-141497, B6232, C-121, CS-0020453, EU-0100362, FT-0705682, 2-Quinolinecarboxylicacid,7-chloro-4-hydroxy-, 2-Quinolinecarboxylicacid, 7-chloro-4-hydroxy-, 7-Chloro-4-hydroxy-quinoline-2-carboxylic acid, 7-chloro-4-oxo-1H-quinoline-2-carboxylic acid, C-54139, J-011490, SR-01000076227-1, SR-01000076227-3, BRD-K84214706-001-03-2, BRD-K84214706-001-04-0, 7-Chloro-1,4-dihydro-4-oxoquinoline-2-carboxylic acid, 7-Chloro-4-oxo-1,4-dihydro-quinoline-2-carboxylic acid, 7-chloro-4-oxo-1,4-dihydroquinoline-2-carboxylic acid, 7-Chloro-4-hydroxy-quinoline-2-carboxylic acid (7-chloro-kynurenate)


ID: 2192

chemical graph of compound 2192



InChIKey: UBDZFAGVPPMTIT-UHFFFAOYSA-N
SMILES: C(=NN)(N)N.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 16017
synonyms found at PubChem are:
Pimagedine hydrochloride, Carbazamidine monohydrochloride, Pimagedine hydrochloride [USAN], EINECS 217-707-7, Aminoguanidine monohydrochloride, GER-11, (diaminomethylideneamino)azanium chloride, GUANIDINE, AMINO-, HYDROCHLORIDE, AI3-60240, Hydrazinecarboximidamide, monohydrochloride, UNII-A2Z7G2RGAH, A2Z7G2RGAH, 87667-21-8, AC1Q1S9U, 79-17-4 (Parent), SCHEMBL9576369, CTK5F8825, AC1L2739, AKOS026749873, LS-73220, Hydrazinecarboximidamide, hydrochloride (1:1), 3?,3??,5?,5??-Tetraiodophenolsulfonephthalein, Aminoguanidine hydrochloride, 1937-19-5, 16139-18-7, Pimagedine HCl, Hydrazinecarboximidamide hydrochloride, Guanylhydrazine hydrochloride, Aminoguanidine (hydrochloride), Aminoguanidinehydrochloride, Carbazamidine hydrochloride, Aminoguanidine HCl, Hydrazinecarboximidamide, hydrochloride, 2-aminoguanidine hydrochloride, Hydrazinecarboximidamide hydrochloride(1:x), Carbazamidine HCl, SMR000875337, SR-01000075164, EINECS 240-295-5, aminoguanidinhydrochlorid, CH7ClN4, ACMC-1BO2J, D0J3BY, AC1MC1P8, amino-guanidine hydrochloride, DSSTox_CID_24405, DSSTox_RID_80205, DSSTox_GSID_44405, SCHEMBL19122, 1-aminoguanidine hydrochloride, KSC492K8N, MLS001335903, MLS001335904, 2-azanylguanidine hydrochloride, aminoguanidine hydrochloride salt, Jsp003971, CHEMBL1256292, DTXSID9044405, CTK3J2586, MolPort-003-925-597, MolPort-006-107-788, UBDZFAGVPPMTIT-UHFFFAOYSA-N, Pharmakon1600-01506176, EBD51074, HY-B1041, KS-000001ZS, Tox21_302098, Tox21_500103, Aminoguanidine hydrochloride, >=98%, ANW-23611, MFCD00039074, NSC760398, s4548, AKOS015901151, CCG-213626, CS-4562, LP00103, NSC-760398, RP18992, NCGC00093600-01, NCGC00255912-01, NCGC00260788-01, AS-11811, SC-15685, CAS-1937-19-5, AB0010802, DB-043491, RT-000784, A1129, B6452, EU-0100103, FT-0622286, FT-0637327, Hydrazinecarboximidamide, hydrochloride (1:), Hydrazinecarboximidamide,hydrochloride (9CI), ST24047392, A 8835, D05479, A813665, SR-01000075164-2, SR-01000075164-5, W-107714, I14-14879, F1905-7144, monoaminoguanidinium chloride, aminoguanidinium chloride


ID: 2193

chemical graph of compound 2193



InChIKey: UBJVUCKUDDKUJF-UHFFFAOYSA-N
SMILES: C=CCSCC=C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 11617
synonyms found at PubChem are:
DIALLYL SULFIDE, Allyl sulfide, 592-88-1, diallylsulfide, Thioallyl ether, 1-Propene, 3,3'-thiobis-, Oil garlic, Allyl monosulfide, Diallyl thioether, Diallyl monosulfide, Diallyl sulphide, 2-Propenyl sulphide, 3,3-Thiobis(1-propene), NSC 20947, di-2-Propenyl sulfide, Allyl sulphide, UNII-60G7CF7CWZ, Dially monosulfide, FEMA No. 2042, C6H10S, CCRIS 3252, HSDB 7333, 3-Allylsulfanyl-propene, EINECS 209-775-1, 3-allylsulfanylprop-1-ene, BRN 1736016, 60G7CF7CWZ, 3-(prop-2-en-1-ylsulfanyl)prop-1-ene, AI3-18865, CHEBI:4489, CHEMBL170458, UBJVUCKUDDKUJF-UHFFFAOYSA-N, 1-prop-2-enylthioprop-2-ene, Q-100687, diallylsulfane, Diallyl thioather, Allyl sulfide, 97%, AC1L1XQU, Spectrum2_000837, Spectrum3_001991, 1-Propene,3'-thiobis-, 4-Thia-1,6-heptadiene, ACMC-209mc0, SCHEMBL45800, 1-Propene,3,3'-thiobis-, BSPBio_003591, Prop-1-ene-3,3'-thiobis, 4-01-00-02097 (Beilstein Handbook Reference), KSC490I9L, (CH2=CHCH2)2S, 3,3'-thiobis(prop-1-ene), 3-(Allylsulfanyl)-1-propene, SPECTRUM1505293, SPBio_000793, Allyl sulfide, >=97%, FG, WLN: 1U2S2U1, DTXSID6060470, 3-(Allylsulfanyl)-1-propene #, CTK3J0495, FEMA 2042, KBio3_003027, 3-prop-2-enylsulfanylprop-1-ene, 3,3'-Thiobis-1-propene, 9CI, MolPort-003-665-654, Allyl sulfide, analytical standard, KS-00000X7D, NSC20947, ZINC1531083, 7490AF, ANW-33214, BDBM50318452, CCG-40295, MFCD00008658, NSC-20947, paragraph signthornI(c)+/-u>>uAoAN, SBB060116, STL453662, AKOS015897442, FCH1115787, MCULE-7417537491, RP19166, RTC-020290, SDCCGMLS-0066835.P001, TRA0077955, NCGC00095345-01, NCGC00095345-02, AN-46219, CC-26436, CJ-05229, CJ-24086, KB-49700, LS-16414, DB-053358, TC-020290, A0235, FT-0624605, ST51046353, C08370, C-27437, SR-05000002373, I09-0131, SR-05000002373-1, Allyl sulfide, United States Pharmacopeia (USP) Reference Standard, InChI=1/C6H10S/c1-3-5-7-6-4-2/h3-4H,1-2,5-6H, 132879-26-6


ID: 2194

chemical graph of compound 2194



InChIKey: UCDKONUHZNTQPY-UHFFFAOYSA-N
SMILES: CN(CC1=CC(=CC(=C1N)Br)Br)C2CCCCC2.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5702220
synonyms found at PubChem are:
Bromhexine hydrochloride, 611-75-6, Bromhexine HCl, Auxit, Bromohexine hydrochloride, Bisolvon, Broncokin, Viscolyt, Bromhexine chloride, Quentan, UNII-YC2ZOM3Z8V, Bromhexine (hydrochloride), Bromohexine monohydrochloride, 2,4-Dibromo-6-((cyclohexyl(methyl)amino)methyl)aniline hydrochloride, YC2ZOM3Z8V, CHEBI:31303, NCGC00095005-01, 2-Amino-3,5-dibromo-N-cyclohexyl-N-methylbenzylamine hydrochloride, 2-Amino-N-cyclohexyl-3,5-dibromo-N-methylbenzylamine hydrochloride, N-(2-Amino-3,5-dibromobenzyl)-N-methyl-cyclohexylammonium chloride, N-Cyclohexyl-N-methyl-(2-amino-3,5-dibromobenzyl)ammonium chloride, NA 274, C14H21Br2ClN2, DSSTox_CID_25886, DSSTox_RID_81200, DSSTox_GSID_45886, Q-200754, Bromessina, 2,4-dibromo-6-[[cyclohexyl(methyl)amino]methyl]aniline hydrochloride, N-(2-Amino-3,5-dibromobenzyl)-N-methylcyclohexylamine hydrochloride, CAS-611-75-6, Bisolvon hydrochloride, NA-274, Bromihexine hydrochloride, Ophtolsol, Ophtosol, [(2-amino-3,5-dibromophenyl)methyl]cyclohexylmethylamine, chloride, 2,4-dibromo-6-[[cyclohexyl(methyl)amino]methyl]aniline;hydrochloride, 2,4-dibromo-6-{[cyclohexyl(methyl)amino]methyl}aniline hydrochloride, SR-05000001825, Bisolvon (TN), BROMBENZONIUM, AC1NWAVG, SCHEMBL99613, Bromohexine Hydrochloride,(S), SPECTRUM1503107, CHEMBL1319139, DTXSID0045886, CTK8E6718, HY-B0372A, KS-00000KNR, 3572-43-8 (Parent), AOB5798, MolPort-003-666-446, UCDKONUHZNTQPY-UHFFFAOYSA-N, HMS1922E19, Pharmakon1600-01503107, Tox21_111385, CB0192, CCG-39304, MFCD00056626, NSC758383, s2060, SBB001448, AKOS015906433, Tox21_111385_1, AC-6857, AN-9584, API0025210, Bromhexine hydrochloride (JP17/USAN), CS-2430, KS-5253, MCULE-9140626069, NSC-758383, NCGC00095005-02, NCGC00178520-03, AK163668, BC203110, SC-46511, ST007548, Bromhexine hydrochloride, >=98.0% (AT), AB0011975, AB1009382, AX8034291, TC-063551, B4054, Bromhexine hydrochloride, analytical standard, FT-0603492, ST24038612, D01778, J10434, 611B756, C-21938, SR-05000001825-2, Bromhexine Hydrochloride 1.0 mg/ml in Methanol (as free base), N-(2-amino-3,5-dibromobenzyl)-N-methylcyclohexanaminium chloride, 2-Amino-3,5-dibromo-N-cyclohexyl-N-methylbenzenemethanamine Hydrochloride, Bromhexine hydrochloride, European Pharmacopoeia (EP) Reference Standard, N-Cyclohexyl-N-methyl-N-(2-amino-3,5-dibromobenzyl)ammonium chloride, 3,5-dibromo-N(alpha)-cyclohexyl-N(alpha)-methyltoluene-alpha,2-diamine monohydrochloride, 3,5-Dibromo-N|A-cyclohexyl-N|A-methyltoluene-|A,2-diamine Monohydrochloride, Bromhexine for system suitability, European Pharmacopoeia (EP) Reference Standard, Bromhexine hydrochloride, Pharmaceutical Secondary Standard; Certified Reference Material, 2-Amino-3,5-dibromo-N-cyclohexyl-N-methylbenzylamine hydrochloride; N-(2-Amino-3,5-dibromobenzyl)-N-methylcyclohexylamine hydrochloride, SCHEMBL10704011, N-Cyclohexyl- N-methyl-(2-amino-3,5-dibrombenzyl)-ammonium-chlorid


ID: 2195

chemical graph of compound 2195



InChIKey: UCNVFOCBFJOQAL-UHFFFAOYSA-N
SMILES: C1=CC(=CC=C1C(=C(Cl)Cl)C2=CC=C(C=C2)Cl)Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3035
synonyms found at PubChem are:
p,p'-DDE, 72-55-9, dichlorodiphenyldichloroethylene, DDT dehydrochloride, 4,4'-DDE, 2,2-Bis(4-chlorophenyl)-1,1-dichloroethylene, DDE, 1,1-Dichloro-2,2-bis(4-chlorophenyl)ethene, NCI-C00555, p,p'-Dichlorodiphenyldichloroethylene, p,p'-Dichlorodiphenyl dichloroethylene, p,p'-(Dichlorodiphenyl)-2,2-dichloroethylene, 1,1-Dichloro-2,2-bis(p-chlorophenyl)ethylene, Ethylene, 1,1-dichloro-2,2-bis(p-chlorophenyl)-, DDE (VAN), DDE, p,p'-, NSC 1153, para,para'-DDE, CCRIS 193, 1,1-Dichloro-2,2-bis(4-chlorophenyl)ethylene, Dichlorodiphenyl dichloroethene, UNII-4M7FS82U08, HSDB 1625, 1,1-Dichloro-2,2-bis(p-chlorophenyl)ethene, 1,1-Dichloro-2,2-di(p-chlorophenyl)ethylene, 2,2-Bis(4-chlorophenyl)-1,1-dichloroethene, 1,1-Bis(p-chlorophenyl)-2,2-dichloroethylene, 2,2-Bis(p-chlorophenyl)-1,1-dichloroethylene, EINECS 200-784-6, 1,1'-(Dichloroethenylidene)bis(4-chlorobenzene), Benzene, 1,1'-(dichloroethenylidene)bis[4-chloro-, BRN 1913355, AI3-01715, CHEMBL363207, 2,2-Bis(chlorophenyl)-1,1-dichloroethylene, 1-chloro-4-[2,2-dichloro-1-(4-chlorophenyl)ethenyl]benzene, CHEBI:16598, UCNVFOCBFJOQAL-UHFFFAOYSA-N, 1,1-Dichloro-2,2-bis(4'-chlorophenyl)ethylene, 4M7FS82U08, 1,1-Dichloro-2,2-bis(para-chlorophenyl) ethylene, 1,1-BIS(CHLOROPHENYL)-2,2-DICHLOROETHYLENE, Benzene, 1,1'-(dichloroethenylidene)bis(4-chloro-, p,p'-Dichlorodiphenoldichloroethylene, ETHYLENE, 2,2-BIS(CHLOROPHENYL)-1,1-DICHLORO-, DSSTox_CID_374, p,p' -DDE, DSSTox_RID_75550, DSSTox_GSID_20374, p,p'-DDE (p,p'-Dichlorodiphenyldichloroethylene), 68679-99-2, Benzene, 1,1'-(2,2-dichloroethenylidene)bis(chloro-, 1,1'-(2,2-dichloroethene-1,1-diyl)bis(4-chlorobenzene), CAS-72-55-9, 12002-54-9, SMR001224518, 1,1'-(Dichloroethenylidene)bis[4-chlorobenzene], Benzene, 1,1'-(2,2-dichloroethenylidene)bis[chloro-, 4,4'-DDE (1,1-Dichloro-2,2-bis(p-chlorophenyl)ethene), Dichlorodiphenyl Dichloroethylene, p,p-Dde, EINECS 272-060-8, p,p'-DDT mixture, p,2-dichloroethylene, p,p'-:dde, Spectrum_001941, ACMC-209onl, SpecPlus_000582, p,p[-DDE, p,p'-Dichlorodiphenyldichloroethylene (DDE), Spectrum2_001865, Spectrum3_000861, Spectrum4_000701, Spectrum5_002042, DDE(p,p'), p,p/'-DDE, 1,1'-Bis(chlorophenyl)-2,2-dichloroethylene, AC1L1F0Z, AC1Q3R1Z, Benzene, 1,1'-(dichloroethenylidene)bis(chloro-, BIDD:PXR0109, BSPBio_002501, KBioGR_001221, KBioSS_002495, SPECTRUM330072, WLN: GYGUYR DG&R DG, MLS001055473, MLS002152918, BIDD:ER0615, DivK1c_006678, SCHEMBL177472, SPBio_001710, 1,2-bis(p-chlorophenyl)ethene, 1,2-di(p-chlorophenyl)ethylene, DTXSID9020374, 1,2-bis(p-chlorophenyl)ethylene, CTK8B2236, KBio1_001622, KBio2_002487, KBio2_005055, KBio2_007623, KBio3_002001, NSC1153, MolPort-003-665-464, HMS2230C07, HMS3369G06, KS-000017LU, NSC-1153, ZINC1530006, 4,4 inverted exclamation marka-DDE, Tox21_201260, Tox21_300109, ANW-36223, BDBM50410512, CCG-39403, AKOS015902433, LS-1616, p,p'-(Dichlorodiphenyl)dichloroethylene, NCGC00090888-01, NCGC00090888-02, NCGC00090888-03, NCGC00090888-04, NCGC00090888-05, NCGC00090888-06, NCGC00090888-07, NCGC00090888-08, NCGC00090888-09, NCGC00090888-10, NCGC00254155-01, NCGC00258812-01, 4,4'-DDE 10 microg/mL in Cyclohexane, LS-68298, 4,4'-DDE 10 microg/mL in Acetonitrile, 4,4'-DDE 100 microg/mL in Cyclohexane, TR-031309, 1,1'-(Dichlorovinylidene)bis(chlorobenzene), 2,2-bis(p-chlorophenyl)-1,1-dichloroethene, 4,4 inverted exclamation marka-DDE solution, B0133, FT-0609172, 4,4'-DDE, PESTANAL(R), analytical standard, Benzene,1'-(dichloroethenylidene)bis[4-chloro-, C04596, Ethylene,1-dichloro-2,2-bis(p-chlorophenyl)-, 1,1-Dichloro-2,2-bis(4-chlorophenyl)ethene 99%, 1,1-Dichloro-2,2-bis(4-chlorophenyl)ethene, 99%, P,P'-DICHLORODIPHENYLDIC HLOROETHYLENE (DDE), 1,1-Dichloro-2,2-bis(4-chlorophenyl)ethene solution, I14-19582, 1,1-Dichloro-2,2-bis(4'-chlorophenyl)ethylene (DDE), 1,1-DICHLORO-2,2-BIS(PARA-CHLOROPHENYL)ETYLENE, Benzene,1,1'-(2,2-dichloroethenylidene)bis[4-chloro-, 1-Chloro-4-[2,2-dichloro-1-(4-chlorophenyl)vinyl]benzene, Benzene, 1,1'-(dichloroethenylidene)bis(4-chloro- (9CI), 1-Chloro-4-[2,2-dichloro-1-(4-chlorophenyl)vinyl]benzene #, 4,4'-DDE solution, 20 mug/mL in methanol, analytical standard, 4,4'-DDE solution, 200 mug/mL in isooctane, analytical standard, 1-[2,2-Bis(Chloranyl)-1-(4-Chlorophenyl)ethenyl]-4-Chloranyl-Benzene, 4,4'-DDE solution, certified reference material, 5000 mug/mL in methanol, 6WS


ID: 2196

chemical graph of compound 2196



InChIKey: UCQUAMAQHHEXGD-UHFFFAOYSA-N
SMILES: CC(=O)C1=CC(=C(C=C1)O)O

biological descriptors:

CFTR relevance: inactive

Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown

reference list:

"MH Nantz" "LJ Galietta" "K By" "EJ Niedzinski" "M Eda" "MF Springsteel" "MJ Haddadin" "MJ Kurth" "AS Verkman"


CID is 14530
synonyms found at PubChem are:
3',4'-Dihydroxyacetophenone, 1197-09-7, 1-(3,4-Dihydroxyphenyl)ethanone, 3,4-DIHYDROXYACETOPHENONE, Qingxintong, 4-Acetylpyrocatechol, Acetopyrocatechol, 4-Acetopyrocatechol, Ethanone, 1-(3,4-dihydroxyphenyl)-, 4-Acetocatechol, Acetophenone-3',4'-dihydroxy, Acetylpyrocatechol, UNII-07OQ35LVBK, 1-(3,4-dihydroxyphenyl)ethan-1-one, 07OQ35LVBK, CHEBI:19868, UCQUAMAQHHEXGD-UHFFFAOYSA-N, AE-641/00345018, A1-00828, 1-acetyl-3,4-dihydroxybenzene, 3/',4/'-Dihydroxyacetophenone, Pungenol, 4-acetylcatechol, PubChem3384, ACMC-1CIQZ, 3,4'-dihydroxyacetophenone, dihydroxyacetophenone,3,4-, Dihydroxyacetophenone; 98%, SCHEMBL144106, CHEMBL243161, 3\',4\'-dihydroxyacetophenone, CHEBI:69446, CTK4B1452, DTXSID30152546, MolPort-000-154-542, ZINC900177, 1-(3,4-Dihydroxyphenyl)-Ethanone, AC1L2410, BCP27931, 1-(3,4-Dihydroxyphenyl)ethanone #, ANW-17366, CD-457, Ethanone,1-(3,4-dihydroxyphenyl)-, FCH917098, SBB061719, TD1322, 1-[3,4-bis(oxidanyl)phenyl]ethanone, AKOS002231977, 1-?phenyl-Ethanone?, dihydroxy deriv., CHM0022688, CS-W008953, GS-3459, MCULE-9501549860, RTR-003294, 1-(3,4-Dihydroxyphenyl)ethanone, 9CI, ACM28631869, 4CN-2675, AJ-24297, AK-42350, AN-48842, BC220893, CC-13184, CJ-04514, K418, KB-28318, LS-67369, OR345013, SC-67020, ZB015173, AB0014212, AX8011148, TR-003294, D2345, FT-0633465, FT-0693227, ST24026855, ST45102395, C10675, 631D869, A804342, C-03021, J-004179, I14-30850


ID: 2197

chemical graph of compound 2197



InChIKey: UDFPKNSWSYBIHO-UHFFFAOYSA-N
SMILES: CC1=CC(=O)OC2=C1C=CC(=C2)OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 390807
synonyms found at PubChem are:
7-Methoxy-4-methylcoumarin, 2555-28-4, 7-Methoxy-4-methyl-2H-chromen-2-one, 2H-1-Benzopyran-2-one, 7-methoxy-4-methyl-, 4-Methylherniarin, HYMECROMONE METHYL ETHER, Herniarin, 4-methyl-, 7-methoxy-4-methylchromen-2-one, 7-Methoxy-4-methyl-chromen-2-one, NSC688805, 4-Methyl-7-methoxycoumarin, Coumarin, 7-methoxy-4-methyl-, ST060441, 2(1H)-Benzopyran-2-one, 7-methoxy-4-methyl, J-100205, 7-methoxy-4-methyl-2h-chromen-2-on, NSC 688805, PubChem8694, Spectrum_000788, ACMC-1CRZN, SpecPlus_000316, AC1Q4FEX, 7-Methoxy-4-methyl-2H-1-benzopyran-2-one, Spectrum2_001769, Spectrum3_001256, Spectrum4_001475, Spectrum5_000149, timtec-bb sbb010006, AC1L90TS, 7M4MC, coumarin,4-methyl-7-methoxy, BSPBio_002792, KBioGR_002049, KBioSS_001268, SPECTRUM300540, MLS002207059, CHEMBL12636, DivK1c_006412, SCHEMBL314248, SPBio_001637, CTK4F6018, KBio1_001356, KBio2_001268, KBio2_003836, KBio2_006404, KBio3_002292, ZINC58049, DTXSID70180242, Methyl 4-methylumbelliferyl ether, CHEBI:107662, MolPort-001-011-944, UDFPKNSWSYBIHO-UHFFFAOYSA-N, ALBB-023165, KS-00000ZX2, ZX-AN021679, ZX-AT010730, 7 - Methoxy - 4 - methylcoumarin, ANW-25755, CCG-38419, GEO-02734, OR1151, SBB010006, STK392110, AKOS001086638, ACM2555284, AM84842, FCH1112112, MCULE-1379091359, NSC-688805, SDCCGMLS-0066546.P001, 7-methoxy-4-methyl-1-benzopyran-2-one, NCGC00095600-01, NCGC00095600-02, NCGC00178467-01, 7-Methoxy-4-methyl-2H-chromen-2-one #, AK162597, AS-17835, CC-23227, SMR001306707, ZB002306, AX8110775, DB-029378, KB-200083, TL8002072, TR-011648, FT-0602217, M1393, R1211, ST24045690, V2069, 2H-1-Benzopyran-2-one,7-methoxy-4-methyl-, A817898, C-08089, SR-05000002424, SR-05000002424-1, BRD-K55766625-001-02-6, BRD-K55766625-001-04-2


ID: 2198

chemical graph of compound 2198



InChIKey: UEJJHQNACJXSKW-UHFFFAOYSA-N
SMILES: C1CC(=O)NC(=O)C1N2C(=O)C3=CC=CC=C3C2=O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5426
synonyms found at PubChem are:
thalidomide, 50-35-1, Thalomid, Sedoval, (+/-)-THALIDOMIDE, 2-(2,6-dioxopiperidin-3-yl)isoindoline-1,3-dione, Corronarobetin, Psycholiquid, Psychotablets, Theophilcholine, Algosediv, Asmadion, Bonbrain, Calmorex, Contergan, Distaval, Ectiluran, Enterosediv, Gastrinide, Glutanon, Hippuzon, Neosedyn, Neosydyn, Nerosedyn, Neufatin, Neurodyn, Neurosedin, Neurosedym, Nevrodyn, Noctosediv, Pantosediv, Polygripan, Profarmil, Quetimid, Quietoplex, Sandormin, Sedimide, Sedisperil, Shinnibrol, Softenil, Softenon, Talargan, Talismol, Telargean, Tensival, Thalinette, Valgraine, Asmaval, Calmore, Glupan, Grippex, Imidene, Isomin, Kevadon, Nibrol, Noxodyn, Pangul, Sleepan, Slipro, Talimol, Telagan, Thalin, Valgis, Yodomin, N-Phthaloylglutamimide, Sedin, Predni-Sediv, Imida-lab, Poly-Giron, Sedalis sedi-lab, Shin-naito S, Neaufatin, Asidon 3, Pro-ban M, Imidan (peyta), N-Phthalylglutamic acid imide, Talidomida, 3-Phthalimidoglutarimide, alpha-Phthalimidoglutarimide, Thalidomidum, Bonbrrin, Distaxal, Distoval, Thalomide, Kedavon, (+-)-Thalidomide, K-17, 2,6-Dioxo-3-phthalimidopiperidine, N-Phthalyl-glutaminsaeure-imid, Thalidomide Celgene, Pro-Bam M, Talidomide [DCIT], alpha-N-Phthalylglutaramide, Neurosedyn, Sedalis, Talidomide, Telargan, N-(2,6-Dioxo-3-piperidyl)phthalimide, Glutarimide, 2-phthalimido-, NSC-66847, alpha-(N-Phthalimido)glutarimide, Talidomida [INN-Spanish], Thalidomidum [INN-Latin], Thalidomine USP26, K 17, E-217, Synovir, Talizer, Thaled, ENMD 0995, 1H-Isoindole-1,3(2H)-dione, 2-(2,6-dioxo-3-piperidinyl)-, 1,3-Dioxo-2-(2,6-dioxopiperidin-3-yl)isoindoline, Thalomid (TM), Thalomid (TN), Thalidomide Pharmion, .alpha.-N-Phthalylglutaramide, Thaled (TN), N-Phthalyl-glutaminsaeure-imid [German], Thalidomide [USAN:INN:BAN], N-Phthalimidoglutamic acid imide, 2-(2,6-dioxopiperidin-3-yl)-2,3-dihydro-1H-isoindole-1,3-dione, HSDB 3586, Phthalimide, N-(2,6-dioxo-3-piperidyl)-, C13H10N2O4, EINECS 200-031-1, IN1061, CHEMBL468, Thalidomide (soluble form), NSC 527179, BRN 0030233, .alpha.-Phthalimidoglutarimide, Thalidomide (JAN/USP/INN), AI3-50606, 2-(2,6-Dioxo-3-piperidinyl)-1H-isoindole-1,3(2H)-dione, 2-(2,6-dioxopiperidin-3-yl)-1H-isoindole-1,3(2H)-dione, (+-)-N-(2,6-Dioxo-3-piperidyl)phthalimide, CHEBI:74947, UEJJHQNACJXSKW-UHFFFAOYSA-N, .alpha.-(N-Phthalimido)glutarimide, NSC66847, THALIDOMIDE (AIDS INITIATIVE), N-(2,6-dioxo-3-piperidinyl)phthalimide, NCGC00015989-09, DSSTox_CID_2524, DSSTox_RID_76611, (+/-)-N-(2,6-Dioxo-3-piperidinyl)phthalimide, DSSTox_GSID_22524, 2-(2,6-dioxo-3-piperidyl)isoindoline-1,3-dione, 2-(2,6-dioxopiperidin-3-yl)isoindole-1,3-dione, 2-(2,6-Dioxo-piperidin-3-yl)-isoindole-1,3-dione, (?)-Thalidomide, Phthalimide,6-dioxo-3-piperidyl)-, (+/-)-2-(2,6-Dioxo-3-piperidinyl)-1H-isoindole-1,3(2H)-dione, 1H-Isoindole-1,3(2H)-dione, 2-(2,6-dioxo-3-piperidinyl)-, (+-)-, WLN: T56 BVNVJ C- DT6VMVTJ, 1H-Isoindole-1, 2-(2,6-dioxo-3-piperidinyl)-, SR-01000076184, Thalidomide (+ and -), Celgene, Pharmion, Talinol, CCRIS 8148, (y)-Thalidomide, Thalidomide,(S), CAS-50-35-1, Prestwick_463, Thalomid, Thalidomide, Thalidomide [USAN:USP:INN:BAN:JAN], (A+/-)-Thalidomide, Thalidomide (+ and-), AC1L1KBZ, AC1Q6FJA, Prestwick0_000192, Prestwick1_000192, Prestwick2_000192, Prestwick3_000192, Spectrum2_000707, Spectrum3_001715, Spectrum4_001087, Spectrum5_001791, (.+/-.)-Thalidomide, D0U7GK, UPCMLD-DP139, Thalomid (TN) (Celgene), SCHEMBL7581, Celgene Brand of Thalidomide, NCIOpen2_003188, Lopac0_001224, BSPBio_000143, BSPBio_001156, BSPBio_003330, KBioGR_000496, KBioGR_001474, KBioGR_002322, KBioSS_000496, KBioSS_002324, MLS000069353, ARONIS24496, DivK1c_000051, SPECTRUM1503607, SPBio_000893, SPBio_002064, BPBio1_000159, GTPL7327, DTXSID9022524, SCHEMBL15197560, UPCMLD-DP139:001, CTK8B6291, HMS500C13, KBio1_000051, KBio2_000496, KBio2_002322, KBio2_003064, KBio2_004890, KBio2_005632, KBio2_007458, KBio3_000911, KBio3_000912, KBio3_002550, KBio3_002802, cMAP_000022, MolPort-003-665-582, NINDS_000051, Bio1_000387, Bio1_000876, Bio1_001365, Bio2_000418, Bio2_000898, HMS1362J17, HMS1568H05, HMS1792J17, HMS1922E12, HMS1990J17, HMS2090O05, HMS2093G15, HMS2095H05, HMS2234C07, HMS3259C22, HMS3263F10, HMS3266F13, HMS3373E06, HMS3373G15, HMS3403J17, HMS3654A20, HMS3712H05, Pharmakon1600-01503607, BCP19772, NSC91729, NSC91730, (inverted question mark)-Thalidomide, Tox21_110275, Tox21_300580, Tox21_501224, AC-917, ANW-53225, BBL023439, BDBM50070114, CCG-39878, LS-140, MFCD00153873, NSC-91729, NSC-91730, NSC527179, NSC758479, STL356025, ( inverted question mark)-Thalidomide, AKOS009529198, Tox21_110275_1, CS-1084, DB01041, LP01224, MCULE-6327754946, NC00600, NSC-527179, NSC-758479, RP29207, (+/-)-Thalidomide, >=98%, powder, IDI1_000051, IDI1_002173, KS-00000H64, n-(2,6-dioxopiperidin-3-yl)phthalimide, NCGC00015989-03, NCGC00015989-04, NCGC00015989-05, NCGC00015989-06, NCGC00015989-07, NCGC00015989-08, NCGC00015989-10, NCGC00015989-11, NCGC00015989-12, NCGC00015989-13, NCGC00015989-14, NCGC00015989-16, NCGC00015989-17, NCGC00024708-02, NCGC00024708-03, NCGC00024708-04, NCGC00024708-05, NCGC00024708-06, NCGC00024708-07, NCGC00024708-08, NCGC00024708-09, NCGC00024708-10, NCGC00024708-11, NCGC00254343-01, NCGC00261909-01, 731-40-8, AN-15419, AS-12367, BC204656, CPD000058524, HY-14658, KB-61574, NCI60_023904, SAM002564245, SC-18573, SMR000058524, WLN: T56 BVNVJ C- DT6VMVTJ -D, WLN: T56 BVNVJ C- DT6VMVTJ -L, SBI-0051191.P003, AB0011813, AB2000009, LS-109463, Phthalimide,6-dioxo-3-piperidyl)-, (+)-, Phthalimide,6-dioxo-3-piperidyl)-, (-)-, TC-141970, AB00052362, EU-0101224, FT-0600001, FT-0631211, S1193, ST24027458, ST51039042, Phthalimide,6-dioxo-3-piperidyl)-, D-(+)-, Phthalimide,6-dioxo-3-piperidyl)-, L-(-)-, (+/-)-N-(2,6-dioxo-3-piperidyl)phthalimide, C07910, D00754, J90042, M-1523, AB00052362-11, AB00052362-12, AB00052362-13, AB00052362_14, AB00052362_15, 153T873, I06-0197, SR-01000076184-1, SR-01000076184-3, SR-01000076184-5, SR-01000076184-8, W-105969, BRD-A93255169-001-04-4, BRD-A93255169-001-06-9, BRD-A93255169-001-24-2, I14-23643, Phthalimide, N-(2,6-dioxo-3-piperidyl)-, (+-)-, Z1550675451, 1H-Isoindole-1, 2-(2,6-dioxo-3-piperidinyl)-, (R)-, 1H-Isoindole-1, 2-(2,6-dioxo-3-piperidinyl)-, (S)-, 2-(2,6-dioxoazaperhydroin-3-yl)benzo[c]azoline-1,3-dione, 2-(2,6-Dioxo-3-piperidinyl)-1H-isoindole-1,3(2H)-dione #, [(R,S)-2-(2,6-dioxo-3-piperidinyl)-1H-isoindole-1,3(2H)-dione, Thalidomide, United States Pharmacopeia (USP) Reference Standard, ( inverted question mark)-2-(2,6-Dioxo-3-piperidinyl)-1H-isoindole-1,3(2H)-dione, 2-(6-hydroxy-2-oxo-2,3,4,5-tetrahydropyridin-3-yl)-2,3-dihydro-1H-isoindole-1,3-dione, 1012310-87-0, 14088-68-7


ID: 2199

chemical graph of compound 2199



InChIKey: UENLHUMCIOWYQN-UHFFFAOYSA-N
SMILES: CC(=O)C1=C(C=CC=C1OC)O

biological descriptors:

CFTR relevance: inactive

Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown

reference list:

"MH Nantz" "LJ Galietta" "K By" "EJ Niedzinski" "M Eda" "MF Springsteel" "MJ Haddadin" "MJ Kurth" "AS Verkman"


CID is 69709
synonyms found at PubChem are:
703-23-1, 1-(2-hydroxy-6-methoxyphenyl)ethanone, 2'-Hydroxy-6'-methoxyacetophenone, 2-Hydroxy-6-methoxyacetophenone, 1-(2-Hydroxy-6-methoxyphenyl)ethan-1-one, Ethanone, 1-(2-hydroxy-6-methoxyphenyl)-, Acetophenone, 2'-hydroxy-6'-methoxy-, UNII-M5VQG8968N, Ethanone,1-(2-hydroxy-6-methoxyphenyl)-, M5VQG8968N, UENLHUMCIOWYQN-UHFFFAOYSA-N, 1-(2-Hydroxy-6-methoxy-phenyl)-ethanone, 1-acetyl-2-hydroxy-6-methoxybenzene, EINECS 211-872-9, PubChem16677, ACMC-209wzo, AC1L2CHK, 2-Acetyl-3-methoxyphenol, AC1Q5D5K, KSC632E4F, SCHEMBL980322, AC1Q4E81, CHEMBL3274349, CTK5D2242, 2-Hydroxy 6-methoxy acetophenone, DTXSID80220567, MolPort-001-766-454, ZINC164091, 2'-Hydroxy 6'-methoxyacetophenone, 6'-Hydroxy-2'-methoxyacetophenone, ACT00341, KS-000009DY, STR04840, ANW-47026, SBB071417, AKOS000112325, 2-HYDROXY-6-METHOXYACETHPHENONE, AS05194, CM11215, CS-W002044, MCULE-9445734833, QC-8320, VZ21898, 2'-Hydroxy-6'-methoxyacetophenone, 97%, AJ-16097, CJ-02110, KB-24492, SC-47454, ST092315, ZB008076, 2'-HYDROXY-6-METHOXY ACETOPHENONE, AB0026346, DB-021193, KB-146772, RT-003441, 2\'-HYDROXY-6\'-METHOXYACETOPHENONE, FT-0632848, ST24026844, W7987, 2'-Hydroxy-6'-methoxyacetophenone, 97% 1g, I01-7350, Q-200289, F0001-1818, InChI=1/C9H10O3/c1-6(10)9-7(11)4-3-5-8(9)12-2/h3-5,11H,1-2H


ID: 2200

chemical graph of compound 2200



InChIKey: UFBJCMHMOXMLKC-UHFFFAOYSA-N
SMILES: C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 1493
synonyms found at PubChem are:
2,4-dinitrophenol, 51-28-5, Aldifen, Solfo Black B, Tertrosulphur PBR, Phenol, 2,4-dinitro-, alpha-Dinitrophenol, 2,4-Dnp, Solfo Black G, 1-Hydroxy-2,4-dinitrobenzene, Nitro kleenup, Fenoxyl carbon N, Chemox PE, Solfo Black BB, Solfo Black SB, Dinitrofenolo, Dinofan, DINITROPHENOL, Tertrosulphur Black PB, Solfo Black 2B Supra, 2,4-Dinitrofenol, Maroxol-50, Osmoplastic-R, Osmotox-Plus, Sulphur Black 1, Nitrophen (VAN), Nitrophene (VAN), RCRA waste number P048, NSC 1532, .alpha.-Dinitrophenol, Camello mosquito coils, Caswell No. 392, EK 102, Dinitrofenolo [Italian], Phenol, alpha-dinitro-, Tertrosulfur pbr, X 32, UNII-Q13SKS21MN, 2,4-Dinitrofenol [Dutch], 1'alpha-2,4-Dinitrophenol, Cobra salts (Impregna salts), Shirakiku brand mosquito coils, 2,4-dinitro-phenol, CCRIS 3102, HSDB 529, CHEBI:42017, EINECS 200-087-7, Phenol, .alpha.-dinitro-, RCRA waste no. P048, EPA Pesticide Chemical Code 037509, Q13SKS21MN, AI3-01535, UFBJCMHMOXMLKC-UHFFFAOYSA-N, Fenoxyl, 1326-82-5, DSSTox_CID_523, Tertrosulfur black pb, DSSTox_RID_75640, DSSTox_GSID_20523, DNF, CAS-51-28-5, Solfo Black, PubChem11250, Spectrum_001934, SpecPlus_000938, AC1L1BLR, Spectrum2_000673, Spectrum3_001694, Spectrum4_000913, Spectrum5_001670, WLN: WNR BQ ENW, Epitope ID:112424, EC 200-087-7, SCHEMBL77643, BSPBio_003248, KBioGR_001406, KBioSS_002480, SPECTRUM330008, MLS001066358, BIDD:ER0505, DivK1c_007034, SPBio_000765, ARONIS010084, CHEMBL273386, SR-1C5, DTXSID0020523, SCHEMBL13973810, CTK1G9509, KBio1_001978, KBio2_002473, KBio2_005041, KBio2_007609, KBio3_002468, NSC1532, MolPort-001-011-561, HMS1923K21, HMS2233H07, HMS3372P06, KS-000041JJ, NSC-1532, Tox21_201462, Tox21_300030, ANW-46655, BBL023448, CCG-39730, LS-154, MFCD00007115, STK397797, ZINC12358776, AKOS000118988, AKOS015912556, DB04528, MCULE-6678680789, NE10472, NCGC00091778-01, NCGC00091778-02, NCGC00091778-03, NCGC00091778-04, NCGC00091778-05, NCGC00091778-06, NCGC00254114-01, NCGC00259013-01, 2,4-dinitrophenol (h2o w/w 18% max), AJ-61331, AN-41595, AS-39888, KB-67467, SC-81242, SMR000471854, TR-032491, D0109, FT-0610210, 2,4-Dinitrophenol (wetted with 15 % water), 9456-EP2284174A1, 9456-EP2316829A1, C02496, AB00053210_08, 2,4-Dinitrophenol, SAJ special grade, >=98.0%, AF-936/31262030, 2,4-Dinitrophenol, moistened with water, >=98.0%, W-105909, 2,4-Dinitrophenol, PESTANAL(R), analytical standard, BRD-K21910317-001-02-4, BRD-K21910317-001-06-5, BRD-K21910317-001-12-3, I14-48190, F0850-6525, 2,4-Dinitrophenol, technical, moistened with water, >=97.0% (HPLC), InChI=1/C6H4N2O5/c9-6-2-1-4(7(10)11)3-5(6)8(12)13/h1-3,9


ID: 2201

chemical graph of compound 2201



InChIKey: UFCGDBKFOKKVAC-DSASHONVSA-N
SMILES: C[C@H]1CC2=CC3=C(C(=C2C4=C(C(=C(C=C4[C@@H]([C@@]1(C)O)OC(=O)C5=CC=CC=C5)OC)OC)OC)OC)OCO3

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 151529
synonyms found at PubChem are:
Schisantherin A, 58546-56-8, Gomisin C, CHEMBL404875, UNII-873480KS4A, AC1L46IR, CHEBI:9048, MolPort-005-932-873, 873480KS4A, Benzo(3,4)cycloocta(1,2-f)(1,3)benzodioxole-5,6-diol, 5,6,7,8-tetrahydro-1,2,3,13-tetramethoxy-6,7-dimethyl-, 5-benzoate, (5S-(5alpha,6beta,7beta))-, Schizandrol-A, Schisantherin Gomisin, Gomisin C/Schizantherin A, DTXSID70207261, BCP15178, HY-N0694, ZINC4098927, BDBM50418091, AKOS015897145, CS-3660, (5S-(5alpha,6beta,7beta))-5,6,7,8-Tetrahydro-1,2,3,13-tetramethoxy-6,7-dimethylbenzo(3,4)cycloocta(1,2-f)(1,3)benzodioxole-5,6-diol 5-benzoate, AC-11195, AN-39777, SC-48300, FT-0686703, N2655, V1538, C10881, W-2854, 546S568, I07-0280, Benzo[3,4]cycloocta[1,2-f][1,3]benzodioxole-5,6-diol,5,6,7,8-tetrahydro-1,2,3,13-tetramethoxy-6,7-dimethyl-, 5-benzoate,(5S,6S,7S,13aS)-


ID: 2202

chemical graph of compound 2202



InChIKey: UFSBFVZQJZMIOU-LZQZFOIKSA-N
SMILES: C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)F

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 445227
synonyms found at PubChem are:
111495-86-4, 2,4-Dinitrophenyl 2-fluoro-2-deoxy-beta-D-glucopyranoside, 2,4-Dinitrophenyl 2-deoxy-2-fluoro-b-D-glucopyranoside, 2,4-Dinitrophenyl 2-Deoxy-2-Fluoro-Beta-D-Glucopyranoside, 2,4-DINITROPHENYL 2-DEOXY-2-FLUORO-BETA-D-ALLOPYRANOSIDE, (2R,3S,4S,5R,6S)-6-(2,4-dinitrophenoxy)-5-fluoro-2-(hydroxymethyl)oxane-3,4-diol, NFG, AC1L9HMO, 2,4-dinitrophenyl-2-fluoro-2-deoxy-beta-D-glucopyranoside, Lopac0_000376, BICL4069, SCHEMBL1321065, CHEMBL1234696, UFSBFVZQJZMIOU-LZQZFOIKSA-N, ZINC4475142, AKOS022179628, CCG-204471, DB02658, NCGC00093808-01, NCGC00093808-02, NCGC00093808-03, AJ-51157, EU-0100376, FT-0667584, D 1791, SR-01000075806, SR-01000075806-1, W-200829, 2,4-Dinitrophenyl 2-Deoxy-2-fluoro-|A-D-glucopyranoside, 2,4-Dinitrophenyl 2-deoxy-2-fluoro-beta-D-glucopyranoside min. 98%, (2R,3S,4S,5R,6S)-6-(2,4-Dinitrophenoxy)-5-fluoro-2-(hydroxymethyl)tetrahydro-2H-pyran-3,4-diol


ID: 2203

chemical graph of compound 2203



InChIKey: UFVMPKORWRHRNF-UHFFFAOYSA-N
SMILES: C1CC(NC(C1)CCN)CCN.Cl.Cl.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 11957639
synonyms found at PubChem are:
MDL 26,630 trihydrochloride, EU-0100834, mdl-26,630-trihydrochloride, CHEMBL1590722, Tox21_500834, LP00834, NCGC00094165-01, NCGC00261519-01, M-166, SR-01000075178, SR-01000075178-1


ID: 2204

chemical graph of compound 2204



InChIKey: UFYKDFXCZBTLOO-TXICZTDVSA-N
SMILES: C([C@H]([C@H]([C@@H]([C@H](C(=O)O)N)O)O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 73563
synonyms found at PubChem are:
D-Glucosaminic acid, 3646-68-2, Glucosaminate, 2-Amino-2-deoxy-D-gluconic acid, Glucosaminic acid, D-Glucosamic acid, 2-Amino-2-deoxygluconic acid, D-Glucosaminate, D-Gluconic acid, 2-amino-2-deoxy-, 2-Amino-2-deoxy-D-gluconate, Gluconic acid, 2-amino-2-deoxy-, (2R,3R,4S,5R)-2-amino-3,4,5,6-tetrahydroxyhexanoic acid, (3r,4s,5r)-3,4,5,6-tetrahydroxy-d-norleucin, CHEMBL3039035, CHEBI:17784, UFYKDFXCZBTLOO-TXICZTDVSA-N, 6165-14-6, (2R,3R,4S,5R)-2-Amino-3,4,5,6-tetrahydroxy-hexanoic acid, EINECS 222-879-1, NSC 37779, NSC 404265, Gluconic acid, 2-amino-2-deoxy-, D-, (3R,4S,5R)-3,4,5,6-tetrahydroxynorleucine, Spectrum_001231, SpecPlus_000455, AI3-51894, Spectrum2_001910, Spectrum3_001347, Spectrum4_001866, Spectrum5_000432, bmse000440, AC1L2K3D, BSPBio_003133, KBioGR_002334, KBioSS_001711, SPECTRUM310298, DivK1c_006551, SCHEMBL396940, SPBio_001880, AC1Q5R04, D-Glucosaminic acid, >=98%, CTK5B3522, KBio1_001495, KBio2_001711, KBio2_004279, KBio2_006847, KBio3_002353, ZINC2384917, BDBM50442917, CCG-38481, MFCD00037764, AKOS006238367, SDCCGMLS-0066564.P001, NCGC00178247-01, KB-49665, ST095791, FT-0624555, G0042, C03752, (3R,4S,5R)-3,4,5,6-tetrahydroxy-D-norleucine, 646G682, C-48351, SR-05000002429, SR-05000002429-1, W-202514, I04-10487, 6BA699D8-74A0-43AF-82A9-F68E6BFA0B50, (4S,2R,3R,5R)-2-amino-3,4,5,6-tetrahydroxyhexanoic acid, (2R,3R,4S,5R)-2-azanyl-3,4,5,6-tetrakis(oxidanyl)hexanoic acid, 2-ammonio-2-deoxy-D-gluconate, CHEBI:58269, 2-azaniumyl-2-deoxy-D-gluconate, 2-amino-2-deoxy-D-gluconic acid zwitterion, A823258, (2R,3R,4S,5R)-2-ammonio-3,4,5,6-tetrahydroxyhexanoate, (2R,3R,4S,5R)-2-azaniumyl-3,4,5,6-tetrakis(oxidanyl)hexanoate


ID: 2205

chemical graph of compound 2205



InChIKey: UGBJGGRINDTHIH-UHFFFAOYSA-N
SMILES: C1CNCCC1S(=O)(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 4838
synonyms found at PubChem are:
piperidine-4-sulfonic acid, Piperidine-4-sulphonic acid, 4-Piperidinesulfonic acid, 72450-62-5, CHEMBL34155, P4S, C5H11NO3S, AC1Q6WTY, Lopac-P-9159, D0VW5M, AC1L1J2H, Lopac0_001024, MLS000069699, SCHEMBL106762, GTPL4287, DTXSID70222752, Piperidine-4-sulfonic acid (P4S), ZINC2516028, BDBM50087272, FCH838660, MFCD00055097, PIPERIDINE-4-SULPHONIC ACID-, AKOS006272381, API0008543, CCG-205104, NCGC00015855-01, NCGC00015855-02, NCGC00015855-03, NCGC00015855-04, NCGC00093348-02, NCGC00093348-03, DA-17251, SMR000058505, AB1009736, LS-176970, EU-0101024, FT-0688685, P 9159, SR-01000075616, SR-01000075616-1


ID: 2206

chemical graph of compound 2206



InChIKey: UGJMXCAKCUNAIE-UHFFFAOYSA-N
SMILES: C1CCC(CC1)(CC(=O)O)CN

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3446
synonyms found at PubChem are:
gabapentin, 60142-96-3, Neurontin, Gabapentine, 1-(Aminomethyl)cyclohexaneacetic acid, Aclonium, Gabapentinum, Gabapetin, 2-[1-(aminomethyl)cyclohexyl]acetic acid, Gabapentino, Fanatrex, Serada, Gabapentino [Spanish], Cyclohexaneacetic acid, 1-(aminomethyl)-, 2-(1-(aminomethyl)cyclohexyl)acetic acid, gabapentina, Gabapentine [INN-French], Gabapentinum [INN-Latin], Gabapen, Gralise, Gabapentino [INN-Spanish], Vultin, Novo-Gabapentin, [1-(AMINOMETHYL)CYCLOHEXYL]ACETIC ACID, Gabapentin GR, Goe-3450, Gabarone, Go 3450, GOE 2450, CI-945, gabapentinium, gabapentin (Neurontin), (1-Aminomethyl-cyclohexyl)-acetic acid, Neurontin (TN), UNII-6CW7F3G59X, CI 945, 1-(Aminomethyl)-cyclohexaneacetic acid, Gabapentin [USAN:INN:BAN], DM-1796, DM-5689, CCRIS 7210, HSDB 7364, EINECS 262-076-3, CHEMBL940, BRN 2359739, Gabapentin (JAN/USAN/INN), 6CW7F3G59X, C9H17NO2, CHEBI:42797, UGJMXCAKCUNAIE-UHFFFAOYSA-N, DDS-2003, GOE 3450, 2-[(aminomethyl)cyclohexyl]acetic acid, NCGC00015466-08, DSSTox_CID_74, CAS-60142-96-3, G-154, DSSTox_RID_75350, DSSTox_GSID_20074, GBN, Neuontin, Sefelsa, Apo-Gabapentin, Gabapentin Hexal, Gabapentin Stada, PMS-Gabapentin, Therapentin-90, CPD000058311, Gabapentin-ratiopharm, SR-01000000019, gabamox, Neurentin, Gabapentin-ER, Novo-Gabapentine, Gabapentin, solid, Gabapentin [USAN:USP:INN:BAN], Prestwick_151, Gralise (TN), GABAPETINE, Tocris-0806, Lopac-G-154, AC1L1FYE, Hexal brand of gabapentin, Prestwick0_000861, Prestwick1_000861, Prestwick2_000861, Prestwick3_000861, Apotex brand of gabapentin, Pfizer brand of gabapentin, D0J0ZS, Aventis brand of gabapentin, AC1Q53PH, SCHEMBL8343, GABAPENTIN; NEURONTIN, Lopac0_000582, BSPBio_000901, Novopharm brand of gabapentin, KSC492E1H, MLS000069358, ratiopharm brand of gabapentin, BIDD:GT0656, Stadapharm brand of gabapentin, SPBio_002822, BPBio1_000993, GTPL5483, ZINC4949, Parke Davis brand of gabapentin, DTXSID0020074, CTK3J2213, Pharmascience brand of gabapentin, MolPort-000-883-862, HMS1570N03, HMS2089J03, HMS2097N03, HMS2236O03, HMS3261F06, HMS3650A20, HMS3714N03, Warner-Lambert brand of gabapentin, 1-aminomethyl cyclohexaneacetic acid, ACT03340, BCP25698, HY-A0057, KS-00000AF6, 1-(aminomethyl)cyclohexanacetic acid, 1-(Aminomethyl)cyclohexaneaceticAcid, Tox21_110157, Tox21_500582, ANW-43124, BBL010794, BDBM50080153, MFCD00865286, NSC742194, s2133, SBB066157, STK598009, 1-(aminomethyl)cyclohexyl-acetic Acid, AKOS000280865, Tox21_110157_1, 1-Aminomethyl-1cyclohexane-acetic acid, AB07485, AC-1485, CCG-204671, CS-1545, DB00996, KS-1064, LP00582, LS-7194, MCULE-5392848565, NSC-742194, RTR-020802, TRA0097671, 1-aminomethyl-1-cyclohexane-acetic acid, NCGC00015466-01, NCGC00015466-02, NCGC00015466-03, NCGC00015466-04, NCGC00015466-05, NCGC00015466-06, NCGC00015466-07, NCGC00015466-09, NCGC00015466-11, NCGC00016891-01, NCGC00021545-02, NCGC00021545-04, NCGC00021545-05, NCGC00261267-01, AJ-08236, AN-14914, BR-35803, SAM002548985, SAM002589946, SC-12130, SMR000058311, SBI-0206904.P001, 1-(AMINOETHYL)CYCLOHEXANEACETIC ACID, AB0068842, AB1000455, ST2410212, TL8003814, TR-020802, AM20070538, EU-0100582, FT-0626586, G0318, EN300-52516, 42G963, C07018, D00332, M-2788, 1-(Aminomethyl)-cyclohexaneacetic acid; Neurontin, L000733, I06-0677, SR-01000000019-2, SR-01000000019-6, SR-01000000019-11, Z1258578343, Gabapentin, European Pharmacopoeia (EP) Reference Standard, Gabapentin, United States Pharmacopeia (USP) Reference Standard, Gabapentin, Pharmaceutical Secondary Standard; Certified Reference Material, Gabapentin solution, 1.0 mg/mL in methanol, ampule of 1 mL, certified reference material, Gabapentin solution, 10 mg/mL in methanol, ampule of 1 mL, certified reference material, AC1OCG9F, 1-(Aminomethyl)cyclohexaneacetate, 2-[1-(ammoniomethyl)cyclohexyl]acetate, 2-[1-(azaniumylmethyl)cyclohexyl]acetate, CJ-00100, ZB000600, 2-[1-(azaniumylmethyl)cyclohexyl]ethanoate, A832613


ID: 2207

chemical graph of compound 2207



InChIKey: UGNWTBMOAKPKBL-UHFFFAOYSA-N
SMILES: C1(=C(C(=O)C(=C(C1=O)Cl)Cl)Cl)Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 8371
synonyms found at PubChem are:
Chloranil, 118-75-2, p-Chloranil, Tetrachloro-p-benzoquinone, Tetrachloro-1,4-benzoquinone, Tetrachlorobenzoquinone, Spergon, 2,3,5,6-tetrachlorocyclohexa-2,5-diene-1,4-dione, Coversan, Reranil, Vulklor, 2,3,5,6-TETRACHLORO-1,4-BENZOQUINONE, Khloranil, Psorisan, Tetrachloroparabenzoquinone, Spergon technical, Spergon I, Tetrachloroquinone, Chloranile, Quinone tetrachloride, Tetrachloro-p-quinone, Geigy-444E, 2,3,5,6-Tetrachlorobenzo-1,4-quinone, 2,3,5,6-Tetrachloro-p-benzoquinone, Dow Seed Disinfectant No. 5, 2,5-Cyclohexadiene-1,4-dione, 2,3,5,6-tetrachloro-, 2,3,5,6-Tetrachloroquinone, Caswell No. 171, ENT 3,797, G-444E, 2,3,5,6-Tetrachloro-2,5-cyclohexadiene-1,4-dione, alpha-Chloranil, p-Benzoquinone, 2,3,5,6-tetrachloro-, 2,3,5,6-Tetrachlorobenzoquinone, NSC 8432, .alpha.-Chloranil, UNII-01W5X7N5XV, CCRIS 7155, G-25804, HSDB 1533, 1,4-Benzoquinone, 2,3,5,6-tetrachloro-, EINECS 204-274-4, EPA Pesticide Chemical Code 079301, AI3-03797, 01W5X7N5XV, CHEBI:36703, UGNWTBMOAKPKBL-UHFFFAOYSA-N, 3,4,5,6-Tetrachloro-p-benzoquinone, 2,3,5,6-Tetrachlor-1,4-benzochinon, 2,3,5,6-tetrachloro-[1,4]benzoquinone, tetrachlorocyclohexa-2,5-diene-1,4-dione, DSSTox_CID_266, DSSTox_RID_75474, DSSTox_GSID_20266, CAS-118-75-2, Tetrachlorquinone, 4-Chloranil, tetrachlorobenzoquinon, P-CHLORONIL, Spectrum_001590, CHLORANIL, PRACT, SpecPlus_000850, AC1L1QUW, Spectrum2_000024, Spectrum3_001660, Spectrum4_000794, Spectrum5_001386, 2,5,6-Tetrachloroquinone, D0D0BI, EC 204-274-4, AC1Q3HK4, SCHEMBL24049, Benzil-related compound, 56, BSPBio_003419, KBioGR_001268, KBioSS_002070, p-Chloranil, 97% 25g, KSC490O2B, ARONIS24200, Chloranil, analytical standard, DivK1c_006946, SPECTRUM1504212, SPBio_000087, 2,5,6-Tetrachlorobenzoquinone, AC1Q3H95, CHEMBL192627, DTXSID2020266, BDBM22782, CTK3J0720, KBio1_001890, KBio2_002070, KBio2_004638, KBio2_007206, KBio3_002639, NSC8432, MolPort-000-644-415, 2,5,6-Tetrachloro-p-benzoquinone, ZINC240941, ENT 3797, NSC-8432, WLN: L6V DVJ BG CG EG FG, p-Benzoquinone,3,5,6-tetrachloro-, Tox21_201656, Tox21_303021, ANW-42320, BBL004011, CCG-39987, LS-604, MFCD00001594, SBB058799, STK396683, Tetrachloro-1,4-benzoquinone, 99%, 2,5,6-Tetrachloro-1,4-benzoquinone, AKOS001569085, AKOS025243279, Chloranil, purum, >=97.0% (AT), 2,4-dione, 2,3,5,6-tetrachloro-, MCULE-7076963744, RP28715, RTR-003192, TRA0090107, KS-000000Z0, NCGC00091254-01, NCGC00091254-02, NCGC00091254-03, NCGC00091254-04, NCGC00091254-05, NCGC00256410-01, NCGC00259205-01, AC-11776, AN-22790, AS-14117, BC203478, BP-30129, KB-48834, SC-19042, TL806233, 2,3,5,6-Tetrachlorobenzo-1,4-quinone #, AB1002157, TR-003192, C1770, CS-0013526, FT-0609408, ST50410970, T7334, AZ0001-0017, Chloranil, PESTANAL(R), analytical standard, EN300-18125, C18933, J10348, 72841-EP2277878A1, 72841-EP2289886A1, 72841-EP2298312A1, 72841-EP2309584A1, 2,5,6-Tetrachloro-2,5-cyclohexadiene-1,4-dione, A804087, I01-0471, 2,5-Cyclohexadiene-1,4-dione,2,3,5,6-tetrachloro-, 2,3,5,6-tetrakis(chloranyl)cyclohexa-2,5-diene-1,4-dione, 2,3,5,6-Tetrachloro-1,4-benzoquinone; p-Chloranil; Chloranil, InChI=1/C6Cl4O2/c7-1-2(8)6(12)4(10)3(9)5(1)1, 142655-99-0, 856302-53-9


ID: 2208

chemical graph of compound 2208



InChIKey: UGQMRVRMYYASKQ-KQYNXXCUSA-N
SMILES: C1=NC(=O)C2=C(N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6021
synonyms found at PubChem are:
inosine, 58-63-9, Hypoxanthosine, Ribonosine, Atorel, Oxiamin, Trophicardyl, Selfer, Pantholic-L, Panholic-L, Hypoxanthine riboside, Hypoxanthine ribonucleoside, beta-Inosine, Hypoxanthine D-riboside, (-)-Inosine, Hypoxanthine nucleoside, Inosinum, Inosina, 9-beta-D-Ribofuranosylhypoxanthine, Inosie, iso-prinosine, INO 495, Inosine [INN:JAN], Inosinum [INN-Latin], Inosina [INN-Spanish], hypoxanthine-ribose, Hypoxanthine, 9-beta-D-ribofuranosyl-, Inosin, AI3-52241, NSC 20262, beta-D-Ribofuranoside, hypoxanthine-9, UNII-5A614L51CT, HXR, EINECS 200-390-4, Hypoxanthine 9-beta-D-ribofuranoside, Hypoxanthine-9-beta-D-ribofuranoside, MLS000028518, CHEBI:17596, UGQMRVRMYYASKQ-KQYNXXCUSA-N, 5A614L51CT, 9.beta.-D-Ribofuranosylhypoxanthine, INO, SMR000058316, DSSTox_CID_25993, DSSTox_RID_81278, DSSTox_GSID_45993, 1,9-Dihydro-9-beta-D-ribofuranosyl-6H-purin-6-one, .beta.-Inosine, (2R,3R,4S,5R)-2-(6-Hydroxy-9H-purin-9-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol, 9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1H-purin-6-one, 9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-6,9-dihydro-1H-purin-6-one, 9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-6,9-dihydro-3H-purin-6-one, CAS-58-63-9, NOS, SR-01000721862, Hypoxanthine-9-D-ribofuranoside, Catacol, Hypoxanthine 9-|A-D-ribofuranoside, NSC20262, 9-.beta.-D-Ribofuranosylhypoxanthine, 3h-inosine, D-Inosine, 2ada, 2fqw, .beta.-D-Ribofuranoside, hypoxanthine-9, NCGC00095787-01, Hypoxanthine, 9-.beta.-D-ribofuranosyl-, Inosine,(S), Inotin (TN), Inosine (JAN/INN), PubChem14189, 1a4m, Inosine (8CI,9CI), AC1L1LMO, Opera_ID_1628, bmse000098, bmse000888, bmse000978, cid_6021, CHEMBL1556, SCHEMBL15804, KBioGR_002560, KBioSS_002569, KSC269S6L, ARONIS24558, AC1Q77T9, GTPL4554, 9-b-D-Ribofuranosylhypoxanthine, Inosine, >=99% (HPLC), DTXSID2045993, 9beta-D-Ribofuranosylhypoxanthine, BDBM22104, CTK1G9965, KBio2_002560, KBio2_005128, KBio2_007696, KBio3_003038, 9-b-D-ribofuranosyl-Hypoxanthine, cMAP_000084, MolPort-001-739-662, MolPort-004-959-754, MolPort-006-169-989, HMS2235I17, Hypoxanthine-9-delta-ribofuranoside, 9-beta-D-ribofuranosyl-Hypoxanthine, HY-N0092, ZINC8855117, 9beta-delta-Ribofuranosylhypoxanthine, Tox21_111522, AN-889, ANW-33000, BDBM50366815, beta-D-Ribofuranoside hypoxanthine-9, hypoxanthine-9 beta-D-Ribofuranoside, MFCD00066770, s2442, 9-beta-delta-Ribofuranosylhypoxanthine, AKOS015969695, AKOS015995607, AKOS024462561, Tox21_111522_1, 9-beta-D-ribofuranosyl-9H-purin-6-ol, 9-beta-delta-ribofuranosyl-Hypoxanthine, AM83935, CS-5845, DB04335, MCULE-3095132846, RTR-037177, beta-delta-Ribofuranoside hypoxanthine-9, Hypoxanthine 9-beta-delta-ribofuranoside, hypoxanthine-9 beta-delta-Ribofuranoside, Hypoxanthine-9-beta-delta-ribofuranoside, SMP1_000165, NCGC00096119-02, NCGC00096119-03, AS-11754, CJ-13587, KB-52689, LS-84000, 9-(beta-D-ribofuranosyl)-9H-purin-6-ol, AB0066076, AB1000320, DB-029916, TR-037177, FT-0627217, I0037, A-8687, C00294, D00054, J10406, 1,9-dihydro-9-b-D-ribofuranosyl-6H-Purin-6-one, SR-01000721862-2, SR-01000721862-3, AC89F8E4-FD89-45EE-8B41-94DFC07AB42F, BRD-K79612754-001-21-7, 1,9-Dihydro-9-beta-delta-ribofuranosyl-6H-purin-6-one, 6H-Purin-6-one, 1,9-dihydro-9-beta-D-ribofuranosyl-, 9-beta-D-Ribofuranosyl-1,9-dihydro-6H-purin-6-one (Inosine), (2R,3S,4R,5R)-2-(hydroxymethyl)-5-(6-hydroxy-9H-purin-9-yl)tetrahydrofuran-3,4-diol, 9-(3,4-DIHYDROXY-5-HYDROXYMETHYL-TETRAHYDRO-FURAN-2-YL)-1,9-DIHYDRO-PURIN-6-ONE, 9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purin-6-one, 9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-1H-purin-6-one, 9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-3H-purin-6-one, 12712-98-0, 132953-54-9, 28861-88-3, 292853-81-7, 4181-51-5, 691344-25-9, 740029-83-8, 9-((2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-1H-purin-6(9H)-one, InChI=1/C10H12N4O5/c15-1-4-6(16)7(17)10(19-4)14-3-13-5-8(14)11-2-12-9(5)18/h2-4,6-7,10,15-17H,1H2,(H,11,12,18)/t4-,6-,7-,10-/m1/s


ID: 2209

chemical graph of compound 2209



InChIKey: UHDGCWIWMRVCDJ-CCXZUQQUSA-N
SMILES: C1=CN(C(=O)N=C1N)[C@H]2[C@H]([C@@H]([C@H](O2)CO)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6253
synonyms found at PubChem are:
cytarabine, 147-94-4, Cytosine arabinoside, Ara-C, Arabinocytidine, Cytosar, Arabinosylcytosine, Aracytidine, Cytarabin, Cytarabinoside, Tarabine, Alexan, Udicil, Cytosar-U, 1-beta-D-Arabinofuranosylcytosine, Spongocytidine, Arabitin, Aracytin, Cytarabina, Arafcyt, Depocyt, Erpalfa, DepoCyte, Arabinofuranosylcytosine, Citarabina, Cytarabinum, Aracytine, Cytosinearabinoside, Cytosine-beta-D-arabinofuranoside, Cytonal, beta-D-Arabinosylcytosine, Cytosine arabinofuranoside, Depocyt (liposomal), Cytarabinum [INN-Latin], Citarabina [INN-Spanish], AraC, Cytosine beta-D-arabinoside, Cytosine beta-D-arabinofuranoside, beta-Ara C, Iretin, Cytosine-1-beta-D-arabinofuranoside, 4-Amino-1-((2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)pyrimidin-2(1H)-one, 1beta-D-Arabinosylcytosine, 4-Amino-1-beta-D-arabinofuranosyl-2(1H)-pyrimidinone, Cytosine arabinose, Arabinoside C, 1beta-Arabinofuranasylcytosine, Cytosine 1-beta-D-arabinofuranoside, 1beta-D-Arabinofuranosylcytosine, 1-beta-D-Arabinofaranosylcytosine, Cytosine arabinoside (VAN), beta-Arabinosylcytosine, arabinocytosine, Cytarbel, Beta-cytosine arabinoside, Cytosine-beta-arabinoside, Ara-Cytidine, CHX 3311, 1-Arabinofuranosylcytosine, cytarabine liposome injection, Arabinosyl Cytosine, Cytosine, beta-D-arabinoside, CCRIS 913, Depocyt (TN), 1-beta-D-Arabinosylcytosine, UNII-04079A1RDZ, Cytosine, 1-beta-D-arabinosyl-, 1-beta-D-Arabinofuranosyl-4-amino-2(1H)pyrimidinone, HSDB 3049, (beta-D-Arabinofuranosyl)cytosine, 4-amino-1-beta-D-arabinofuranosylpyrimidin-2(1H)-one, Cytarabine [USAN:INN:BAN:JAN], EINECS 205-705-9, Cytosine, 1-beta-D-arabinofuranosyl-, CHEMBL803, NSC 287459, U 19920A, U-19,920, Cyclocide, 4-Amino-1-arabinofuranosyl-2-oxo-1,2-dihydropyrimidin, AI3-52329, 2(1H)-Pyrimidinone, 4-amino-1-beta-D-arabinofuranosyl-, AR3, 4-Amino-1-beta-D-arabinofuranosyl-2(1H)-pyrimidinon [Czech], C9H13N3O5, CHEBI:28680, 4-Amino-1-arabinofuranosyl-2-oxo-1,2-dihydropyrimidin [Czech], UHDGCWIWMRVCDJ-CCXZUQQUSA-N, 04079A1RDZ, 1-beta-D-arabinofuranosyl-cytosine, U-19920, 1-.beta.-D-arabinofuranosyl-cytosine, 4-Amino-1-b-D-arabinofuranosyl-2-(1H)-pyrimidinone, 4-Amino-1-beta-D-arabinofuranosyl-2(1H)-pyrimidinon, 1-beta-D-Arabinofuranosylcytosine, Cytosine Arabinoside, NCGC00093356-03, 2(1H)-Pyrimidinone, 4-amino-1-y-D-arabinofuranosyl- [CAS], NCI-C04728, 4-Amino-1-arabinofuranosyl-2-oxo-1,2-dihydropyrimidine, Intrathecal cytarabine (also known as ara-C), DSSTox_CID_2877, AC-1075, 1-(arabinofuranosyl)cytosine, 4-amino-1-[(2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one, DSSTox_RID_76771, DSSTox_GSID_22877, 4-amino-1-[(2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2-dihydropyrimidin-2-one, Intrathecal (injected into the spinal fluid) DepoCyt, 2(1H)-Pyrimidinone, 4-amino-1-.beta.-D-arabinofuranosyl-, Cytosine beta-D-arabinofuranoside hydrochloride, CYTARABINE (SEE ALSO CYTARABINE HYDROCHLORIDE 69-74-9), CAS-147-94-4, SMR000449317, Cytartbine, 1-beta-arabinofuranosylcytosine, SR-01000075773, NSC287459, cytarabine liposome, Cytosar-U (TN), Cytarabine [USAN:USP:INN:BAN:JAN], MK 8242, PubChem14152, beta -arabinosylcytosine, 1-b-D-ribosyl-Cytosine, beta -cytosine arabinoside, beta -D-arabinosylcytosine, Cytosine-beta -arabinoside, D07XSN, AC1L1M4F, AC1Q52OJ, SCHEMBL3140, 1-b-D-Ribofuranosylcytosine, 1beta -D-Arabinosylcytosine, BIDD:PXR0139, cytosine-1b-D-Ribofuranoside, Lopac0_000316, 69-74-9 (hydrochloride), KSC917S2P, MLS000758310, MLS001066340, MLS001424023, 1-beta-D-Arabinosyl-Cytosine, 1-beta-delta-ribosyl-Cytosine, BIDD:GT0371, Cytosine, beta -D-arabinoside, 1beta -Arabinofuranasylcytosine, Cytarabine (JP15/USP/INN), Cytarabine (JP17/USP/INN), GTPL4827, PYR287, 1-beta-D-ribofuranosyl-Cytosine, cytosine-1b-delta-Ribofuranoside, DTXSID3022877, 1beta-delta-Ribofuranosylcytosine, CTK8B7927, 1beta -D-Arabinofuranosylcytosine, 1-(b-D-Arabinofuranosyl)cytosine, Cytosine, 1-beta -D-arabinosyl-, MolPort-001-792-509, 1-beta -d-arabinofuranosylcytosine, 1-beta-D-arabinofuranosyl cytosine, 1-beta-delta-Ribofuranosylcytosine, Cytosine-beta -D-arabinofuranoside, HMS2051K19, HMS2090A18, HMS2230M16, HMS3713N12, 1-beta -D-Arabinofaranosylcytosine, cytosine-1beta-delta-Ribofuranoside, 1-beta-delta-ribofuranosyl-Cytosine, BCP02876, BTB15125, ZINC3795098, Tox21_111203, Tox21_301971, ANW-58969, BDBM50087289, CCG-51297, EBD145460, GP6403, LS-860, MFCD00066487, s1648, (non-labelled)Cytarabine-13C-15N2, AKOS007930145, AKOS015896896, AM84428, CS-2177, Cytosine, 1-beta -D-arabinofuranosyl-, DB00987, KS-5063, MCULE-3945147956, NC00070, RL01868, KS-0000022L, NCGC00093356-04, NCGC00093356-05, NCGC00093356-06, NCGC00142483-02, NCGC00255381-01, AJ-45634, AK-54744, CPD000449317, HY-13605, KB-09511, SAM001247012, SRI-10828-19, SRI-10828-20, SRI-10828_24, SY004943, AB0005212, AX8008499, SL-000002, TL8001048, TR-008148, FT-0082880, FT-0624314, ST24043183, C02961, D00168, J10463, K-4708, 10163-EP2272828A1, 10163-EP2284920A1, 10163-EP2287165A2, 10163-EP2287166A2, 10163-EP2292603A1, 10163-EP2292620A2, 10163-EP2298764A1, 10163-EP2298765A1, 10163-EP2298774A1, 10163-EP2299509A1, 10163-EP2301921A1, 10163-EP2301926A1, 10163-EP2301936A1, 10163-EP2308843A1, 10163-EP2314558A1, 10163-EP2316452A1, 10163-EP2371810A1, 10163-EP2372804A1, 10163-EP2378585A1, 15153-EP2270018A1, 15153-EP2272832A1, 15153-EP2275420A1, 15153-EP2277565A2, 15153-EP2277566A2, 15153-EP2277567A1, 15153-EP2277568A2, 15153-EP2277569A2, 15153-EP2277570A2, 15153-EP2277865A1, 15153-EP2292280A1, 15153-EP2295055A2, 15153-EP2295416A2, 15153-EP2295426A1, 15153-EP2295427A1, 15153-EP2298748A2, 15153-EP2298764A1, 15153-EP2298765A1, 15153-EP2298768A1, 15153-EP2298778A1, 15153-EP2298780A1, 15153-EP2301928A1, 15153-EP2305642A2, 15153-EP2305689A1, 15153-EP2308833A2, 15153-EP2308855A1, 15153-EP2308861A1, 15153-EP2311453A1, 15153-EP2311808A1, 15153-EP2311825A1, 15153-EP2311829A1, 15153-EP2311840A1, 15153-EP2311842A2, 15153-EP2314590A1, 15153-EP2316832A1, 15153-EP2316833A1, 15187-EP2270008A1, 15187-EP2280012A2, 15187-EP2281815A1, 15187-EP2292233A2, 15187-EP2292615A1, 15187-EP2292617A1, 15187-EP2301928A1, 15187-EP2301933A1, 15187-EP2305640A2, 15187-EP2305671A1, 15187-EP2308833A2, 15187-EP2311827A1, 15187-EP2311840A1, 15187-EP2316832A1, 15187-EP2316833A1, 147C944, 4-Amino-1-b-D-ribofuranosyl-2(1H)-pyrimidinone, C-55053, SR-01000721860, Ara-C, Cytosine Arabinoside, Cytosar-U, Cytarabine, J-520199, J-700005, J-700166, SR-01000075773-3, SR-01000075773-5, SR-01000721860-6, 1-beta -D-Arabinofuranosyl-4-amino-2(1H)pyrimidinone, 2(1H)-Pyrimidinone, 4-amino-1- -D-arabinofuranosyl, BRD-K33106058-001-07-7, BRD-K33106058-003-20-6, 2(1H)-Pyrimidinone, 4-amino-1-|A-D-arabinofuranosyl-, 2(1H)-Pyrimidinone, 4-amino-1beta -D-arabinofuranosyl-, 4-Amino-1-beta-delta-ribofuranosyl-2(1H)-pyrimidinone, Z1522566619, 2(1H)-Pyrimidinone, 4-amino-1-beta -D-arabinofuranosyl-, 2(1H)-Pyrimidinone, 4-amino-1-D-arabinofuranosyl-[CAS], Cytarabine, European Pharmacopoeia (EP) Reference Standard, 1-(b-D-Ribofuranosyl)-2-oxo-4-amino-1,2-dihydro-1,3-diazine, Cytarabine, United States Pharmacopeia (USP) Reference Standard, Cytarabine; 2(1H)-Pyrimidinone,4-amino-1-a-Darabinofuranosyl-, Cytosine beta-D-arabinofuranoside, crystalline, >=90% (HPLC), 1-(b-delta-Ribofuranosyl)-2-oxo-4-amino-1,2-dihydro-1,3-diazine, Cytosine beta-D-arabinofuranoside, Vetec(TM) reagent grade, 90%, Cytarabine, Pharmaceutical Secondary Standard; Certified Reference Material, 4-amino-1-[(2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidin-2-one


ID: 2210

chemical graph of compound 2210



InChIKey: UHDGCWIWMRVCDJ-XVFCMESISA-N
SMILES: C1=CN(C(=O)N=C1N)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6175
synonyms found at PubChem are:
cytidine, 65-46-3, Cytosine riboside, 1-beta-D-Ribofuranosylcytosine, 4-Amino-1-beta-D-ribofuranosyl-2(1H)-pyrimidinone, 1beta-Ribofuranosylcytosine, beta-D-Ribofuranoside, cytosine-1, 1-beta-Ribofuranosylcytosine, Cytidin, Zytidin, 4-Amino-1beta-D-ribofuranosyl-2(1H)-pyrimidinone, Cytosine, 1-beta-D-ribofuranosyl-, 1beta-2'-Ribofuranosylcytosine, d-, UNII-5CSZ8459RP, NSC 20258, Cyd, CHEBI:17562, 2(1H)-Pyrimidinone, 4-amino-1-beta-D-ribofuranosyl-, EINECS 200-610-9, 2(1H)-Pyrimidinone, 4-amino-1beta-D-ribofuranosyl-, 1beta-D-Ribofuranosylcytosine, 5CSZ8459RP, cytosine-1beta-D-Ribofuranoside, UHDGCWIWMRVCDJ-XVFCMESISA-N, 4-amino-1-beta-D-ribofuranosylpyrimidin-2(1H)-one, 4-amino-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one, 4-amino-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2-dihydropyrimidin-2-one, 4-amino-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidin-2-one, SMR000058243, 1.beta.-Ribofuranosylcytosine, 1.beta.-D-Ribofuranosylcytosine, Cytosine beta-D-riboside, Cytosine-1-beta-D-ribofuranoside, .beta.-D-Ribofuranoside, cytosine-1, 3h-cytidine, Cytosine, 1-.beta.-D-ribofuranosyl-, Posilent (TN), CTN, beta.-D-Ribo-C, Cytidine, 99%, cytidine-2'-13C, cytidine, N-15N-, PubChem14146, CP-C, 4-Amino-1.beta.-D-ribofuranosyl-2(1H)-pyrimidinone, bmse000190, bmse000969, bmse001020, D0E7ES, Epitope ID:141494, 2(1H)-Pyrimidinone, 4-amino-1-.beta.-D-ribofuranosyl-, AC1L1LY9, AC1Q6C2P, SCHEMBL7179, beta-D-ribofuranosyl-cytidine, KSC353A2P, MLS000049947, MLS002207040, 1-beta-D-ribosyl- (6CI), CHEMBL95606, CYT007, GTPL4728, 1-Beta-d-ribofuranoside cytosine, CTK2F3027, BIC2010, MolPort-000-716-085, ZX-AFC000579, Cytidine, >=99.0% (HPLC), HY-B0158, ZINC2583632, ANW-35046, GC1136, KM0929, MFCD00006545, MMV638723, s2053, SBB003195, AKOS015888568, AM83932, CS-1989, DB02097, MCULE-3044641322, RTR-022281, SRI-2352_17, NCGC00093356-08, NCGC00142483-01, AJ-43263, AN-23747, AS-12696, BC679398, CJ-10310, KB-49502, SC-09086, ST056938, AB0012341, DB-029614, LS-135845, TL8004649, TR-022281, FT-0624315, ST24046405, 65C463, C00475, D07769, 16501-EP2281563A1, 16501-EP2287165A2, 16501-EP2287166A2, 16501-EP2289892A1, 16501-EP2292088A1, 16501-EP2292620A2, 16501-EP2292630A1, 16501-EP2295407A1, 16501-EP2298736A1, 16501-EP2298783A1, 16501-EP2305808A1, 16501-EP2316459A1, 1-(beta-D-ribofuranosyl)-4-aminopyrimidin-2-one, I14-8299, J-700167, BRD-K71847383-001-12-5, 4-Amino-1-.beta.-D-ribofuranosyl-2-(1H)-pyrimidinone, F0348-2240, 6D2DC474-DD76-4081-8B34-10605C218F49, 1-(beta-D-Ribofuranosyl)-2-oxo-4-amino-1,2-dihydro-1,3-diazine, Cytidine, BioReagent, suitable for cell culture, powder, >=99%, 111398-92-6, 185553-94-0, 4-amino-1-((2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)pyrimidin-2(1H)-one, 4395-95-3, 494210-74-1, 873077-03-3


ID: 2211

chemical graph of compound 2211



InChIKey: UHPXMYLONAGUPC-WKLLBTDKSA-N
SMILES: CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)N=CN3CCCCCC3)C(=O)OCOC(=O)C(C)(C)C)C.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 115162
synonyms found at PubChem are:
pivmecillinam hydrochloride, Melysin, 32887-03-9, Pivmecillinam (hydrochloride), Selexid, UNII-48FX7N21H2, amdinocillin pivoxil hydrochloride, Pivmecilinamo clorhidrato [Spanish], EINECS 251-278-7, FL-1039, pivmecilinamo clorhidrato, MLS002154128, 48FX7N21H2, 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-(((hexahydro-1H-azepin-1-yl)methylene)amino)-3,3-dimethyl-7-oxo-, (2,2-dimethyl-1-oxopropoxy)methyl ester, monohydrochloride, (2S-(2alpha,5alpha,6beta))-, CHEBI:51213, 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-(((hexahydro-1H-azepin-1-yl)methylene)amino)-3,3-dimethyl-7-oxo-, (2,2-dimethyl-1-oxopropoxy)methyl ester, monohydrochloride, (2S,5R,6R)-, NCGC00016813-01, CAS-32887-03-9, C21H33N3O5S.ClH, SR-01000838842, 2,2-dimethylpropanoyloxymethyl (2S,5R,6R)-6-[(E)-azepan-1-ylmethylideneamino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate;hydrochloride, Melysin (TN), Pivaloylmethoxy (2S, Pivmecillinamhydrochlorid, AC1L3GMW, Pivmecillinami Hydrochloridum, DSSTox_CID_25453, DSSTox_RID_80889, DSSTox_GSID_45453, C21H33N3O5S.HCl, SCHEMBL232687, CHEMBL1355196, DTXSID1045453, HY-B0810A, Pivmecillinam hydrochloride [JAN], HMS1571C08, BCP07839, Pivmecillinam hydrochloride (JP17), Tox21_110625, 3975AH, AKOS030526136, CCG-221053, SMR001233435, LS-149886, D01499, J-018915, SR-01000838842-3, 2,2-dimethylpropanoyloxymethyl (2S,5R,6R)-6-(azepan-1-ylmethylideneamino)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate hydrochloride, 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-(((hexahydro-1H-azepin-1-yl)methylene)amino)-3,3-dimethyl-7-oxo-, hydroxymethyl ester, pivalate (ester),monohydrochloride, (+)-, 59866-09-0, Methylene 2,2-dimethylpropanoate (2S,5R,6R)-6-[[(hexahydro-1H-azepin-1-yl)methylene]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate hydrochloride, SCHEMBL1650614, [(2,2-dimethylpropanoyl)oxy]methyl 6beta-[(azepan-1-ylmethylidene)amino]-2,2-dimethylpenam-3alpha-carboxylate hydrochloride


ID: 2212

chemical graph of compound 2212



InChIKey: UHRWOVVMQAASAO-UHFFFAOYSA-N
SMILES: CC1(CC23C1CCC2(C(CCC3=O)O)C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 4579738
synonyms found at PubChem are:
3-NOR-3-OXOPANASINSAN-6-OL, SR-01000388310, KBio2_003750, Spectrum_000702, SpecPlus_000228, AC1NDPR2, Spectrum2_001771, Spectrum3_001308, Spectrum4_001457, Spectrum5_000073, BSPBio_002975, KBioGR_001973, KBioSS_001182, SPECTRUM300110, DivK1c_006324, SPBio_001661, CHEMBL1329649, KBio1_001268, KBio2_001182, KBio2_006318, KBio3_002195, CHEBI:110190, MolPort-003-179-801, CCG-38420, SDCCGMLS-0066517.P001, NCGC00095585-01, NCGC00095585-02, SR-01000388310-1, SR-01000388310-2, BRD-A59682351-001-03-1, 5-hydroxy-2,2,4a-trimethyl-2a,3,4,5,6,7-hexahydro-1H-cyclobut[i]inden-8-one, 5-hydroxy-2,2,4a-trimethyl-2a,3,4,5,6,7-hexahydro-1H-cyclobuta[i]inden-8-one


ID: 2213

chemical graph of compound 2213



InChIKey: UIAGMCDKSXEBJQ-UHFFFAOYSA-N
SMILES: CC1=C(C(C(=C(N1)C)C(=O)OC(C)C)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCCOC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 4497
synonyms found at PubChem are:
nimodipine, 66085-59-4, Nimotop, Periplum, Nimodipino, Nimodipinum, Nymalize, Admon, Nimodipinum [INN-Latin], Nimodipino [INN-Spanish], BAY e 9736, Bay-e-9736, Isopropyl 2-methoxyethyl 1,4-dihydro-2,6-dimethyl-4-(m-nitrophenyl)-3,5-pyridinedicarboxylate, NimoGel, DRG-0139, Nimotop(TM), Bay-E 9736, Nimodipine [USAN:BAN:INN], CHEBI:7575, Nimodipine (Nimotop), 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-, 2-methoxyethyl 1-methylethyl ester, 2-Methoxyethyl-1-methylethyl ester, NIMOTOP (TN), Nimodipine (USAN/INN), EINECS 266-127-0, BRN 0459792, MLS000863294, 3-(2-methoxyethyl) 5-propan-2-yl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate, 3-isopropyl 5-(2-methoxyethyl) 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate, UIAGMCDKSXEBJQ-UHFFFAOYSA-N, C21H26N2O7, EG-1961, NCGC00015714-09, SMR000058300, N-149, DSSTox_CID_3370, 1,4-Dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylic acid, DSSTox_RID_76998, isopropyl 2-methoxyethyl 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylate, DSSTox_GSID_23370, Periplum, Nimotop, BRN 0459792, DRG-0139, 2-methoxyethyl propan-2-yl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate, 3-O-(2-methoxyethyl) 5-O-propan-2-yl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate, Brainal, Kenesil, Remontal, Calnit, Modus, 3,5-pyridinecarboxylic acid 2-methoxyethyl 1-methylethyl ester, Nimodipin Hexal, Nimodipin ISIS, Nimodipin-ISIS, Nimodipino Bayvit, 4-[4-(4-chlorophenyl)-4-hydroxy-1-piperidyl]-N,N-dimethyl-2,2-diphenyl-butanamide, 1,4-Dihydro-2,6-dimethyl-4-(3&prime;-nitrophenyl)-3,5-pyridinedicarboxylic acid 2-methoxyethyl-1-methylethyl Ester, 1,4-Dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylic acid 2-methoxyethyl 1-methylethyl ester, 1-methylethyl 2-(methyloxy)ethyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate, 2,6-dimethyl-4-(3'-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid 3-beta-methoxyethyl ester 5-isopropyl ester, 3,5-pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl), 2-methoxyethyl 1-methylethyl ester, 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-,2-methoxyethyl 1-methylethyl ester, O5-isopropyl O3-(2-methoxyethyl) 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate, SR-01000075335, nemotan, NimoVent, NimodipinISIS, Nimodipime,(S), Nimodipine [USAN:USP:INN:BAN], Nymalize (TN), Nimotop, Nimodipine, CAS-66085-59-4, Opera_ID_14, PubChem16211, Spectrum_001880, SpecPlus_000716, AC1L1IAS, Elan Brand of Nimodipine, Vita Brand of Nimodipine, Prestwick0_000918, Prestwick1_000918, Prestwick2_000918, Prestwick3_000918, Spectrum2_001562, Spectrum3_000766, Spectrum4_000791, Spectrum5_001687, Bayer Brand of Nimodipine, Hexal Brand of Nimodipine, Bayvit Brand of Nimodipine, D0XN1F, Esteve Brand of Nimodipine, AC1Q4G7S, Almirall Brand of Nimodipine, Alpharma Brand of Nimodipine, CBiol_001832, Lopac0_000891, SCHEMBL34041, BSPBio_000796, BSPBio_001397, BSPBio_002412, KBioGR_000117, KBioGR_001262, KBioSS_000117, KBioSS_002408, Andromaco Brand of Nimodipine, Cantabria Brand of Nimodipine, MLS000069381, MLS001076550, MLS001424155, MLS002154061, MLS002172461, MLS003899190, DivK1c_006812, SPECTRUM1503600, SPBio_001464, SPBio_002985, BPBio1_000876, GTPL2523, CHEMBL3197349, DTXSID5023370, CTK8J9033, KBio1_001756, KBio2_000117, KBio2_002403, KBio2_002685, KBio2_004971, KBio2_005253, KBio2_007539, KBio3_000233, KBio3_000234, KBio3_001632, 3-isopropyl 5-(2-methoxyethyl), BRD8407, MolPort-001-840-190, Bio1_000118, Bio1_000607, Bio1_001096, Bio2_000117, Bio2_000597, HMS1361F19, HMS1570H18, HMS1791F19, HMS1922E04, HMS1989F19, HMS2052M05, HMS2089H13, HMS2093G11, HMS2097H18, HMS2234B05, HMS3262D04, HMS3266O22, HMS3369G07, HMS3394M05, HMS3402F19, HMS3657I03, HMS3714H18, Pharmakon1600-01503600, ACT02628, ALBB-015317, BCP21152, BRD-8407, HY-B0265, 2,6-dimethyl-4-(3-nitrophenyl)-, Nimotop|||Admon|||BAY-e 9736, Tox21_110202, Tox21_500891, BBL028286, BDBM50101971, CCG-39340, MFCD00153848, NSC758476, s1747, STK642934, AKOS005174934, AKOS015852459, Tox21_110202_1, AC-8484, AN-7970, CCG-101085, CS-2253, DB00393, KS-1304, LP00891, MCULE-4717687158, NC00335, NSC-758476, IDI1_033867, NCGC00015714-04, NCGC00015714-05, NCGC00015714-06, NCGC00015714-07, NCGC00015714-08, NCGC00015714-10, NCGC00015714-11, NCGC00015714-12, NCGC00015714-13, NCGC00015714-16, NCGC00021456-02, NCGC00024675-02, NCGC00024675-03, NCGC00024675-04, NCGC00024675-05, NCGC00024675-06, NCGC00024675-07, NCGC00024675-08, NCGC00024675-09, NCGC00261576-01, 1,4-Dihydro-2,6-dimethyl-4-(3&prime, CPD002530605, SAM001246890, SC-17122, SMR002530605, ST082783, SBI-0050866.P003, AB0012346, AB1009471, LS-131292, AB00513963, EU-0100891, FT-0082761, FT-0602600, N0896, R2304, C07267, D00438, 1,4-Dihydro-2,6-dimethyl-4-(3-nitrophenyl)-, AB00053314-03, AB00053314-04, AB00053314_05, AB00053314_06, 085N594, I06-0230, SR-01000075335-1, SR-01000075335-2, SR-01000075335-4, SR-01000075335-5, SR-01000075335-7, BRD-A58048407-001-06-3, BRD-A58048407-001-09-7, Nimodipine, British Pharmacopoeia (BP) Reference Standard, Nimodipine, European Pharmacopoeia (EP) Reference Standard, Nimodipine, United States Pharmacopeia (USP) Reference Standard, Nimodipine, Pharmaceutical Secondary Standard; Certified Reference Material, Nimodipine for peak identification, EuropePharmacopoeia (EP) Reference Standard, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridine-dicarboxylic acid isopropyl 2-methoxyethyl ester, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinecarboxylic acid 2-methoxyethyl 1-methylethyl ester, 1,4-Dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylic acid 2-methoxyethyl 1-methylethyl ester; Isopropyl 2-methoxyethyl 1,4-dihydro-2,6-dimethyl-4-(m-nitrophenyl)-3,5-pyridinedicarboxylate, 1,4-Dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylic acid 2-methyloxyethyl 1-methylethyl ester, 2-Methoxyethyl 1-Methylethyl 1,4-Dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylate, 3-Isopropyl 5-(2-methoxyethyl) 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydro-3,5-pyridinedicarboxylate #, isopropyl 2-methoxyethyl 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)pyridine-3,5-dicarboxylate, isopropyl 2-methoxyethyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate, methylethyl 5-[(2-methoxyethyl)oxycarbonyl]-2,6-dimethyl-4-(3-nitrophenyl)-1,4 -dihydropyridine-3-carboxylate, O5-(2-methoxyethyl) O3-propan-2-yl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate


ID: 2214

chemical graph of compound 2214



InChIKey: UIAYVIIHMORPSJ-UHFFFAOYSA-N
SMILES: CN(C1CCCCC1)C(=O)CCCOC2=CC3=C(C=C2)NC(=O)C=C3

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 2753
synonyms found at PubChem are:
cilostamide, 68550-75-4, ciloalamide, OPC 3689, Cilostamide [INN], N-Cyclohexyl-N-methyl-4-(1,2-dihydro-2-oxo-6-quinolyloxy)butyramide, Cilostamidum [INN-Latin], Cilostamida [INN-Spanish], UNII-45S5605Q18, OPC 3869, CHEMBL34431, NCGC00015269-03, N-cyclohexyl-N-methyl-4-[(2-oxo-1H-quinolin-6-yl)oxy]butanamide, 45S5605Q18, Butanamide, N-cyclohexyl-4-((1,2-dihydro-2-oxo-6-quinolinyl)oxy)-N-methyl-, DSSTox_CID_25140, DSSTox_RID_80698, DSSTox_GSID_45140, Cilostamida, Cilostamidum, 6-[3-(N-Cyclohexyl-N-methylcarbamoyl)propoxy]quinolin-2[1H]-one, N-Cyclohexyl-4-((1,2-dihydro-2-oxo-6-quinolyl)oxy)-N-methylbutyramide, N-cyclohexyl-N-methyl-4-[(2-oxo-1,2-dihydroquinolin-6-yl)oxy]butanamide, CAS-68550-75-4, SR-01000075781, OPC-3689, Tocris-0915, AC1L1EDZ, Lopac-C-7971, ACMC-20f49n, D0J0CB, AC1Q5I6X, Lopac0_000288, SCHEMBL49742, GTPL5167, DTXSID3045140, BDBM15297, CHEBI:92503, OPC3689, MolPort-003-940-830, UIAYVIIHMORPSJ-UHFFFAOYSA-N, HMS2090J06, HMS3260J18, HMS3267A21, BCP08355, n-cyclohexyl-4-[(2-hydroxyquinolin-6-yl)oxy]-n-methylbutanamide, OCP 3689, ZINC3872076, Tox21_110119, Tox21_500288, BDBM50027177, BS0052, HSCI1_000142, MFCD00673958, N-cyclohexyl-N-methyl-4-(1,2-dihydro- 2-oxo-6-quinolyloxy)butyramide, AKOS024458692, AKOS030528583, Cilostamide phosphodiesterase inhibitor, Tox21_110119_1, CCG-204383, Cilostamide, phosphodiesterase inhibitor, LP00288, KS-0000004Z, NCGC00015269-01, NCGC00015269-02, NCGC00015269-04, NCGC00015269-05, NCGC00015269-06, NCGC00024869-01, NCGC00024869-02, NCGC00024869-03, NCGC00260973-01, CJ-10998, HY-101312, KB-125286, LS-176675, B6500, CS-0021135, EU-0100288, C 7971, AB01275528-01, SR-01000075781-1, SR-01000075781-3, BRD-K28578425-001-01-3, BRD-K28578425-001-02-1, BRD-K28578425-001-03-9, BRD-K28578425-001-04-7, BRD-K28578425-001-06-2, 6-[3-(N-cyclohexyl-N-methylaminocarbonyl)propoxy]carbostyril, 6-[3-(N-methyl-N-cyclohexylaminocarbonyl)propoxy]-carbostyril, 6-[3-(N-methyl-N-cyclohexylaminocarbonyl)propoxy]carbostyril, N-Cyclohexyl-N-methyl-4-(2-oxo-1,2-dihydro-quinolin-6-yloxy)-butyramide, BUTANAMIDE,N-CYCLOHEXYL-4-[(1,2-DIHYDRO-2-OXO-6-QUINOLINYL)OXY]-N-METHYL-


ID: 2215

chemical graph of compound 2215



InChIKey: UIKROCXWUNQSPJ-VIFPVBQESA-N
SMILES: CN1[C@@H](CCC1=O)C2=CN=CC=C2

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 854019
synonyms found at PubChem are:
cotinine, (-)-Cotinine, 486-56-6, Cotinina, Cotininum, (S)-(-)-Cotinine, Cotinine (-), (S)-Cotinine, UNII-K5161X06LL, (S)-1-Methyl-5-(3-pyridinyl)-2-pyrrolidinone, (5S)-1-methyl-5-(pyridin-3-yl)pyrrolidin-2-one, 2-Pyrrolidinone, 1-methyl-5-(3-pyridinyl)-, (5S)-, (S)-1-Methyl-5-(3-pyridyl)-2-pyrrolidinone, NICOTINE IMPURITY C, CHEBI:68641, S(-)-1-Methyl-5-(3-pyridyl)-2-pyrrolidone, (5S)-1-methyl-5-pyridin-3-ylpyrrolidin-2-one, UIKROCXWUNQSPJ-VIFPVBQESA-N, K5161X06LL, Cotinine [INN], Cotininum [INN-Latin], Cotinina [INN-Spanish], (5S)-1-methyl-5-(3-pyridyl)pyrrolidin-2-one, DSSTox_CID_27576, DSSTox_RID_82428, DSSTox_GSID_47576, CCRIS 7625, BRD4010, BRD-4010, EINECS 207-634-9, NIH 10498, BRN 0083099, SMR000449278, SR-01000075768, HSDB 7805, NCGC00093739-04, CAS-486-56-6, Prestwick_134, L-COTININE, AC1LGYRL, Spectrum_001984, (S)-1-methyl-5-(pyridin-3-yl)pyrrolidin-2-one, (S)-(-)-1-Methyl-5-(3-pyridyl)-2-pyrrolidinone, Prestwick0_000082, Prestwick1_000082, Prestwick2_000082, Prestwick3_000082, Spectrum3_000700, Spectrum4_001793, Spectrum5_000465, bmse000577, D0TY5N, (-)-Cotinine, 98%, (5S)-(-)-1-Methyl-5-(pyridin-3-yl)pyrrolidin-2-one, COTININE (-)-, (5S)-1-methyl-5-(3-pyridinyl)-2-pyrrolidinone, Lopac0_000285, SCHEMBL49060, BSPBio_000004, BSPBio_002459, KBioGR_002368, KBioSS_002550, 5-24-02-00504 (Beilstein Handbook Reference), MLS000758262, MLS001423950, DivK1c_000861, SPECTRUM1500208, SPBio_001943, (-)-Cotinine, >=98%, BPBio1_000006, CHEMBL578211, MEGxp0_001870, DTXSID1047576, ACon1_000202, KBio1_000861, KBio2_002541, KBio2_005109, KBio2_007677, KBio3_001679, OR7251T, MolPort-001-742-588, MolPort-044-812-170, NINDS_000861, US8609708, 91 Cotinine, HMS1568A06, HMS1920A14, HMS2051A15, HMS2091G22, HMS2095A06, HMS2232F15, HMS3260J12, Pharmakon1600-01500208, ZINC402766, (-)-Cotinine, analytical standard, HY-B1178, ZX-AT017484, Tox21_111219, Tox21_300615, Tox21_500285, 4205AE, BDBM50370573, BN0830, MFCD00077696, NSC756704, AKOS007930814, Tox21_111219_1, (-)-Cotinine 1.0 mg/ml in Methanol, CCG-100799, CS-4787, FCH3491801, LP00285, MCULE-8421169764, NC00049, NSC-756704, PB32127, SDCCGMLS-0066565.P001, IDI1_000861, NCGC00093739-08, NCGC00093739-13, NCGC00254396-01, NCGC00260970-01, AK165303, AS-50387, CPD000449278, SAM001247007, ST057157, ZB012942, SBI-0050273.P003, DB-070947, AM20061246, B7277, EU-0100285, FT-0665182, FT-0695369, C 5923, Q-1537, AB00053721_08, (5S)-1-methyl-5-pyridin-3-yl-pyrrolidin-2-one, A827581, SR-01000075768-1, SR-01000075768-5, SR-01000075768-6, BRD-K94144010-001-04-8, BRD-K94144010-001-05-5, BRD-K94144010-001-09-7, (S)-1-METHYL-5-PYRIDIN-3-YL-PYRROLIDIN-2-ONE, I14-105437, (-)-Cotinine solution, drug standard, 1.0 mg/mL in methanol, 2-Pyrrolidinone, 1-methyl-5-(3-pyridinyl)-, (S)- (9CI), 3-[(2S)-(-)-1-METHYL-5-OXOPYRROLIDIN-2-YL]PYRIDINE, (5S)-(-)-1-METHYL-2-OXO-5-(PYRIDIN-3-YL)PYRROLIDINE, (5S)-1-Methyl-5-(pyridin-3-yl)pyrrolidin-2-one ((-)-Cotinine), (-)-Cotinine solution, 1.0 mg/mL in methanol, ampule of 1 mL, certified reference material, Nicotine Related Compound C, United States Pharmacopeia (USP) Reference Standard, 75202-09-4


ID: 2216

chemical graph of compound 2216



InChIKey: UITFTHVYOCLXCA-UHFFFAOYSA-N
SMILES: C1=CC=NC(=C1)C2=NOC(=C2)CCCO

biological descriptors:

CFTR relevance: inactive

Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown

reference list:

"MH Nantz" "LJ Galietta" "K By" "EJ Niedzinski" "M Eda" "MF Springsteel" "MJ Haddadin" "MJ Kurth" "AS Verkman"


CID is 10632010
synonyms found at PubChem are:
3-(2-Pyridinyl)-5-isoxazole-1-propanol


ID: 2217

chemical graph of compound 2217



InChIKey: UJEWTUDSLQGTOA-UHFFFAOYSA-N
SMILES: C1CCN(C1)C2=C(C(=CC(=C2)C(=O)O)S(=O)(=O)N)OC3=CC=CC=C3

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 4849
synonyms found at PubChem are:
piretanide, 55837-27-9, Tauliz, Arlix, 4-phenoxy-3-(pyrrolidin-1-yl)-5-sulfamoylbenzoic acid, Piretanido [Spanish], Eurelix, HOE 118, Piretanidum [INN-Latin], Piretanido [INN-Spanish], UNII-DQ6KK6GV93, Arelix (TN), C17H18N2O5S, EINECS 259-852-9, Hoe-118, BRN 5633965, DQ6KK6GV93, 4-phenoxy-3-pyrrolidin-1-yl-5-sulfamoylbenzoic acid, 4-Phenoxy-3-(1-pyrrolidinyl)-5-sulfamoylbenzoic acid, S 734118, S 73 4118, NCGC00016878-01, 3-(Aminosulfonyl)-4-phenoxy-5-(1-pyrrolidinyl)-benzoic acid, Benzoic acid, 3-(aminosulfonyl)-4-phenoxy-5-(1-pyrrolidinyl)-, Acide phenoxy-4-(1-pyrrolidinyl)-3-sulfamoyl-5 benzoique [French], CAS-55837-27-9, DSSTox_CID_3488, DSSTox_RID_77050, DSSTox_GSID_23488, W-105543, Piretanido, Piretanidum, diumax, Piretanide [USAN:BAN:INN:JAN], Piretanide [USAN:INN:BAN:JAN], Piretanide (JAN), AC1Q6UWQ, Prestwick0_001047, Prestwick1_001047, Prestwick2_001047, Prestwick3_001047, D09NNS, AC1L1J3E, SCHEMBL49473, BSPBio_000974, MLS002154123, Piretanide (JAN/USAN/INN), SPBio_002907, BPBio1_001072, CHEMBL349803, GTPL4742, DTXSID2023488, CHEBI:32015, Acide phenoxy-4-(1-pyrrolidinyl)-3-sulfamoyl-5 benzoique, UJEWTUDSLQGTOA-UHFFFAOYSA-N, HMS1571A16, HMS2098A16, HMS2230G15, HMS3372O22, HMS3715A16, ZINC3812930, Tox21_110661, AKOS015895445, Tox21_110661_1, AN-6573, API0001532, CCG-221047, DB02925, NCGC00016878-02, NCGC00016878-04, AJ-45687, CC-33824, LS-36049, SMR001233430, AX8148304, KB-242980, AB00514020, FT-0673944, D01634, 837P279, C-23760, SR-01000838837, I06-0537, S-734118, SR-01000838837-2, 3-(1-pyrrolidinyl)-4-phenoxy-5-sulphamylbenzoic acid, 4-phenoxy-3(1-pyrrolidinyl)-5-sulfamoyl-benzoic acid, 4-Phenoxy-3-(pyrrolidin-1-yl)-5-sulfamoylbenzoicacid, 4-phenoxy-3-pyrrolidin-1-yl-5-sulfamoyl-benzoic acid, BRD-K87990216-001-03-7, 4-phenoxy-3-(1-pyrrolidinyl)-5-sulphamoylbenzoic acid, F2173-0688, 3-(aminosulfonyl)-4-(phenyloxy)-5-pyrrolidin-1-ylbenzoic acid


ID: 2218

chemical graph of compound 2218



InChIKey: UJXLTDHDLUBZBL-UHFFFAOYSA-N
SMILES: CC1C2=CC(=C(C=C2CCN1)OC)OC.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 44458
synonyms found at PubChem are:
1,2,3,4-Tetrahydro-6,7-dimethoxy-1-methylisoquinoline hydrochloride, ISOQUINOLINE, 1,2,3,4-TETRAHYDRO-6,7-DIMETHOXY-1-METHYL-, HYDROCHLORIDE, AC1L2BVY, 5784-74-7 (Parent), EiM08-43131, LS-85915, 6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium chloride, 63283-42-1, 6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline hydrochloride, Salsolidine hydrochloride, Isoquinoline, 6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydro, hydrochloride, 6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline hcl, 6,7-Dimethoxy-1-methyl-1,2,3,4-tetrahydro-isoquinoline hydrochloride, Prestwick_860, AC1O4WI9, AC1Q3C4C, MLS002153861, SCHEMBL5242077, CHEMBL1883920, CTK6J9749, MolPort-001-838-604, UJXLTDHDLUBZBL-UHFFFAOYSA-N, HMS1569L05, NSC34659, NSC-34659, AKOS024275419, CCG-220532, MCULE-9434960460, SMR001233219, ST011972, SR-01000842149-5, Z2583384725, 6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline;hydrochloride, 6,7-Dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline hydrochloride,99%


ID: 2219

chemical graph of compound 2219



InChIKey: UKFAWRZYFYOXEG-UHFFFAOYSA-N
SMILES: COC1=C(C=C2C(=C1)COC2=O)OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 230460
synonyms found at PubChem are:
5,6-Dimethoxyisobenzofuran-1(3H)-one, 531-88-4, 759409-69-3, 5,6-DIMETHOXY-3H-ISOBENZOFURAN-1-ONE, 5,6-dimethoxy-2-benzofuran-1(3H)-one, METAMECONINE, 5,6-dimethoxy-3H-2-benzofuran-1-one, NSC25379, UKFAWRZYFYOXEG-UHFFFAOYSA-N, 5,6-dimethoxy-3 h-isobenzofuran-1-one, 1(3H)-Isobenzofuranone, 5,6-dimethoxy-, metameconin, 5,6-dimethoxy-3-hydroisobenzofuran-1-one, Macconine, Meconinm, Spectrum_001281, 5,6-Dimethoxyphthalide, SpecPlus_000200, 5,6-dimethoxy-phthalide, AC1L5JKE, AC1Q6HPA, Spectrum2_001902, Spectrum3_001042, Spectrum4_001181, Spectrum5_001648, BSPBio_002564, KBioGR_001841, KBioSS_001761, SPECTRUM300062, DivK1c_006296, SCHEMBL800990, SPBio_001864, CHEMBL1559465, CTK6J9740, KBio1_001240, KBio2_001761, KBio2_004329, KBio2_006897, KBio3_001784, DTXSID20282301, CHEBI:113547, MolPort-000-161-888, ZINC384402, ALBB-020808, ZX-AN036455, 7542AB, 9322AE, CCG-38473, FCH829782, MFCD00086313, NSC-25379, SBB010019, STK234719, 1(3H)-Isobenzofuranone,6-dimethoxy-, AKOS000265096, MCULE-9203808007, RTC-066242, SDCCGMLS-0066483.P001, NCGC00095581-01, NCGC00095581-02, AJ-20371, AS-10523, KB-41329, ST060466, 5,6-Dimethoxy-3h-isobenzo[b]furan-1-one, 5,6-Dimethoxyisobenzo[b]furan-1(3H)-one, AX8246068, DB-075038, KB-244212, TR-037407, FT-0660005, R2021, VU0243943-3, 5,6-dimethoxy-1,3-dihydro-2-benzofuran-1-one, AB00052752-02, A838556, AP-065/40649144, SR-05000002427, 5,6-Dimethoxy-3 H-isobenzofuran-1-one, AldrichCPR, I14-5178, SR-05000002427-1, BRD-K94324294-001-02-7, BRD-K94324294-001-03-5, F3292-0464


ID: 2220

chemical graph of compound 2220



InChIKey: UKHFPVCOXBJPIN-UHFFFAOYSA-N
SMILES: COC(=O)C1=NC=C2C(=C1)C3=CC=CC=C3N2

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 107704
synonyms found at PubChem are:
beta-CCM, 69954-48-9, Methyl beta-carboline-3-carboxylate, beta-Carboline-3-carboxylic acid methyl ester, 3-Carbomethoxy-beta-carboline, UNII-I2A008F6YL, methyl 9H-pyrido[3,4-b]indole-3-carboxylate, CHEMBL268191, CHEMBL453066, I2A008F6YL, Methyl 9H-Pyrido(3,4-b)indole-3-carboxylate, methyl 9H-beta-carboline-3-carboxylate, 9H-beta-Carboline-3-carboxylic acid methyl ester, 9H-Pyrido(3,4-b)indole-3-carboxylic acid, methyl ester, C13H10N2O2, Beta CCM, Lopac-E-002, Biomol-NT_000273, D0J0CA, AC1L32LA, Lopac0_000523, BPBio1_001036, SCHEMBL1066725, CHEBI:92505, CTK5D1600, ZINC25301, MolPort-003-941-223, UKHFPVCOXBJPIN-UHFFFAOYSA-N, Methyl |A-carboline-3-carboxylate, Methyl Beta-carboline-3 carboxylate, BDBM50001478, BDBM50243981, PDSP1_000635, PDSP1_001774, PDSP2_000630, PDSP2_001757, CCG-204613, NCGC00015390-01, NCGC00015390-02, NCGC00015390-03, NCGC00015390-04, NCGC00093917-01, NCGC00093917-02, NCGC00093917-03, ZB000806, LS-133449, AM20061455, beta-carbolin-3-carboxylic acid methyl ester, E-002, EU-0100523, FT-0723201, beta-carboline-3-carboxylic acid, methyl ester, B-CARBOLINE-3-CARBOXYLIC ACID METHYLESTE R, C-54150, L002416, SR-01000075868, SR-01000075868-1, BRD-K28680267-001-01-8, 9H-beta-Carboline-3-carboxylic acid methyl ester (BCCM), 9H-Pyrido[3,4-b]indole-3-carboxylicacid, methyl ester, 9H-beta-Carboline-3-carboxylic acid methyl ester(BetaCCE), 9H-beta-Carboline-3-carboxylic acid methyl ester (beta-CCM)


ID: 2221

chemical graph of compound 2221



InChIKey: UKHMZCMKHPHFOT-UHFFFAOYSA-N
SMILES: C1CC(OC1)N2C=NC3=C2N=CN=C3N

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5270
synonyms found at PubChem are:
17318-31-9, 9-(tetrahydrofuran-2-yl)-9h-purin-6-amine, SQ 22536, SQ22536, 9-(Tetrahydro-2-furanyl)-9H-purin-6-amine, Sq 22,536, 9-(Tetrahydrofuryl)adenine, 9-THF-Ade, 9-(Tetrahydro-2-furyl)-adenine, SQ-22536, 9-(oxolan-2-yl)purin-6-amine, 6-Amino-9-(tetrahydro-2-furyl)-9H-purine, Adenine, 9-(tetrahydro-2-furyl)-, 9H-Purin-6-amine, 9-(tetrahydro-2-furanyl)-, AX 100, Adenine, 9-(tetrahydro-2-furanyl)-, CHEMBL64239, MLS002667588, CHEBI:90232, IN1081, 9-(Tetrahydro-2&prime;-furyl)adenine, 9H-Purin-6-amine,9-(tetrahydro-2-furanyl)-, NSC 53339, SMR001230661, PubChem24224, AC1L1JZ9, 9-(Tetrahydrofuryl)-Adenine, Lopac0_001192, BSPBio_001142, KBioGR_000482, KBioSS_000482, MLS002153167, SCHEMBL896095, 9-(Tetrahydro-2-furyl)adenine, AC1Q4Y48, 9-(tetrahydro-2'-furyl)adenine, BCBcMAP01_000102, CTK4D4534, KBio2_000482, KBio2_003050, KBio2_005618, KBio3_000883, KBio3_000884, KS-00001CMW, MolPort-003-959-502, Bio2_000411, Bio2_000891, HMS1362J03, HMS1792J03, HMS1990J03, HMS2235P22, HMS3263P05, HMS3266A19, HMS3369D08, HMS3403J03, BCP28072, EX-A1263, NSC53339, Tox21_501192, ANW-46000, BDBM50009687, HSCI1_000170, MFCD00210216, NSC-53339, s8283, AKOS015998755, CCG-205266, CS-6136, LP01192, TRA0036703, ACM17318319, IDI1_002166, NCGC00015912-02, NCGC00015912-03, NCGC00015912-04, NCGC00015912-05, NCGC00015912-06, NCGC00015912-07, NCGC00094445-01, NCGC00094445-02, NCGC00094445-03, NCGC00094445-04, NCGC00094445-05, NCGC00261877-01, AK-61055, SC-14024, AB0022835, AX8151862, HY-100396, KB-250520, LS-186726, LS-187418, ST2406618, TC-134745, EU-0101192, FT-0688572, S-153, W3775, 9-(OXOLAN-2-YL)-9H-PURIN-6-AMINE, SQ 22,536, >=97% (HPLC), powder, M02495, 9-(Tetrahydro-furan-2-yl)-9H-purin-6-ylamine, SR-01000075521, J-010883, SR-01000075521-1, BRD-A56987319-001-03-8, BRD-A56987319-001-05-3


ID: 2222

chemical graph of compound 2222



InChIKey: UKRPCHIHTZLKDS-UHFFFAOYSA-N
SMILES: C1=CC2=C(C(=C1)O)C(=O)C=C(O2)C3=CC=C(C=C3)Br

biological descriptors:

CFTR relevance: inactive

Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown

reference list:

"MH Nantz" "LJ Galietta" "K By" "EJ Niedzinski" "M Eda" "MF Springsteel" "MJ Haddadin" "MJ Kurth" "AS Verkman"


CID is 5256411
synonyms found at PubChem are:
AC1NQWMY, ZINC33805583, 2-(4-bromophenyl)-5-hydroxychromen-4-one, 2-(4-bromophenyl)-5-hydroxy-4H-chromen-4-one, 54296-24-1


ID: 2223

chemical graph of compound 2223



InChIKey: UKTUQKGXNWDYAI-PNQPWASPSA-N
SMILES: C[C@]12CCC3[C@]4([C@H](C(C(=O)[C@H](C4=O)C[C@@]3(C1=CC(=O)O[C@H]2C5=COC=C5)O)(C)C)CC(=O)O)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 73349765
synonyms found at PubChem are:
8-HYDROXYCARAPINIC ACID, CHEMBL3039069


ID: 2224

chemical graph of compound 2224



InChIKey: ULCGXOSKNHMYAX-UHFFFAOYSA-N
SMILES: C1CN=C(N1)NC2=C(C=C(C=C2Cl)I)Cl.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 11957583
synonyms found at PubChem are:
p-Iodoclonidine hydrochloride, 108294-53-7, 2-[(2,6-Dichloro-4-iodophenyl)imino]imidazoline hydrochloride, 108294-57-1, P-Iodoclonidine HCl, EU-0100664, MLS000859954, SCHEMBL5274141, CHEMBL1255758, MolPort-044-561-409, REGID_for_CID_11957583, Tox21_500664, MFCD00069292, AKOS027446582, CCG-221968, LP00664, NCGC00094026-01, NCGC00261349-01, SMR000326813, RT-023694, FT-0737814, I-114, C-54159, SR-01000075273, J-002086, SR-01000075273-1, 2,6-dichloro-N-(imidazolidin-2-ylidene)-4-iodoaniline hydrochloride, p-Iodoclonidine hydrochloride, analytical standard, for drug analysis


ID: 2225

chemical graph of compound 2225



InChIKey: ULFCBIUXQQYDEI-UHFFFAOYSA-N
SMILES: C1=CC(=C(C(=C1CNNC(=O)C(CO)N)O)O)O.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 26964
synonyms found at PubChem are:
BENSERAZIDE HYDROCHLORIDE, Benserazide HCl, 14919-77-8, Benzerazide hydrochloride, 2-amino-3-hydroxy-N'-(2,3,4-trihydroxybenzyl)propanehydrazide hydrochloride, Benserazide (hydrochloride), Ro 4-4602/001, CCRIS 5092, 2'-(2,3,4-Trihydroxybenzyl)-DL-serinohydrazide monohydrochloride, DL-SERINE 2, EINECS 238-991-9, DL-Serine 2-(2,3,4-trihydroxybenzyl)hydrazine hydrochloride, 14046-64-1, MLS000028424, CHEBI:31262, SMR000058421, 2-amino-3-hydroxy-N'-[(2,3,4-trihydroxyphenyl)methyl]propanehydrazide hydrochloride, DSSTox_CID_25412, DSSTox_RID_80862, DSSTox_GSID_45412, C10H16ClN3O5, W-108090, DL-Serine 2-(2,3,4-trihydroxybenzyl)hydrazide hydrochloride, Serine, 2-(2,3,4-trihydroxybenzyl)hydrazide, monohydrochloride, DL-, 3-hydroxy-1-oxo-1-[2-(2,3,4-trihydroxybenzyl)hydrazinyl]propan-2-aminium chloride, SR-01000003044, Benserazide hydrochloride [JAN], 2-amino-3-hydroxy-N'-[(2,3,4-trihydroxyphenyl)methyl]propanehydrazide;hydrochloride, Opera_ID_1594, NCGC00016709-01, Serazide;Ro 4-4602, Madopa (Hoffmann-LaRoche), AC1L1C8T, CAS-14919-77-8, MLS001148252, MLS002222160, C10H15N3O5.HCl, SCHEMBL364720, SPECTRUM1500137, CHEMBL1255778, DTXSID0045412, HY-B0404A, Benserazide hydrochloride (JP17), MolPort-003-666-129, Benserazide HCl (Ro 4-4602), HMS1570L18, HMS1920G05, Pharmakon1600-01500137, BCP14068, Tox21_110573, Tox21_500233, BG0103, CB0168, CCG-38998, MFCD00078571, NSC755907, s2453, AKOS007930267, Tox21_110573_1, AC-6825, AN-5849, API0007085, CS-2504, H22B350, LP00233, NSC-755907, Ro-4-4602, KS-00000Y25, NCGC00015163-09, NCGC00093698-01, NCGC00093698-02, NCGC00093698-03, NCGC00093698-04, NCGC00093698-05, NCGC00260918-01, AS-13683, BC200991, H794, AB0013267, AB2000568, LS-145026, B4108, EU-0100233, FT-0659734, FT-0760799, ST24039907, B 7283, D01653, J10106, K-4739, Benserazide hydrochloride, >=98% (TLC), solid, A808862, I14-2800, SR-01000003044-2, SR-01000003044-8, dl-serine2-(2,3,4-trihydroxybenzyl)hydrazidehydrochloride, Benserazide hydrochloride, European Pharmacopoeia (EP) Reference Standard, DL-Serine, 2-((2,3,4-trihydroxyphenyl)methyl)hydrazide, monohydrochloride, DL-Serine, 2-[(2,3,4-trihydroxyphenyl)methyl]hydrazide hydrochloride, 2-azanyl-3-oxidanyl-N'-[[2,3,4-tris(oxidanyl)phenyl]methyl]propanehydrazide hydrochloride, Benserazide for peak identification, European Pharmacopoeia (EP) Reference Standard, DL-Serine, 2-((2,3,4-trihydroxyphenyl)methyl)hydrazide, monohydrochloride (9CI), 31796-68-6, AC1LCWAF, SCHEMBL16516192, Benserazide hydrochloride, 98% 1g, AKOS026750132, 2-amino-3-hydroxy-N'-[(2,3,4-trihydroxyphenyl)methyl]propanehydrazide; hydron; chloride


ID: 2226

chemical graph of compound 2226



InChIKey: ULGZDMOVFRHVEP-RWJQBGPGSA-N
SMILES: CC[C@@H]1[C@@]([C@@H]([C@H](C(=O)[C@@H](C[C@@]([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)O[C@H]2C[C@@]([C@H]([C@@H](O2)C)O)(C)OC)C)O[C@H]3[C@@H]([C@H](C[C@H](O3)C)N(C)C)O)(C)O)C)C)O)(C)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 12560
synonyms found at PubChem are:
erythromycin, Erythromycin A, 114-07-8, E-Mycin, Abomacetin, Erythrocin, Erythromycinum, Erymax, Ilotycin, Erythromycine, Eritromicina, Emgel, Erycette, Robimycin, Erythro-Statin, E-Glades, Ery-Tab, E-Base, erythro, Benzamycin, Dumotrycin, Erythrogran, Mephamycin, Stiemycin, Ermycin, Eryacne, Erycen, Erygel, Sansac, Aknin, Wemid, Eryc Sprinkles, Erythra-Derm, Theramycin Z, Akne-Mycin, Erythromycin base, Ak-Mycin, Erythromast 36, R-P Mycin, Endoeritrin, Eritomicina, Erythroderm, Erytrociclin, Paediathrocin, Pharyngocin, Proterytrin, Acneryne, Acnesol, Aknemycin, Derimer, Deripil, Erisone, Eryacnen, Erydermer, Eryhexal, Erysafe, Iloticina, Latotryd, Lederpax, Mercina, Oftamolets, Pantoderm, Pantodrin, Primacine, Romycin, Stiemicyn, Tiloryth, Tiprocin, Emuvin, Erecin, Erymed, Erytop, E-Solve 2, AustriaS, Eros, Ery-maxin, Erythro-Teva, Sans-acne, Torlamicina, Abboticin, Erimycin-T, Ery-Diolan, Inderm Gel, Del-Mycin, Aknederm Ery Gel, Udima Ery Gel, Eryc 125, Emu-Ve, Skid Gel E, Akne Cordes Losung, Ilosone (estolate), Ilotycin T.S., E-Mycin (base), Ery-Tab (base), E-Base (base), Emu-V, Ery-B, ERYC (base), Erythroguent, C-Solve-2, Eritrocina, Erycinum, Erythromid, Pantomicina, Propiocine, Dotycin, Erycin, Eryderm, Ilocaps, N-Methylerythromycin A, ERYC, Pfizer-E, PCE Dispertab (base), IndermRetcin, Kesso-Mycin, Taimoxin-F, Eryc-125, Eryc-250, Erythromycin Lactate, T-Stat, Ery-Sol, Eritromicina [INN-Spanish], Erythromycine [INN-French], Erythromycinum [INN-Latin], Oftalmolosa Cusi Eritromicina, Staticin (TN), Akne-mycin (TN), Emycin, Erytab, Inderm, Retcin, Erygel (TN), UNII-63937KV33D, Wyamycin S, Eryc (TN), T-stat (TN), Erythrocin stearate, Pce (TN), (-)-ERYTHROMYCIN, CHEMBL532, ERYTHROMYCIN STEARATE, erythromycin-A, Benzamycin Pak, CHEBI:42355, ULGZDMOVFRHVEP-RWJQBGPGSA-N, A/T/S, 63937KV33D, Ilotycin gluceptate, NCI-C55674, E0751, DSSTox_CID_2991, DSSTox_RID_76820, DSSTox_GSID_22991, (3R*,4S*,5S*,6R*,7R*,9R*,11R*,12R*,13S*,14R*)-4-((2,6-Dideoxy-3-C-methyl-3-O-methyl-alpha-L-ribo-hexopyranosyl)oxy)-14-ethyl-7,12,13-trihydroxy-3,5,7,9,11,13-hexamethyl-6-((3,4,6-trideoxy-3-(dimethylamino)-beta-D-xylo-hexopyranosyl)oxy)oxacyclotetradecane-2,10-dione, ERY, Erythromycin [INN:BAN:JAN], CCRIS 9078, Erythromycin glucoheptonate, HSDB 3074, Ilotycin T.S, EINECS 204-040-1, Erythromycin Ointment, NSC 55929, Erythromycin intravenous, (2R,3S,4S,5R,6R,8R,10R,11R,12S,13R)-5-(3-amino-3,4,6-trideoxy-N,N-dimethyl--D-xylo-hexopyranosyloxy)-3-(2,6-dideoxy-3-C,3-O-dimethyl--L-ribo-hexopyranosyloxy)-13-ethyl-6,11,12-trihydroxy-2,4,6,8,10,12-hexamethyl-9-oxotridecan-13-olide, AI3-50138, E-mycin, Erycin, Robimysin, SR-05000001618, Sentry AQ mardel maracyn, erthromycin, Erythromycin sodium lauryl sulfate, Erythromycines, ULGZDMOVFRHVEP-UHFFFAOYSA-N, NSC55929, NCGC00094670-01, Erythromycin [USP:INN:BAN:JAN], 82343-12-2, adecane-2,10-dione (non-preferred name), CAS-114-07-8, Prestwick_205, E-mycin, Erythrocin, Spectrum_000115, Spectrum_000659, AC1L1ZUR, EM-A, (3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-6-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-14-ethyl-7,12,13-trihydroxy-4-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-3,5,7,, Prestwick3_000151, Spectrum2_000759, Spectrum2_001263, Spectrum4_000538, Spectrum5_001596, Erythromycin A, B + C, D02YIZ, EC 204-040-1, Erythromycin & VRC3375, SCHEMBL2601, BSPBio_000282, BSPBio_002480, KBioGR_001175, KBioSS_000555, KBioSS_001139, MLS001066618, BIDD:GT0017, DivK1c_000294, DivK1c_000397, DivK1c_000702, SPECTRUM1500280, SPBio_000778, SPBio_001226, Erythromycin (mixture A,B,C), BPBio1_000312, GTPL1456, CHEMBL3735423, DTXSID4022991, Erythromycin A, T-Stat, Pantomicina, HSDB 3074, Erytab, DRG-0279, Erythromycin (JP15/USP/INN), Erythromycin (JP17/USP/INN), HMS500O16, KBio1_000294, KBio1_000397, KBio1_000702, KBio2_000555, KBio2_001139, KBio2_003123, KBio2_003707, KBio2_005691, KBio2_006275, MolPort-002-507-378, NINDS_000294, NINDS_000397, NINDS_000702, ZX-AFC000696, HMS1920M04, HMS2091D05, HMS2095O04, HMS3712O04, Pharmakon1600-01500280, ACT03320, HY-B0220, RKL10096, Tox21_111311, Tox21_111869, Tox21_300515, BDBM50344942, CCG-38992, LMPK04000006, MFCD00084654, NSC756759, ZINC85534336, AKOS015895249, CS-2168, DB00199, MCULE-4566208867, NSC-756759, IDI1_000294, IDI1_000397, IDI1_000702, SMP1_000119, NCGC00179619-01, NCGC00179619-02, NCGC00179619-03, NCGC00254234-01, AC-12744, AC-12901, BC205124, CC-27517, CPD000544946, SAM002643510, SC-13736, SMR000544946, Erythromycin, potency: >=850 mug per mg, Erythromycin, tested according to Ph.Eur., SBI-0051368.P003, Erythromycin, N-demethyl-N-(methyl-11C)-, LS-187077, Erythromycin, meets USP testing specifications, C01912, D00140, E-3250, Erythromycin, plant cell culture tested, ~98%, 44496-EP2272846A1, 44496-EP2275422A1, 44496-EP2292608A1, 44496-EP2305644A1, 44496-EP2308866A1, 44496-EP2311814A1, 44496-EP2311828A1, 44496-EP2380568A1, AB00051981_09, AB00051981_10, Erythromycin standard solution, 1 mg/mL in H2O, Erythromycin, Biotechnology Performance Certified, 114E078, C-23475, SR-01000799155, 9,11,13-hexamethyl-oxacyclotetradecane-2,10-dione, Erythromycin, Antibiotic for Culture Media Use Only, Erythromycin, BioReagent, suitable for cell culture, SR-01000799155-2, SR-05000001618-1, SR-05000001618-2, BRD-K63550407-001-13-5, BRD-K63550407-028-03-9, Erythromycin, compd. with monododecyl sulfate, sodium salt, Erythromycin A, European Pharmacopoeia (EP) Reference Standard, Erythromycin, United States Pharmacopeia (USP) Reference Standard, Sulfuric acid, monododecyl ester, sodium salt, compd. with erythromycin, Erythromycin, for microbiological assay, European Pharmacopoeia (EP) Reference Standard, Erythromycin, Pharmaceutical Secondary Standard; Certified Reference Material, (3R*,4S*,5S*,6R*,7R*,9R*,11R*,12R*,13S*,14R*)-4-[(2,6-Dideoxy-3-C-methyl-3-O-methyl-.alpha.-L-ribo-hexopyranosyl)oxy]-14-ethyl-7,12,13-trihydroxy-3,5,9,11,13-hexamethyl-6-[[3,4,6-trideoxy-3-, (3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-4-(2,6-dideoxy-3-C-methyl-3-O-methyl-alpha-L-ribo-hexopyranosyloxy)-14-ethyl-7,12,13-trihydroxy-6-[3,4,6-trideoxy-3-(dimethylamino)-beta-D-xylo-hexopyranosyloxy]-3,5,7,9,11,13-hexamethyloxacyclotetradecane-2,10-dione, (3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-6-(((2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-14-ethyl-7,12,13-trihydroxy-4-(((2R,4R,5S,6S)-5-hydroxy-4-methoxy-4, (3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-6-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyl-tetrahydropyran-2-yl]oxy-14-ethyl-7,12,13-trihydroxy-4-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyl-tetrahydropyran-2-yl]oxy-3,5,7,9,11,13-hexamethyl-oxacyclotetradecane-2,10-dione, (3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-6-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-14-ethyl-7,12,13-trihydroxy-4-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-3,5,7,9,11,13-hexamethyl-oxacyclotetradecane-2,10-dione, (3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-6-[(2S,3R,4S,6R)-4-dimethylamino-3-hydroxy-6-methyloxan-2-yl]oxy-14-ethyl-7,12,13-trihydroxy-4-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-3,5,7,9,11,13-hexamethyl-1-oxacyclotetradecane-2,10-dione, (3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-6-{[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyltetrahydro-2H-pyran-2-yl]oxy}-14-ethyl-7,12,13-trihydroxy-4-{[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyltetrahydro-2H-pyran-2-yl]oxy}-3,5,7,9,11,13-hexamethyloxacyclotetradecane-2,10-dione, 374700-25-1


ID: 2227

chemical graph of compound 2227



InChIKey: ULLNJSBQMBKOJH-VIVFLBMVSA-N
SMILES: CCOC1[C@@H]([C@H]([C@H](O1)[C@@H](COCC2=CC=CC=C2)OCC3=CC=CC=C3)OCC4=CC=CC=C4)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 196122
synonyms found at PubChem are:
tribenoside, 10310-32-4, Tribenzoside, Glyvenal, Ethyl 3,5,6-tri-O-benzyl-D-glucofuranoside, (3R,4R,5R)-4-(Benzyloxy)-5-((R)-1,2-bis(benzyloxy)ethyl)-2-ethoxytetrahydrofuran-3-ol, Glyvenol, Glivenol, D-Glucofuranoside, ethyl 3,5,6-tris-O-(phenylmethyl)-, TBGF, 21401-BA, Tribenosidum [INN-Latin], Tribenosido [INN-Spanish], Tribenosido, Tribenosidum, C29H34O6, EINECS 233-687-2, Ba 21401, BG-356, Ethyl 3,5,6-tri-O-benzyl-D-glucofuranoside;Ethyl 3,5,6-tri-O-benzyl-D-glucofuranoside, Ethyl-3,5,6-tri-O-benzyl-D-glucofuranoside, D-Glucofuranoside, ethyl-3,5,6-tris-o-(phenylmethyl)-, tribenosid, Tribenoside [USAN:INN:BAN:JAN], Glucofuranoside, ethyl-3,5,6-tri-o-benzyl-, D-, Prestwick3_001019, BSPBio_001177, AC1L516Y, BPBio1_001295, SCHEMBL7192326, CHEMBL3301681, CHEBI:91780, HMS2098K19, HMS3715K19, AKOS022185031, API0004490, CCG-221019, NCGC00179274-01, AK117679, AB00514005, FT-0660910, ST24034462, 310T324, SR-01000872695, SR-01000872695-1, W-200685, BRD-A60294240-001-01-1, (3R,4R,5R)-5-[(1R)-1,2-bis(phenylmethoxy)ethyl]-2-ethoxy-4-phenylmethoxy-3-oxolanol, (3R,4R,5R)-5-[(1R)-1,2-bis(phenylmethoxy)ethyl]-2-ethoxy-4-phenylmethoxyoxolan-3-ol


ID: 2228

chemical graph of compound 2228



InChIKey: ULSDMUVEXKOYBU-ZDUSSCGKSA-N
SMILES: CN(C)CCC1=CNC2=C1C=C(C=C2)C[C@H]3COC(=O)N3

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 60857
synonyms found at PubChem are:
zolmitriptan, 139264-17-8, Zomig, Zomigoro, Zomigon, Flezol, 311C90, Zomig-ZMT, AscoTopand, Zomig Nasal Spray, Zomig ZMT, zolmitriptane, zolmitriptanum, AscoTop, Zolmitriptan [USAN], zipton, zominat, UNII-2FS66TH3YW, (S)-4-[3-(2-Dimethylamino-ethyl)-1H-indol-5-ylmethyl]-oxazolidin-2-one, Zolmitriptan (Zomig), Zomig (TN), Zolmitriptan RapidFilm, BW-311C90, 2FS66TH3YW, CHEMBL1185, (S)-4-((3-(2-(Dimethylamino)ethyl)-1H-indol-5-yl)methyl)-2-oxazolidinone, (S)-4-((3-(2-(Dimethylamino)ethyl)indol-5-yl)methyl)-2-oxazolidinone, 4-((3-(2-(Dimethylamino)ethyl)-1H-indol-5-yl)methyl)-2-oxazolidinone, CHEBI:10124, C16H21N3O2, KS-5072, (4S)-4-[[3-[2-(Dimethylamino)ethyl]-1H-indol-5-yl]methyl]-2-oxazolidinone, (S)-4-((3-(2-(dimethylamino)ethyl)-1H-indol-5-yl)methyl)oxazolidin-2-one, (S)-4-[[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]methyl]-2-oxazolidinone, (4S)-4-((3-(2-(DIMETHYLAMINO)ETHYL)-1H-INDOL-5-YL)METHYL)-2-OXAZOLIDINONE, (4S)-4-({3-[2-(dimethylamino)ethyl]-1H-indol-5-yl}methyl)-1,3-oxazolidin-2-one, (4S)-4-[[3-(2-dimethylaminoethyl)-1H-indol-5-yl]methyl]-1,3-oxazolidin-2-one, DSSTox_CID_25933, DSSTox_RID_81232, DSSTox_GSID_45933, Rapimelt, 4-[[3-(2-dimethylaminoethyl)-1H-indol-5-yl]methyl]oxazolidin-2-one, 2-Oxazolidinone, 4-((3-(2-(dimethylamino)ethyl)-1H-indol-5-yl)methyl)-, (S)-, CPD000449310, SMR000449310, CAS-139264-17-8, Zolmitriptan [USAN:INN:BAN], (4S)-4-[[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]methyl]-1,3-oxazolidin-2-one, NCGC00095155-01, Zomigoro (TN), Zomigon (TN), AscoTop (TN), Spectrum2_000728, D0NG7O, GTPL60, AC1L1U2E, SCHEMBL33336, MLS000758208, MLS001424172, BIDD:GT0040, SPECTRUM1505281, SPBio_000656, Zolmitriptan (JAN/USAN/INN), DTXSID8045933, KS-00000HAJ, ZINC15515, Zolmitriptan, >=98% (HPLC), Zomig;Zomigon;AscoTopand;Zomigoro, MolPort-003-666-626, ULSDMUVEXKOYBU-ZDUSSCGKSA-N, HMS1922B04, HMS2052K17, HMS2093O14, HMS2235I22, HMS3714H11, Pharmakon1600-01505281, ACT04392, BCP10513, HY-B0229, ZMT, Tox21_111455, BDBM50033383, CCG-38993, MFCD00871503, NSC760383, s1649, AKOS015850706, Tox21_111455_1, AB07628, AN-5272, AT-3239, CS-2179, DB00315, NC00382, NSC-760383, (S)-N,N-Dimethyl-2-[5-(2-oxo-1,3-oxazolidin-4-ylmethyl)-1H-indol-3-yl]ethylamine, NCGC00263884-02, NCGC00263884-03, NCGC00263884-08, AK-47834, BC206232, KB-62428, SAM001246841, SAM001247064, SC-17326, SBI-0206762.P001, AB2000194, LS-100559, ST2407794, B2261, FT-0631159, 64Z178, A-2479, C07218, D00415, J10141, AB00698244-05, AB00698244_06, SR-05000001693, J-007257, SR-05000001693-1, Zomig, Zomigon, AscoTopand, Zomigoro, Zolmitriptan, Zolmitriptan, United States Pharmacopeia (USP) Reference Standard, (4S)-4-[[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]methyl]oxazolidin-2-one, (S) -N,N-Dimethyl-2- [5- (2-oxo-1,3-oxazolidin-4-ylmethyl) -1H -indol-3-yl]ethylamine, (S)-4-({3-[2-(dimethylamino)ethyl]-1H-indol-5-yl}methyl)-1,3-oxazolidin-2-one, (S)-4-(3-[2-(DIMETHYLAMINO)ETHYL]-5-INDOLYLMETHYL)OXAZOLIDIN-2-ONE, (S)-N,N-Dimethyl-2-[5-(2-oxo-1,3-oxazolidin-4-ylmethyl)-1H -indol-3-yl]ethylamine, 2-Oxazolidinone, 4-[[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]methyl]-, (4S)-


ID: 2229

chemical graph of compound 2229



InChIKey: ULSUXBXHSYSGDT-UHFFFAOYSA-N
SMILES: COC1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C(=C(C(=C3OC)OC)OC)OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 68077
synonyms found at PubChem are:
Tangeretin, 481-53-8, Tangeritin, Ponkanetin, Pentamethoxyflavone, 4',5,6,7,8-Pentamethoxyflavone, 5,6,7,8,4'-Pentamethoxyflavone, Tangeretin (6CI), UNII-I4TLA1DLX6, 5,6,7,8-tetramethoxy-2-(4-methoxyphenyl)-4H-chromen-4-one, 5,6,7,8-Tetramethoxy-2-(4-methoxyphenyl)-4-benzopyrone, C20H20O7, EINECS 207-570-1, NSC 53909, I4TLA1DLX6, 4H-1-Benzopyran-4-one, 5,6,7,8-tetramethoxy-2-(4-methoxyphenyl)-, BRN 0351695, CHEMBL73930, AI3-23869, MLS002667634, 5,6,7,8-tetramethoxy-2-(4-methoxyphenyl)chromen-4-one, CHEBI:9400, ULSUXBXHSYSGDT-UHFFFAOYSA-N, 4H-1-Benzopyran-4-one, 5,6,7,8-tetramethoxy-2-(p-methoxyphenyl)-, NSC53909, Flavone, 4',5,6,7,8-pentamethoxy- (7CI,8CI), NSC-53909, Flavone, 5,6,7,8,4'-pentamethoxy, 2-(4-Methoxyphenyl)-5,6,7,8-tetramethoxy-4H-1-benzopyran-4-one, Q-100525, 4H-1-Benzopyran-4-one, 2-(4-methoxyphenyl)-5,6,7,8-tetramethoxy-, 5,6,7,8-tetramethoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one, tangeretin(6ci), 4',5,6,7,8-pentamethoxy-flavone, Tangeretin (Tangeritin), AC1Q6AJM, Spectrum2_001698, Spectrum3_000920, Spectrum4_001019, AC1L28ZE, SCHEMBL19740, KBioGR_001517, 5-18-05-00491 (Beilstein Handbook Reference), SPECTRUM1505269, SPBio_001656, Tangeretin, analytical standard, MEGxp0_001011, Tangeretin, >=95% (HPLC), ACon1_001263, KBio3_001900, DTXSID30197417, Flavone,5,6,7,8-pentamethoxy-, MolPort-001-741-167, HMS3651A22, HY-N0133, ZINC1531699, 4'',5,6,7,8-pentamethoxyflavone, 5,6,7,8,4''-Pentamethoxyflavone, BDBM50209218, CCG-38782, CT0015, GA2100, LMPK12111443, MFCD00017438, NSC618905, s2363, AKOS015895209, AC-1699, CS-5484, MCULE-1727108016, NSC-618905, SDCCGMLS-0066766.P001, Flavone, 4',5,6,7,8-pentamethoxy-, NCGC00095850-01, NCGC00095850-02, NCGC00169520-01, AN-14690, AS-11637, BC216326, CC-34639, CJ-24106, LS-39784, NCI60_004330, SC-46059, SMR001557394, ST097546, AB0010469, FT-0632194, N2077, C10190, K-9174, 481T538, C-21181, SR-05000002625, CU-01000013437-2, I06-0225, SR-05000002625-1, BRD-K25186396-001-02-1, BRD-K25186396-001-04-7, 4H-1-Benzopyran-4-one,6,7,8-tetramethoxy-2-(4-methoxyphenyl)-, 4H-1-Benzopyran-4-one,6,7,8-tetramethoxy-2-(p-methoxyphenyl)-, 4H-1-Benzopyran-4-one, 5,6,7,8-tetra-methoxy-2-(4-methoxyphenyl)-, 5,6,7,8-Tetramethoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one, 9CI


ID: 2230

chemical graph of compound 2230



InChIKey: ULTTYPMRMMDONC-UHFFFAOYSA-N
SMILES: C1=CC=C(C(=C1)CN(CC2=C(C=CC(=C2)O)O)C3=CC(=C(C=C3)O)C(=O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3894
synonyms found at PubChem are:
Lavendustin A, 125697-92-9, RG14355, UNII-3Y0G32G2RV, 3Y0G32G2RV, CHEMBL103552, C21H19NO6, Lavendustin A, from Streptomyces griseolavendus, IN1274, Benzoic acid,5-[[(2,5-dihydroxyphenyl)methyl][(2-hydroxyphenyl)methyl]amino]-2-hydroxy-, RG 14355, 5-(((2,5-Dihydroxyphenyl)methyl)((2-hydroxyphenyl)methyl)amino)-2-hydroxybenzoic acid, Benzoic acid, 5-(((2,5-dihydroxyphenyl)methyl)((2-hydroxyphenyl)methyl)amino)-2-hydroxy-, 5-((2,5-dihydroxybenzyl)(2-hydroxybenzyl)amino)-2-hydroxybenzoic acid, 5-[(2,5-dihydroxybenzyl)(2-hydroxybenzyl)amino]-2-hydroxybenzoic acid, 5-Amino-((N-2,5-dihydroxybenzyl)-N?-2-hydroxybenzyl)salicylic acid, 5-Amino-[(N-2,5-dihydroxybenzyl)-N&prime;-2-hydroxybenzyl]salicylic Acid, 5-[[(2,5-Dihydroxyphenyl)methyl][(2-hydroxyphenyl)methyl]amino]-2-hydroxybenzoic acid, 5-{[(2,5-dihydroxyphenyl)methyl][(2-hydroxyphenyl)methyl]amino}-2-hydroxybenzoic acid, BiomolKI_000009, ACMC-20c89j, BiomolKI2_000019, D0D9TU, AC1L1GY5, AC1Q5V0X, CBiol_002008, BMK1-B9, BSPBio_001191, KBioGR_000531, KBioSS_000531, SCHEMBL159085, CHEBI:92413, CTK4B4738, KBio2_000531, KBio2_003099, KBio2_005667, KBio3_000961, KBio3_000962, DTXSID00154855, MolPort-003-848-367, Bio1_000294, Bio1_000783, Bio1_001272, Bio2_000426, Bio2_000906, HMS1362K13, HMS1792K13, HMS1990K13, HMS3403K13, BCP20666, ZINC3873083, BDBM50038202, NSC678027, AKOS015914247, CCG-100613, NSC-678027, TRA0073584, IDI1_002181, SMP2_000273, NCGC00162408-01, NCGC00162408-02, NCGC00162408-03, NCGC00162408-04, NCI60_027898, LS-172642, RT-013561, B6693, FT-0627734, ST50405209, V0351, SR-05000002164, J-005265, SR-05000002164-2, BRD-K23583188-001-05-6, I14-44474, 5-amino-[(N-2,5-dihydroxybenzyl)-N'-2-hydroxybenzyl]salicylic acid, 5-amino-[(N-2,5-dihydroxybenzyl)-N''-2-hydroxybenzyl]salicylic acid, 5-[(2,5-dihydroxy-benzyl)-(2-hydroxy-benzyl)-amino]- 2-hydroxy-benzoic acid, 5-[(2,5-Dihydroxy-benzyl)-(2-hydroxy-benzyl)-amino]-2-hydroxy-benzoic acid, 5-[(2,5-dihydroxyphenyl)methyl-[(2-hydroxyphenyl)methyl]amino]-2-hydroxybenzoic acid, 5-{[(2,5-dihydroxyphenyl)methyl][(2-hydroxyphenyl)methyl]amino}-2-hydroxybenzo ic acid, Benzoic acid,5-dihydroxyphenyl)methyl][(2-hydroxyphenyl)methyl]amino]-2-hydroxy-


ID: 2231

chemical graph of compound 2231



InChIKey: UMGQVUWXNOJOSJ-DGGAMASNSA-N
SMILES: C[C@@H](C1=CC=CC=C1)NC(=O)/C(=C/C2=CC(=C(C=C2)O)O)/C#N

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5328769
synonyms found at PubChem are:
Tyrphostin AG 835, 133550-37-5, Tyrphostin B50, Tyrphostin B44, (+) enantiomer, Tyrphostin Ag-835, Tocris-0579, Tyrphostin deriv. 50, AC1NS5AU, Lopac-T-4443, Lopac-T-5568, Lopac0_001198, BDBM4305, CHEMBL261557, SCHEMBL12856415, MolPort-003-983-811, Tyrphostin AG 835, >=92%, HMS3263P17, HMS3266M20, ZINC2557951, Tox21_501198, BS0197, HSCI1_000020, MFCD00209855, AKOS024458569, CCG-205272, LP01198, NCGC00016022-01, NCGC00016022-02, NCGC00024663-01, NCGC00024663-02, NCGC00024663-03, NCGC00024663-04, NCGC00261883-01, EU-0101198, T3540, T 5568, SR-01000597624, SR-01000597624-1, BRD-K17415526-001-02-7, (S)-2-cyano-3-(3,4-dihydroxyphenyl)-N-(1-phenylethyl)acrylamide, (S)-N-(alpha-Methylbenzyl)-3,4-dihydroxybenzylidenecyanoacetamide, (S,E)-2-cyano-3-(3,4-dihydroxyphenyl)-N-(1-phenylethyl)acrylamide, 2-Cyano-3-(3,4-dihydroxyphenyl)-N-[(S)-1-phenylethyl]acrylamide, (+)-(S)-N-(alpha-Methylbenzyl)-3,4-dihydroxy-benzylidenecyanoacetamide, (+)-(S)-N-(alpha-Methylbenzyl)-3,4-dihydroxybenzylidenecyanoacetamide, (2E)-2-cyano-3-(3,4-dihydroxyphenyl)-N-[(1S)-1-phenylethyl]prop-2-enamide, (E)-2-cyano-3-(3,4-dihydroxyphenyl)-N-[(1S)-1-phenylethyl]prop-2-enamide, (S)-(E)-2-Cyano-3-(3',4'-dihydroxyphenyl)-N-(1-phenylethyl)-2-propenamide, 2-Propenamide,2-cyano-3-(3,4-dihydroxyphenyl)-N-[(1S)-1-phenylethyl]-,(2E)-


ID: 2232

chemical graph of compound 2232



InChIKey: UMGQVUWXNOJOSJ-KMHUVPDISA-N
SMILES: C[C@H](C1=CC=CC=C1)NC(=O)/C(=C/C2=CC(=C(C=C2)O)O)/C#N

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5328772
synonyms found at PubChem are:
Tyrphostin B44, Tyrphostin AG 527, 133550-32-0, Tyrphostin B44, (-) enantiomer, Tyrphostin B44(-), AG 527, alpha-Cyano-(-)-(R)-N-(alpha-phenethyl)-3,4-dihydroxycinnamide, (-)-(R)-N-(alpha-Methylbenzyl)-3,4-dihydroxybenzylidinecyanoacetamide, SR-01000076158, Tyrphostin B44, (+) enantiomer, Tyrphostin B-44, Tocris-0578, Tyrphostin deriv. 44, AC1NS5B1, Lopac0_001177, MLS002153178, BDBM4302, CHEMBL258767, cid_5328772, DTXSID90416171, MolPort-003-983-810, UMGQVUWXNOJOSJ-KMHUVPDISA-N, HMS2235B13, ZINC3871437, AG-527, BS0196, HSCI1_000018, AKOS024458568, CCG-205251, NCGC00024662-01, NCGC00024662-02, NCGC00024662-03, NCGC00024662-04, NCGC00024662-05, SMR001230670, B6359, EU-0101177, M01337, T 4443, A806631, SR-01000597717, J-006401, J-006404, SR-01000076158-1, SR-01000076158-2, SR-01000597717-1, BRD-K43405658-001-01-8, (R,E)-2-cyano-3-(3,4-dihydroxyphenyl)-N-(1-phenylethyl)acrylamide, 2-Cyano-3-(3,4-dihydroxyphenyl)-N-[(R)-1-phenylethyl]acrylamide, (-)-(R)-N-(alpha-Methylbenzyl)-3,4-dihydroxy-benzylidenecyanoacetamide, (2E)-2-cyano-3-(3,4-dihydroxyphenyl)-N-[(1R)-1-phenylethyl]prop-2-enamide, (E)-2-cyano-3-(3,4-dihydroxyphenyl)-N-[(1R)-1-phenylethyl]-2-propenamide, (E)-2-cyano-3-(3,4-dihydroxyphenyl)-N-[(1R)-1-phenylethyl]prop-2-enamide, (E)-3-[3,4-bis(oxidanyl)phenyl]-2-cyano-N-[(1R)-1-phenylethyl]prop-2-enamide, (R)-(E)-2-Cyano-3-(3',4'-dihydroxyphenyl)-N-(1-phenylet hyl)-2-propenamide, (R)-(E)-2-Cyano-3-(3',4'-dihydroxyphenyl)-N-(1-phenylethyl)-2-propenamide


ID: 2233

chemical graph of compound 2233



InChIKey: UMQUQWCJKFOUGV-UHFFFAOYSA-N
SMILES: CC(C)(C)NCC(COC1=CC=CC2=C1NC(=O)N2)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 2687
synonyms found at PubChem are:
Tbhpbo, Cgp 12177, Cgp-12177, Cgp 12177A, 81047-99-6, 4-(3-tert-Butylamino-2-hydroxypropoxy)benzimidazol-2-one, CHEBI:73288, CGP-12177A, [3H]CGP 12177, CGP12177A, [3H]CGP12177, [3H]-CGP12177, C14H19N3O3, 4-[3-(tert-butylamino)-2-hydroxypropoxy]-1,3-dihydro-2H-benzimidazol-2-one, 4-[3-(tert-butylamino)-2-hydroxypropoxy]-1,3-dihydrobenzimidazol-2-one, 2H-Benzimidazol-2-one, 4-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)-1,3-dihydro-, (+/-)-CGP-12177A hydrochloride, Spectrum_001907, SpecPlus_000776, Spectrum4_000777, D01RRT, D03BZW, D06SAW, AC1L1E8K, AC1Q6M3F, CGP-12177A hydrochloride, Lopac0_000372, GTPL532, KBioGR_001194, KBioSS_002444, DivK1c_006872, CHEMBL420746, GTPL5387, SCHEMBL2016211, BDBM25747, CTK5E8414, KBio1_001816, KBio2_002438, KBio2_005006, KBio2_007574, 4-[3-(tert-butylamino)-2-hydroxypropoxy]-1h-benzimidazol-2-ol, CGP12177, BDBM50027879, 2H-Benzimidazol-2-one, 4-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)-, CCG-204467, NCGC00015184-03, NCGC00015184-04, NCGC00015184-05, NCGC00025024-02, NCGC00025024-03, LS-177605, FT-0708718, L000166, BRD-A34706053-003-01-9, 2H-Benzimidazol-2-one,4-[3-[(1,1-dimethylethyl)amino]-2-hydroxypropoxy]-1,3-dihydro-, 4-[3-(tert-butylamino)-2-hydroxypropoxy]-2,3-dihydro-1H-1,3-benzodiazol-2-one, 4-[3-[(1,1-dimethylethyl)amino]-2-hydroxypropoxy]-1,3-dihydro-2h-benzimidazol-2-one, 4-[3-[(tert-butyl)amino]-2-hydroxypropoxy]-1,3-dihydro-2H-benzimidazol-2-one, 4-[3-(tert-butylamino)-2-hydroxypropoxy]-2,3-dihydro-1H-1,3-benzodiazol-2-one hydrochloride


ID: 2234

chemical graph of compound 2234



InChIKey: UNBRKDKAWYKMIV-QWQRMKEZSA-N
SMILES: CC[C@@H](CO)NC(=O)[C@H]1CN([C@@H]2CC3=CNC4=CC=CC(=C34)C2=C1)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 8226
synonyms found at PubChem are:
methylergonovine, Methylergometrine, Methylergobasin, Methylergometrin, Methylergobasine, Methylergobrevin, Methergine, Methylergonovin, Methergen, Partergin, Basofortina, Metilergometrina, Methylergometrinum, Methylergometrine maleate, 113-42-8, Methergin, Metilergometrinio, Metilergometrina [DCIT], Lysergic acid butanolamide, Ergometrine, methyl-, Methylergometrine [INN:BAN], Ryegonovin, Metenarin, Methylergometrinum [INN-Latin], Metilergometrinio [INN-Spanish], Spametrin-M, UNII-W53L6FE61V, ME 277, Ergotyl (TN), D-Lysergic acid-dl-hydroxybutylamide-2, D-Lysergic acid-(+)-butanolamide-(2), HSDB 3364, Methylergometrine (INN), N-(alpha-(Hydroxymethyl)propyl)-D-lysergamide, EINECS 204-027-0, W53L6FE61V, CHEMBL1201356, Lysergamide, N-((S)-1-(hydroxymethyl)propyl)-, 9,10-Didehydro-N-(1-(hydroxymethyl)propyl)-6-methylergoline-8-carboxamide, 9,10-Didehydro-N-(alpha-(hydroxymethyl)propyl)-6-methyl-ergoline-8-beta-carboxamide, Ergoline-8-carboxamide, 9,10-didehydro-N-(1-(hydroxymethyl)propyl)-6-methyl-, (8beta(S))-, NCGC00017258-04, Methergine (TN), C20H25N3O2, DSSTox_CID_3283, DSSTox_RID_76957, DSSTox_GSID_23283, (8beta)-N-[(1S)-1-(hydroxymethyl)propyl]-6-methyl-9,10-didehydroergoline-8-carboxamide, Ergoline-8-beta-carboxamide, 9,10-didehydro-N-((S)-1-(hydroxymethyl)propyl)-6-methyl-, (6aR,9R)-N-[(2S)-1-hydroxybutan-2-yl]-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide, Ergotyl, CAS-113-42-8, Spectrum_000263, AC1L1QJP, Prestwick3_000374, Spectrum2_000613, Spectrum3_000502, Spectrum5_001879, Biomol-NT_000154, D05AHE, Lopac0_000794, SCHEMBL78176, BSPBio_000527, BSPBio_002023, GTPL150, KBioSS_000743, DivK1c_000357, SPBio_000546, D-lysergic acid 1-butanolamide, BPBio1_000442, BPBio1_000581, DTXSID1023283, CHEBI:92607, KBio1_000357, KBio2_000743, KBio2_003311, KBio2_005879, KBio3_001523, NINDS_000357, Tox21_110809, BDBM50330860, ZINC95619105, Tox21_110809_1, API0006820, CCG-204878, DB00353, IDI1_000357, NCGC00017258-03, NCGC00017258-05, NCGC00017258-06, NCGC00017258-08, NCGC00024646-02, NCGC00024646-03, LS-64363, SBI-0050771.P004, AB00514664, D08207, AB00053497_03, 191038-EP2275420A1, 191038-EP2280008A2, BRD-K34685430-001-01-1, BRD-K34685430-050-04-2, BRD-K34685430-050-06-7, (8beta)-N-[(2S)-1-hydroxybutan-2-yl]-6-methyl-9,10-didehydroergoline-8-carboxamide, (4R,7R)-N-[(2S)-1-hydroxybutan-2-yl]-6-methyl-6,11-diazatetracyclo[7.6.1.0;{2,7}.0;{12,16}]hexadeca-1(16),2,9,12,14-pentaene-4-carboxamide, 29477-86-9, 29589-73-9, 479-03-8, 78207-86-0, H8D


ID: 2235

chemical graph of compound 2235



InChIKey: UNFGQCCHVMMMRF-UHFFFAOYSA-N
SMILES: CCC(C1=CC=CC=C1)C(=O)N

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 7011
synonyms found at PubChem are:
2-Phenylbutyramide, 2-Phenylbutanamide, 90-26-6, Geristerol, Hyposterol, Normosterolo, Phenetamid, Phenetamide, Redusterol, Substerina, Eusterol, Geriapan, Lipilisol, Nivonorm, Phenexan, Phenylethylacetamide, Phenylbutyramide, BUTYRAMIDE, 2-PHENYL-, FENBUTYRAMIDE, alpha-Phenylbutyramide, TH 4128, Butyramide, alpha-phenyl-, NSC 1861, alpha-Toluamide, alpha-ethyl-, Benzeneacetamide, .alpha.-ethyl-, .alpha.-Phenylbutyramide, EINECS 201-980-4, BRN 3197469, AI3-01390, UNFGQCCHVMMMRF-UHFFFAOYSA-N, .alpha.-Toluamide, .alpha.-ethyl-, Benzeneacetamide, alpha-ethyl-, 2-phenyl-Mutyramide, ACMC-20annn, Spectrum_001621, SpecPlus_000884, AC1L1NSV, AC1Q2RVO, Benzeneacetamide,a-ethyl-, Spectrum2_000492, Spectrum3_000652, Spectrum4_000627, Spectrum5_001398, (2RS)-2-Phenylbutanamide, WLN: ZVY2&R, (+/-)-2-phenylbutylamide, benzeneacetamide, |A-ethyl-, BSPBio_002283, KBioGR_001214, KBioSS_002101, 4-09-00-01818 (Beilstein Handbook Reference), DivK1c_006980, SCHEMBL232920, SPECTRUM1504223, alpha-PHENYL-N-BUTYRAMIDE, SPBio_000383, CHEMBL3039472, alpha-Phenyl-alpha-ethylacetamide, CHEBI:93832, CTK8C6017, KBio1_001924, KBio2_002101, KBio2_004669, KBio2_007237, KBio3_001503, NSC1861, NSC-1861, CCG-39566, AKOS008977373, Benzeneacetamide, alpha-ethyl- (9CI), MCULE-4316178210, NCGC00095335-01, NCGC00095335-02, AC-11144, H642, LS-47728, DB-057192, KB-174109, TR-028381, FT-0622441, ST50331835, W-100336, BRD-A25537246-001-02-9, BRD-A25537246-001-03-7, I14-49292


ID: 2236

chemical graph of compound 2236



InChIKey: UNJFKXSSGBWRBZ-BJCIPQKHSA-N
SMILES: C1C=C(N2[C@H](S1)[C@@H](C2=O)NC(=O)/C(=C\CC(=O)O)/C3=CSC(=N3)N)C(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5282242
synonyms found at PubChem are:
ceftibuten, 97519-39-6, Cedax, Ceftibuteno, Ceftibutenum, Ceftibutene, UNII-IW71N46B4Y, Cephem, cis-Ceftibutin, Sch-39720, 7432-S, Antibiotic 7432S, Sch 39720, Cephalosporin 7432-S, CHEBI:3510, IW71N46B4Y, Isocef, Ceftibuten hydrate, Ceftibutene [INN-French], Ceftibutenum [INN-Latin], Ceftibuteno [INN-Spanish], Ceprifran, (6R,7R)-7-((Z)-2-(2-Aminothiazol-4-yl)-4-carboxybut-2-enamido)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, Ceftem, cis-ceftibuten, Keimax, Ceftibuten [USAN:INN:BAN], S 7432, (+)-(6R,7R)-7-((Z)-2-(2-Amino-4-thiazolyl)-4-carboxycrotonamido)-8-oxo-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, NCGC00095137-01, AC1NQZPP, Ceftibuten (USAN/INN), Spectrum5_001558, CHEMBL1605, DSSTox_CID_25925, DSSTox_RID_81227, DSSTox_GSID_45925, SCHEMBL37054, BSPBio_002733, SPECTRUM1505207, DTXSID4045925, HMS1922L17, HMS2093K18, HMS3715P10, Pharmakon1600-01505207, (6R,7R)-7-[[(2Z)-2-(2-Amino-4-thiazolyl)-4-carboxy-1-oxo-2-buten-1-yl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid hydrate, (6R,7R)-7-[[(Z)-2-(2-amino-1,3-thiazol-4-yl)-5-hydroxy-5-oxopent-2-enoyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, (6R,7R)-7-{[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-4-carboxybut-2-enoyl]amino}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 7-((2-(2-amino-4-thiazolyl)-4-carboxy-1-oxo-2-butenyl)amino)-8-oxo-, (6R-(6alpha,7beta(Z)))-, 7beta-{[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-4-carboxybut-2-enoyl]amino}-3,4-didehydrocepham-4-carboxylic acid, HY-B0698, ZINC3871967, Tox21_111446, BDBM50370586, CC0255, CCG-39440, MFCD00864918, NSC758925, AKOS005146205, AKOS015854930, CS-2939, DB01415, NSC-758925, NCGC00178501-01, SC-27736, SBI-0206740.P001, CAS-97519-39-6, C08117, D00922, AB01563048_01, 519C396, Ceftibuten, Antibiotic for Culture Media Use Only, SR-05000001989, SR-05000001989-1, I14-31895, (6R,7R)-7-[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-4-carboxybut-2-enamido]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, (6R,7R)-7-[[(2Z)-2-(2-Amino-4-thiazolyl)-4-carboxy-1-oxo-2-buten-1-yl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic Acid


ID: 2237

chemical graph of compound 2237



InChIKey: UNPLRYRWJLTVAE-UHFFFAOYSA-N
SMILES: C1CCN(CC1)CCOC(C2=CC=CC=C2)C3=CC=C(C=C3)Cl.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 161104
synonyms found at PubChem are:
Cloperastine hydrochloride, 14984-68-0, Hustazol, Seki, Cloperastine HCl, Cloperastina cloridrato [Italian], EINECS 239-067-8, 2-Piperidinoethyl p-chlorobenzhydryl ether hydrochloride, 1-(2-((p-Chloro-alpha-phenylbenzyl)oxy)ethyl)piperidine hydrochloride, 1-(2-(p-Cloro-alpha-fenilbenzilossi)etil)piperidina cloridrato [Italian], DSSTox_CID_25413, DSSTox_RID_80863, DSSTox_GSID_45413, Q-200881, 4-Chlorobenzhydryl 2-(1-Piperidyl)ethyl Ether Hydrochloride, 1-(2-((4-Chlorophenyl)phenylmethoxy)ethyl)piperidinium chloride, 1-[2-[(4-Chlorophenyl)phenylmethoxy]ethyl]piperidinium chloride, 1-(2-((4-Chlorophenyl)(phenyl)methoxy)ethyl)piperidine hydrochloride, Piperidine, 1-(2-((p-chloro-alpha-phenylbenzyl)oxy)ethyl)-, hydrochloride, Cloperastina cloridrato, SR-01000841238, 1-[2-[(4-Chlorophenyl)(phenyl)methoxy]ethyl]piperidine Hydrochloride, Prestwick_74, Piperidine, 1-(2-((4-chlorophenyl)phenylmethoxy)ethyl)-, hydrochloride, Cloperastine Hydrocloride, 1-(2-((p-chloro-a-phenylbenzyl)oxy)ethyl)piperidine hydrochloride, C20H24ClNO.HCl, NCGC00016711-01, AC1L4OT4, AC1Q3BB1, CAS-14984-68-0, SCHEMBL23733, MLS002154004, SPECTRUM1503920, CHEMBL1492516, DTXSID5045413, CHEBI:31420, Cloperastine hydrochloride [JAN], CTK8F8733, 3703-76-2 (Parent), MolPort-003-940-666, UNPLRYRWJLTVAE-UHFFFAOYSA-N, HMS1570O08, HMS1922K14, Pharmakon1600-01503920, Cloperastine Hydrochloride (JP17), 1-(2-(p-Cloro-alpha-fenilbenzilossi)etil)piperidina cloridrato, BCP13748, Tox21_110575, CCG-39374, NSC758635, AKOS015961657, Tox21_110575_1, API0002072, NSC-758635, RL01908, NCGC00095079-01, NCGC00095079-02, NCGC00178069-05, AC-14456, I590, SMR001233333, LS-114831, FT-0603201, Cloperastine hydrochloride, analytical standard, D01609, 984C680, C-21030, SR-01000841238-2, SR-01000841238-3, 1-[2-[(4-chlorophenyl)-phenylmethoxy]ethyl]piperidine hydrochloride, 1-{2-[(4-Chloro-phenyl)-phenyl-methoxy]-ethyl}-piperidine hydrochloride, Piperidine, 1-(2-((4-chlorophenyl)phenylmethoxy)ethyl)-, hydrochloride (9CI), Piperidine, 1-[2-[(4-chlorophenyl)phenylmethoxy]ethyl]-, hydrochloride (1:1), MolPort-005-976-888, MCULE-6526705979, AKOS015900932, I14-15783


ID: 2238

chemical graph of compound 2238



InChIKey: UOHFCPXBKJPCAD-UHFFFAOYSA-N
SMILES: COC1=CC=C(C=C1)C=C(C#N)C#N

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 2063
synonyms found at PubChem are:
Tyrphostin A1, Tyrphostin 1, 2826-26-8, (4-Methoxybenzylidene)malononitrile, AG 9, 2-[(4-methoxyphenyl)methylidene]propanedinitrile, 2-(4-Methoxybenzylidene)malononitrile, ((4-Methoxyphenyl)methylene)methane-1,1-dicarbonitrile, AG-9, Propanedinitrile, ((4-methoxyphenyl)methylene)-, UOHFCPXBKJPCAD-UHFFFAOYSA-N, (p-Methoxybenzylidene)malononitrile, [(4-Methoxybenzylidene)malononitrile, IN1438, NSC637326, (4-methoxybenzylidene)propanedinitrile, alpha-Cyano-(4-methoxy)cinnamonitrile], Propanedinitrile, [(4-methoxyphenyl)methylene]-, Propanedinitrile,2-[(4-methoxyphenyl)methylene]-, ag9, [(4-methoxyphenyl)methylene]methane-1,1-dicarbonitrile, AC1Q4PYH, BiomolKI_000016, ((4-Methoxyphenyl)methylene)propanedinitrile, Maybridge1_003703, Lopac-T-7040, (4-Anisylidene)malonitrile, BiomolKI2_000026, D0H3UI, Tyrphostin 1, >=98%, AC1L1CU0, AC1Q49KM, Lopac0_001150, BMK1-C4, BSPBio_001198, KBioGR_000538, KBioSS_000538, (p-Methoxybenzal)malononitrile, CHEMBL77456, ARONIS021285, BDBM4317, GTPL5917, p-methoxybenzylidenemalononitrile, SCHEMBL1982746, CHEBI:92740, CTK4G1112, HMS552A07, KBio2_000538, KBio2_003106, KBio2_005674, KBio3_000975, KBio3_000976, KS-00001YFE, ZINC42475, DTXSID10182508, NSC1343, MolPort-000-933-432, Bio2_000439, Bio2_000919, HMS1362L19, HMS1792L19, HMS1990L19, HMS3229M13, HMS3263F21, HMS3403L19, (4-Methoxybenzylidene)malodinitrile, NSC-1343, Tox21_501150, 4137AH, BBL008146, HSCI1_000106, MFCD00019787, SBB062079, STK046008, .alpha.-Cyano-p-methoxycinnamonitrile, AKOS000357412, CCG-100620, CS-3182, LP01150, Malononitrile, (p-methoxybenzylidene)-, MCULE-6231671516, NSC-637326, IDI1_002194, 1,1-Dicyano-2-(4-methoxyphenyl)ethene, 2-(4-Methoxy-benzylidene)-malononitrile, 2-(4-Methoxybenzylidene)malononitrile #, benzylidenemalononitrile (BMN) deriv. 1, NCGC00016042-01, NCGC00016042-02, NCGC00016042-03, NCGC00016042-04, NCGC00016042-05, NCGC00016042-06, NCGC00016042-07, NCGC00094413-01, NCGC00094413-02, NCGC00094413-03, NCGC00094413-04, NCGC00094413-05, NCGC00261835-01, 2-Cyano-3-(p-methoxyphenyl)acrylonitrile, FM 00023, HY-16668, ST019971, ZB001294, UPCMLD0ENAT0503-7296:001, 2-[(4-methoxyphenyl)methylene]malononitrile, AB0118789, DB-047364, Benzene, 1-methoxy-4-(2,2-dicyanoethenyl), EU-0101150, FT-0618927, T7625, 2-[(4-methoxyphenyl)methylene]propanedinitrile, 6K-003, T 7040, 2-[(4-methoxyphenyl)-methylene]-propanedinitrile, SR-01000076169, J-017022, SR-01000076169-1, BRD-K41996876-001-05-5, I14-60618, Z44300027, F0192-0840, InChI=1/C11H8N2O/c1-14-11-4-2-9(3-5-11)6-10(7-12)8-13/h2-6H,1H


ID: 2239

chemical graph of compound 2239



InChIKey: UORKIKBNUWJNJF-UHFFFAOYSA-N
SMILES: C1=CC=C2C(=C1)C=CC3=C2C=CC4=C3C(=O)C=CC4=O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 180933
synonyms found at PubChem are:
1,4-Chrysenequinone, Chrysene-1,4-dione, 100900-16-1, 1,4-Chrysenedione, 1-4-CHRYSENEQUINONE, Chrysene-1,4-quinone, CHEMBL421215, Prestwick_898, 1,4-Chrysenedione #, Prestwick0_000615, Prestwick1_000615, Prestwick2_000615, Prestwick3_000615, BSPBio_000550, SCHEMBL893374, SPBio_002769, ACMC-2097t5, AC1L483T, BPBio1_000606, CHEBI:94533, CTK0I0965, DTXSID90143571, MolPort-003-928-552, UORKIKBNUWJNJF-UHFFFAOYSA-N, HMS1569L12, HMS2096L12, KS-000014IO, ZINC2539285, ANW-14391, BDBM50107004, AKOS027320075, CC-1627, NCGC00016967-01, NCGC00016967-02, DB-005067, HY-111441, RT-006148, CAS-100900-16-1, CS-0040835, FT-0642436, C-16078, SR-01000872668, J-000250, SR-01000872668-1, BRD-K18812295-001-01-5, I14-108747


ID: 2240

chemical graph of compound 2240



InChIKey: UOSWGERPQQOSHS-UHFFFAOYSA-N
SMILES: CCCC1=C(N(NC1=C2C=CC(=O)C=C2)C3=CC=C(C=C3)O)C4=CC=C(C=C4)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6095481
synonyms found at PubChem are:
PPT, 263717-53-9, 1,3,5-Tris(4-hydroxyphenyl)-4-propyl-1H-pyrazole, PROPYLPYRAZOLETRIOL, propyl pyrazole triol, 4,4',4''-(4-propyl-1H-pyrazole-1,3,5-triyl)triphenol, UNII-0T83Y6JZPF, 0T83Y6JZPF, CHEBI:64110, 1,3,5-tris(4-hydroxyphenyl)-4-propylpyrazole, 4,4',4''-(4-Propyl-[1H]-pyrazole-1,3,5-triyl)trisphenol, 4,4',4''-(4-propylpyrazole-1,3,5-triyl)trisphenol, 4,4',4''-(4-propyl-(1H)-pyrazole-1,3,5-triyl)trisphenol, propylpyrazole triol, 4-(1,5-bis(4-hydroxyphenyl)-4-propyl-1,2-dihydro-3H-pyrazol-3-ylidene)cyclohexa-2,5-dien-1-one, PPT trisphenol compound, SR-01000075913, NCGC00015511-01, Tocris-1426, Lopac-H-6036, D0Y8UF, AC1O1FL0, Lopac0_000575, MLS001056593, SCHEMBL426190, CHEMBL441282, GTPL2819, DTXSID9040392, CHEBI:92007, CTK8E7595, MolPort-003-983-795, HMS2233O06, HMS3261D12, HMS3267J14, HMS3650I12, Tox21_500575, 1996AH, BDBM50398935, BS0150, MFCD03453628, ZINC13121898, AKOS024456590, ZINC100001833, CCG-204664, LP00575, KS-0000185H, NCGC00015511-02, NCGC00015511-03, NCGC00015511-04, NCGC00015511-05, NCGC00015511-06, NCGC00025159-01, NCGC00025159-02, NCGC00025159-03, NCGC00025159-04, NCGC00261260-01, ACM263717539, KB-59946, SMR000326968, RT-010978, B6735, EU-0100575, FT-0739972, J3.570.983E, H 6036, J-016401, SR-01000075913-1, SR-01000075913-3, SR-01000075913-6, SR-01000075913-9, BRD-K00312224-001-03-8, 4,4',4"-(4-Propyl-[1H]-pyrazole-1,3,5-triyl)trisphenol, 1,3,5-Tris(4-hydroxyphenyl)-4-propyl-1H-pyrazole, powder, >=98% (HPLC), 4-[2,3-bis(4-hydroxyphenyl)-4-propyl-1H-pyrazol-5-ylidene]cyclohexa-2,5-dien-1-one, 4-[2,3-Bis(4-hydroxyphenyl)-4-propyl-1H-pyrazole-5(2H)-ylidene]-2,5-cyclohexadiene-1-one


ID: 2241

chemical graph of compound 2241



InChIKey: UOTMYNBWXDUBNX-UHFFFAOYSA-N
SMILES: COC1=C(C=C(C=C1)CC2=NC=CC3=CC(=C(C=C32)OC)OC)OC.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6084
synonyms found at PubChem are:
PAPAVERINE HYDROCHLORIDE, 61-25-6, Cardiospan, Cardoverina, Dispamil, Drapavel, Forpavin, Papalease, Papaversan, Pavatest, Paverolan, Alapav, Cerebid, Delapav, Dilaves, Durapav, Dynovas, Myobid, Pameion, Papacon, Pavacap, Pavacen, Paveron, Pavnell, Vasal, Ro-Papav, Vaso-Pav, Artegodan, Cepaverin, Optenyl, Pavagrant, Pavakey, Pavased, Therapav, Dipav, Lapav, Pap-Kaps-150, Spasmo-Nit, 1-(3,4-Dimethoxybenzyl)-6,7-dimethoxyisoquinoline hydrochloride, PAP H, Papaverine (hydrochloride), Papaverinium chloride, NCI-C56359, Papanerin-hcl, Papavarine chlorhydrate, Papaverine Hcl, Papaverine chlorohydrate, Copavin, Papanerin-HCl [German], Papaverine monohydrochloride, NSC 35443, Pavadel, UNII-23473EC6BQ, CCRIS 3804, Chlorhydrate de papaverine [French], EINECS 200-502-1, 6,7-Dimethoxy-1-veratrylisoquinoline hydrochloride, MLS000028497, 23473EC6BQ, Isoquinoline, 6,7-dimethoxy-1-veratryl-, hydrochloride, Papaverine hydrochlorid, 6,7,3',4'-Tetramethoxy-1-benzylisoquinoline hydrochloride, SMR000058283, Pavabid (TN), DSSTox_CID_5825, C20H22ClNO4, DSSTox_RID_77939, DSSTox_GSID_25825, Isoquinoline, 1-((3,4-dimethoxyphenyl)methyl)-6,7-dimethoxy-, hydrochloride, NSC35443, CAS-61-25-6, SR-01000003098, NCGC00015810-02, 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxyisoquinoline;hydrochloride, Papaverine, HCl, Isoquinoline, 1-((3,4-dimethoxyphenyl)methyl)-6,7-dimethoxy-, hydrochloride (1:1), Isoquinoline, 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-, hydrochloride (1:1), Prestwick_376, Papaverine hydrochloride [USP:JAN], component of Copavin, Papaverine hydrochloride [USAN:JAN], PubChem6305, Papavarine hydrochloride, Papaverine, hydrochloride, AC1L1LRO, AC1Q3DLI, Opera_ID_1617, REGID_for_CID_6084, MLS001148655, MLS002222208, 58-74-2 (Parent), ARONIS23834, CHEMBL98123, SCHEMBL121268, SPECTRUM1500459, Papaverine hydrochloride, powder, DTXSID9025825, CTK8G2272, AOB5339, BBC/116, MolPort-000-847-203, UOTMYNBWXDUBNX-UHFFFAOYSA-N, HMS1569F08, HMS1920F06, Pharmakon1600-01500459, Tox21_110226, Tox21_500957, CCG-40065, HY-18077A, LS-267, MFCD00012745, NSC-35443, NSC757256, SBB080541, Papaverine hydrochloride (JP17/USP), AKOS005111070, Tox21_110226_1, API0003748, CS-5015, LP00957, NSC-757256, NCGC00015810-12, NCGC00094258-01, NCGC00094258-02, NCGC00094258-03, NCGC00094258-04, NCGC00094258-05, NCGC00094258-06, NCGC00261642-01, AS-13262, H754, ST077145, 1-(3,7-dimethoxyisoquinoline hydrochloride, KB-146860, TR-031684, EU-0100957, FT-0631269, P0016, D02218, P 3510, Isoquinoline,7-dimethoxy-1-veratryl-, hydrochloride, SR-01000003098-2, SR-01000003098-4, SR-01000003098-9, WLN: T66 CNJ B1R CO1 DO1& HO1 IO1 &GH, I01-13837, SR-01000003098-11, 6,3',4'-Tetramethoxy-1-benzylisoquinoline hydrochloride, 1-(3,4-Dimethoxybenzyl)-6,7-dimethoxyisoquinolinehydrochloride, Isoquinoline, 6,7-dimethoxy-1-veratryl-, hydrochloride (8CI), 4-[(6,7-dimethoxyisoquinolyl)methyl]-1,2-dimethoxybenzene, chloride, 6,7-Dimethoxy-1-(3,4-dimethoxybenzyl)-isoquinoline hydrochloride, Isoquinoline,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-, hydrochloride, 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxyisoquinoline hydrochloride, Papaverine hydrochloride, European Pharmacopoeia (EP) Reference Standard, Papaverine hydrochloride, Pharmaceutical Secondary Standard; Certified Reference Material, Papaverine hydrochloride, United States Pharmacopeia (USP) Reference Standard, AC1LCWFP, Papaverine hydrochloride(Pavabid), AKOS026749937, 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxyisoquinoline; hydron; chloride, 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxyisoquinolin-2-ium chloride, AC1NS0PA, MolPort-000-740-853, MCULE-2677621965, A833127, 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-isoquinolin-2-ium chloride


ID: 2242

chemical graph of compound 2242



InChIKey: UOWZUVNAGUAEQC-UHFFFAOYSA-N
SMILES: C1=CC(=C(C=C1OC2=C(C=C(C=C2I)CC(=O)O)I)I)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5803
synonyms found at PubChem are:
Tiratricol, 51-24-1, Triac, 3,3',5-TRIIODOTHYROACETIC ACID, Triacana, Tiratricolum, Triiodothyroacetic acid, 2-[4-(4-hydroxy-3-iodophenoxy)-3,5-diiodophenyl]acetic acid, UNII-29OQ9EU4R1, Tiratricol [INN], 3',3,5-Triiodothyroacetic acid, CHEMBL41632, 29OQ9EU4R1, Tiratricol (INN), CAS-51-24-1, NCGC00016227-01, Teatrois, Benzeneacetic acid, 4-(4-hydroxy-3-iodophenoxy)-3,5-diiodo-, Tiratricol, 3,3',5-triiodothyroacetic acid, DSSTox_CID_25232, DSSTox_RID_80767, DSSTox_GSID_45232, 4-(4-Hydroxy-3-iodophenoxy)-3,5-diiodophenylacetic acid, 2-[4-(4-hydroxy-3-iodo-phenoxy)-3,5-diiodo-phenyl]acetic acid, [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-DIIODO-PHENYL]-ACETIC ACID, 4HY, SMR000058684, SR-01000003135, Tiratricolum [INN-Latin], 2-(4-(4-hydroxy-3-iodophenoxy)-3,5-diiodophenyl)acetic acid, C14H9I3O4, Tiracana (TN), Prestwick_439, EINECS 200-086-1, 1nq0, Levothyroxine Impurity C, Prestwick0_000202, Prestwick1_000202, Prestwick2_000202, Prestwick3_000202, D0J6XC, Triiodothyroacetic acid, 3, REGID_for_CID_5803, SCHEMBL25149, BSPBio_000183, MLS000028613, MLS006010657, SPBio_002104, AC1L1L68, BPBio1_000203, GTPL2637, DTXSID2045232, BDBM18862, CTK8F4764, 4-(4-Hydroxy-3-iodophenoxy)-3,5-diiodobenzeneacetic acid, MolPort-003-959-798, 3,3',5'-Triiodothyroacetic acid, HMS1568J05, HMS2095J05, HMS3264A05, HMS3652J07, HMS3712J05, Pharmakon1600-01506047, 3,3',5-Triiodo Thyroacetic Acid, BCP07182, HY-B1201, ZINC4217580, 1477-04-9 (hydrochloride salt), Tox21_110317, Tox21_303544, MFCD00055931, NSC759294, s4185, AKOS015951178, API0004430, CCG-213970, CS-4829, DB03604, NSC-759294, KS-0000196U, NCGC00016227-02, NCGC00016227-03, NCGC00016227-04, NCGC00016227-05, NCGC00016227-08, NCGC00257371-01, AN-41594, AS-15930, R418, 3,3',5-Triiodothyroacetic acid, >=90%, SBI-0207015.P001, 3,3',5-Triiodothyroacetic acid, free acid, AB1008568, FT-0675568, D07214, 055T931, SR-01000003135-2, SR-01000003135-3, BRD-K61236135-001-03-3, (4-(4-Hydroxy-3-iodophenoxy)-3,5-diiodophenyl)acetic acid, [4-(4-Hydroxy-3-iodophenoxy)-3,5-diiodophenyl]acetic Acid (Triiodothyroacetic Acid)


ID: 2243

chemical graph of compound 2243



InChIKey: UPBAOYRENQEPJO-UHFFFAOYSA-N
SMILES: CN1C=C(C=C1C(=O)NC2=CN(C(=C2)C(=O)NC3=CN(C(=C3)C(=O)NCCC(=N)N)C)C)NC=O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3115
synonyms found at PubChem are:
distamycin a, Stallimycin, Distamycin, Herperetin, 636-47-5, Distamycin 3, DST-A, UNII-80O63P88IS, NSC82150, FI 6426, CHEMBL11252, 80O63P88IS, NCGC00018292-04, NSC 150528, Estalimicina, Stallimicina, Stallimycine, Stallimycinum, Distamicina A, DISTAMYCIN HYDROCHLORIDE, NSC150528, Dst-3, D0BS6Q, AC1L1F7B, AC1Q5M1Q, DSSTox_CID_25637, DSSTox_RID_81018, DSSTox_GSID_45637, SCHEMBL108585, DTXSID9045637, cid_6602691, UPBAOYRENQEPJO-UHFFFAOYSA-N, ZINC3872327, 6576-51-8 (mono-hydrochloride), Tox21_110857, BDBM50055659, CCG-36393, NSC-82150, NCGC00018292-01, NCGC00018292-02, NCGC00018292-03, NCGC00018292-05, NCGC00024382-03, CAS-636-47-5, NCI60_041805, SR-01000000269, SR-01000000269-3, N,4''-Ter[pyrrole-2-carboxamide], N''-(2-amidinoethyl)-4-formamido-1,1',1''-trimethyl-, 1H-Pyrrole-2-carboxamide, N-(5-(((3-amino-3-iminopropyl)amino)carbonyl)-1-methyl-1H-pyrrol-3-yl)-4-(((4-(formylamino)-1-methyl-1H-pyrrol-2-yl)carbonyl)amino)-1-methyl- (9CI), 2N-(3,3-aminoiminopropyl)-4-[4-(4-formamido-1-methyl-1H-2-pyrrolylcarboxamido)-1-methyl-1H-2-pyrrolylcarboxamido]-1-methyl-1H-2-pyrrolecarboxamide, 2N-[5-(3-amino-3-iminopropylcarbamoyl)-1-methyl-1H-3-pyrrolyl]-4-(4-formamido-1-methyl-1H-2-pyrrolylcarboxamido)-1-methyl-1H-2-pyrrolecarboxamide, 2N-[5-(3-amino-3-iminopropylcarbamoyl)-1-methyl-1H-3-pyrrolyl]-4-(4-formamido-1-methyl-1H-2-pyrrolylcarboxamido)-1-methyl-1H-2-pyrrolecarboxamide(distamycin A), 2N-[5-(3-amino-3-iminopropylcarbamoyl)-1-methyl-1H-3-pyrrolyl]-4-(4-formamido-1-methyl-1H-2-pyrrolylcarboxamido)-1-methyl-1H-2-pyrrolecarboxamide(Distamycin), 4N-[5-(3-amino-3-iminopropylcarbamoyl)-1-methyl-1H-2-pyrrolyl]-2-(4-formamido-1-methyl-1H-2-pyrrolylcarboxamido)-1-methyl-1H-4-pyrrolecarboxamide, 5N-[5-(3-amino-3-iminopropylcarbamoyl)-1-methyl-2,3-dihydro-1H-3-pyrrolyl]-3-(4-formamido-1-methyl-1H-2-pyrrolylcarboxamido)-1-methyl-2,3-dihydro-1H-5-pyrrolecarboxamide, N-(3-amino-3-iminopropyl)-4-(4-(4-formamido-1-methyl-1H-pyrrole-2-carboxamido)-1-methyl-1H-pyrrole-2-carboxamido)-1-methyl-1H-pyrrole-2-carboxamide, N-[5-[[(Amino-3-iminopropyl)amino]carbonyl]-1-methyl-1H-pyrrol-3-yl-4-[[(4-(formylamino)-1-methyl-1H-pyrrol-2yl]carbonyl]amino]-1H-pyrrole-2-carboxamide, N-[5-[[5-[(3-amino-3-imino-propyl)carbamoyl]-1-methyl-pyrrol-3-yl]carbamoyl]-1-methyl-pyrrol-3-yl]-4-formamido-1-methyl-pyrrole-2-carboxamide, N-[5-[[5-[(3-amino-3-iminopropyl)carbamoyl]-1-methylpyrrol-3-yl]carbamoyl]-1-methylpyrrol-3-yl]-4-formamido-1-methylpyrrole-2-carboxamide


ID: 2244

chemical graph of compound 2244



InChIKey: UPHWJAWTGRBPAJ-UHFFFAOYSA-N
SMILES: CC1(C=CC2=C(O1)C=C3C(=C2OC)C(=C(C(=O)O3)C4=CC=C(C=C4)OC)OC)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 4262362
synonyms found at PubChem are:
Robustic acid methyl ether, Methyl robustate, KBio2_003602, Spectrum_000554, SpecPlus_000621, AC1N6MHO, Spectrum2_001801, Spectrum3_001257, Spectrum4_001591, Spectrum5_000302, BSPBio_002794, KBioGR_002202, KBioSS_001034, DivK1c_006717, SPBio_001781, CHEMBL3039033, SCHEMBL12062097, KBio1_001661, KBio2_001034, KBio2_006170, KBio3_002294, CCG-38447, LMPK12160026, SDCCGMLS-0066522.P001, 5,6-dimethoxy-7-(4-methoxyphenyl)-2,2-dimethylpyrano[3,2-g]chromen-8-one


ID: 2245

chemical graph of compound 2245



InChIKey: UPJFTVFLSIQQAV-UHFFFAOYSA-N
SMILES: CCCCC1C2CCCC=C2C(=O)O1

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5018391
synonyms found at PubChem are:
Sedanolide, 6415-59-4, 3-butyl-3a,4,5,6-tetrahydro-3H-2-benzofuran-1-one, 3-Butyl-3a,4,5,6-tetrahydro-1(3H)-isobenzofuranone, (3S,3aR)-(-)-Sedanolide, Sedanolid, CCRIS 7108, trans-Sedanolide, trans-Neocnidilide, Sedanolide, trans-, AC1NMZ0G, SCHEMBL7651293, CHEMBL2165230, CTK8G3082, MolPort-004-964-842, UPJFTVFLSIQQAV-UHFFFAOYSA-N, AKOS006281161, VA11737, SC-50513, FT-0636144, V0337, A834653, 3-butyl-3a,4,5,6-tetrahydro-3H-isobenzofuran-1-one, 3-butyl-3a,4,5,6-tetrahydroisobenzofuran-1(3H)-one, 1(3H)-Isobenzofuranone, 3-butyl-3a,4,5,6-tetrahydro-, 1(3H)-Isobenzofuranone,3-butyl-3a,4,5,6-tetrahydro-, 3-butyl-1,3,3a,4,5,6-hexahydro-2-benzofuran-1-one, 3-Butyl-3a,4,5,6-tetrahydro-1(3H)-isobenzofuranone, 9CI, (3S,3aR)-3-Butyl-3a,4,5,6-tetrahydroisobenzofuran-1(3H)-one, 1(3H)-Isobenzofuranone, 3-butyl-3a,4,5,6-tetrahydro-, (3S,3aR)-


ID: 2246

chemical graph of compound 2246



InChIKey: UPQIJUPZPPSCEM-UHFFFAOYSA-N
SMILES: C1=CC=C(C=C1)COC2=CC=CC=C2C3=NOC(=C3)CCl

biological descriptors:

CFTR relevance: CFTR modulators

Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown

reference list:

"BA Woodworth" "EJ Sorscher" "BT Conger" "SB Hicks" "SM Rowe" "S Zhang" "D Skinner"


CID is 17750929
synonyms found at PubChem are:
601519-76-0, 3-(2-Benzyloxy-phenyl)-5-chloromethyl-isoxazole, UCCF-152, 3-(2-Benzyloxyphenyl)-5-chloromethylisoxazole, CHEMBL315425, SCHEMBL4069467, CTK5B1068, DTXSID00590779, ZINC22115080, AKOS030539482, KB-26486, EC-000.1916, 3-[2-(benzyloxy)phenyl]-5-(chloromethyl)isoxazole, 3-[2-(Benzyloxy)phenyl]-5-(chloromethyl)-1,2-oxazole, 5-(chloromethyl)-3-(2-phenylmethoxyphenyl)-1,2-oxazole


ID: 2247

chemical graph of compound 2247



InChIKey: UPUDVKWQBVIKBG-UHFFFAOYSA-N
SMILES: CCOC1=C(C=C(C=C1)CC2=NC=CC3=CC(=C(C=C32)OCC)OCC)OCC.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 13796
synonyms found at PubChem are:
Perparin, Perparine, Perperine, Isovex, Perparin hydrochloride, Perparine hydrochloride, Perperine hydrochloride, Papetherine hydrochloride, EINECS 213-573-9, NSC 525044, 1-(3,4-Diethoxybenzyl)-6,7-diethoxyisoquinoline hydrochloride, 6,7-Diethoxy-1-(3,4-diethoxybenzyl)isoquinoline hydrochloride, Isoquinoline, 1-((3,4-diethoxyphenyl)methyl)-6,7-diethoxy-, hydrochloride, ISOQUINOLINE, 1-(3,4-DIETHOXYBENZYL)-6,7-DIETHOXY-, HYDROCHLORIDE, C24H29NO4.HCl, AC1L22I2, Isoquinoline, 1-(3,4-diethoxybenzyl)-6,7-dimethoxy-, hydrochloride, 17159-58-9, LS-85495, 1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxyisoquinolin-2-ium chloride, Ethaverine hydrochloride, 985-13-7, Papetherine, Consenil, Ethaquin, Laverin, Neopavrin, Paveroid, Cebral, ETHAVERINE HCl, Barbonin hydrochloride, UNII-6Z6T599E49, 6Z6T599E49, DSSTox_CID_27759, DSSTox_RID_82536, DSSTox_GSID_47779, SR-01000872675, NCGC00016557-01, CAS-985-13-7, 1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxyisoquinoline;hydrochloride, Isoquinoline, 1-((3,4-diethoxyphenyl)methyl)-6,7-diethoxy-, hydrochloride (1:1), Isoquinoline, 1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxy-, hydrochloride (1:1), Ethaquin (TN), Ethylpapaverine HCl, Prestwick_1049, AC1NWASE, SCHEMBL317507, SPECTRUM1501000, 486-47-5 (Parent), CHEMBL1316965, DTXSID2047779, KS-00002WVN, MolPort-003-666-340, HMS1570F21, HMS1921O22, Pharmakon1600-01501000, Tox21_110492, CCG-39003, NSC525044, NSC757818, AKOS024255721, Tox21_110492_1, KS-1407, MCULE-3681389000, NSC-525044, NSC-757818, NCGC00016557-06, NCGC00094883-01, NCGC00094883-02, 6,4-diethoxybenzyl)isoquinoline hydrochloride, D07927, SR-01000872675-1, SR-01000872675-2, Isoquinoline,4-diethoxybenzyl)-6,7-diethoxy-, hydrochloride, Isoquinoline,4-diethoxyphenyl)methyl]-6,7-diethoxy-, hydrochloride, 1-[(3,4-diethoxyphenyl)methyl]-6,7-diethoxyisoquinoline hydrochloride, SCHEMBL17603566, AKOS026749877


ID: 2248

chemical graph of compound 2248



InChIKey: UQGKUQLKSCSZGY-UHFFFAOYSA-N
SMILES: CCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C4=NNN=N4)C(=O)OCC5=C(OC(=O)O5)C)C(C)(C)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 130881
synonyms found at PubChem are:
Olmesartan medoxomil, 144689-63-4, Benicar, Olmetec, CS-866, Cs 866, Olmesartan (medoxomil), Benevas, Olvance, UNII-6M97XTV3HD, Olmesartan medoximil, Benicar (TN), Olmetec (TN), 6M97XTV3HD, CS-866DM, CS-866RN, C29H30N6O6, CS866, DE-092, KS-1182, NCGC00095136-01, (5-methyl-2-oxo-1,3-dioxol-4-yl)methyl 5-(2-hydroxypropan-2-yl)-2-propyl-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]imidazole-4-carboxylate, 1H-Imidazole-5-carboxylic acid, 4-(1-hydroxy-1-methylethyl)-2-propyl-1-((2'-(1H-tetrazol-5-yl) (1,1'-biphenyl)-4-yl)methyl)-, (5-methyl-2-oxo-1,3-dioxol-4-yl) methyl ester, 1H-Imidazole-5-carboxylic acid, 4-(1-hydroxy-1-methylethyl)-2-propyl-1-((2'-(1H-tetrazol-5-yl)(1,1'-biphenyl)-4-yl)methyl)-, (5-methyl-2-oxo-1,3-dioxol-4-yl)methyl ester, Olsertain, (5-Methyl-2-oxo-1,3-dioxol-4-yl)Methyl 1-((2'-(1H-tetrazol-5-yl)-[1,1'-biphenyl]-4-yl)Methyl)-4-(2-hydroxypropan-2-yl)-2-propyl-1H-iMidazole-5-carboxylate, (5-methyl-2-oxo-2H-1,3-dioxol-4-yl)methyl 4-(2-hydroxypropan-2-yl)-2-propyl-1-({4-[2-(1H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl}methyl)-1H-imidazole-5-carboxylate, 1H-imidazole-5-carboxylic acid, 4-(1-hydroxy-1-methylethyl)-2-propyl-1-((2'-(1H-tetrazol-5-yl)(1,1'-biphenyl)-4-yl)methyl)-,(5-methyl-2-oxo-1,3-dioxol-4-yl)methyl ester, SR-05000001987, votume, Openvas, (5-methyl-2-oxo-1,3-dioxol-4-yl)methyl 5-(2-hydroxypropan-2-yl)-2-propyl-3-[[4-[2-(1H-tetrazol-5-yl)phenyl]phenyl]methyl]imidazole-4-carboxylate, Olmesartan medoxomil [USAN:INN:BAN], Spectrum_001944, Spectrum2_000506, Spectrum3_001676, Spectrum4_000740, Spectrum5_001556, D07UBG, Benicar, Olmetec,Olmesartan, DSSTox_CID_25924, DSSTox_RID_81226, DSSTox_GSID_45924, SCHEMBL16403, BSPBio_003491, GTPL591, KBioGR_001040, KBioSS_002498, MLS006010109, SPECTRUM1505205, SPBio_000431, Olmesartan medoxomil (Benicar), AC1L2Y71, CHEMBL1200692, DTXSID9045924, CHEBI:31932, KBio2_002490, KBio2_005058, KBio2_007626, KBio3_002711, KS-00000IVQ, AOB3863, Olmesartan medoxomil (JAN/USAN), UQGKUQLKSCSZGY-UHFFFAOYSA-N, HMS1922L15, HMS2089K18, HMS2093K16, HMS3651E13, HMS3715N09, Pharmakon1600-01505205, BCP05214, EBD35964, Olmesartan medoxomil (JP17/USAN), ZINC4149248, Tox21_111445, BDBM50442892, CCG-39596, Forest Brand of Olmesartan Medoxomil, NSC758924, Olmesartan medoxomil tablets (JP17), s1604, Sankyo Brand of Olmesartan Medoxomil, STL451024, AKOS015894907, AKOS015914772, AC-1601, AN-1125, BCP9000555, CCG-221184, CS-0577, MCULE-2480015750, NSC-758924, Olmesartan medoxomil, >=98% (HPLC), RP17784, NCGC00095136-02, NCGC00095136-03, (5-methyl-2-oxo-1,3-dioxolen-4-yl)methoxy-4-(1-hydroxy-1-methylethyl)-2-propyl-1-(4-(2-(tetrazol-5-yl)phenyl)phenyl)methylimidazol-5-carboxylate, BC208264, BC209016, BR-72894, CPD004727564, HY-17005, SAM001246634, SC-17112, SMR002203616, SBI-0206741.P001, AB0012006, AB1009487, Berlin-Chemie Brand of Olmesartan Medoxomil, LS-181818, CAS-144689-63-4, FT-0601603, O0510, ST24031498, D01204, J10058, S-1787, AB01275443-01, AB01275443_02, AB01275443_03, 689O634, A808260, L001061, I06-0025, J-501595, SR-05000001987-1, SR-05000001987-2, BRD-K78485176-001-02-9, BRD-K78485176-001-03-7, I14-41691, Z1550675457, Olmesartan medoxomil, European Pharmacopoeia (EP) Reference Standard, Olmesartan medoxomil, United States Pharmacopeia (USP) Reference Standard, Olmesartan medoxomil for system suitability, European Pharmacopoeia (EP) Reference Standard, Olmesartan Medoxomil, Pharmaceutical Secondary Standard; Certified Reference Material, (5-methyl-2-oxidanylidene-1,3-dioxol-4-yl)methyl 5-(2-oxidanylpropan-2-yl)-2-propyl-3-[[4-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]methyl]imidazole-4-carboxylate, (5-Methyl-2-oxo-1,3-dioxol-4-yl)methyl 1-((2'-(1H-tetrazol-5-yl)-[1,1'-biphenyl]-4-yl)methyl)-4-(2-h, (5-methyl-2-oxo-1,3-dioxol-4-yl)methyl 1-((2'-(1H-tetrazol-5-yl)-[1,1'-biphenyl]-4-yl)methyl)-4-(2-hydroxypropan-2-yl)-2-propyl-1H-i midazole-5-carboxylate, (5-Methyl-2-oxo-1,3-dioxol-4-yl)methyl 1-((2'-(1H-tetrazol-5-yl)-[1,1'-biphenyl]4-yl)methyl)-4-(2-hydroxypropan-2-yl)-2-propyl-1H-imidazole-5-carboxylate, (5-methyl-2-oxo-1,3-dioxol-4-yl)methyl 1-((2'-(1h-tetrazol-5-yl)biphenyl-4-yl)methyl)-4-(2-hydroxypropan-2-yl)-2-propyl-1h-imidazole-5-carboxylate, (5-methyl-2-oxo-1,3-dioxol-4-yl)methyl 1-((2'-(2H-tetrazol-5-yl)-[1,1'-biphenyl]-4-yl)methyl)-4-(2-hydroxypropan-2-yl)-2-propyl-1H-imidazole-5-carboxylate, (5-methyl-2-oxo-1,3-dioxol-4-yl)methyl 1-((2'-(2H-tetrazol-5-yl)biphenyl-4-yl)methyl)-4-(2-hydroxypropan-2-yl)-2-propyl-1H-imidazole-5-carboxylate, (5-Methyl-2-oxo-1,3-dioxol-4-yl)methyl 1-[[2'-(1H-Tetrazol-5-yl)-[1,1'-biphenyl]-4-yl]methyl]-4-(2-hydroxypr, (5-Methyl-2-oxo-1,3-dioxol-4-yl)methyl 4-(2-hydroxy-2-propanyl)-2-propyl-1-[[2'-(1H-tetrazol-5-yl)-4-biphenylyl]methyl]-1H-imidazole-5-carboxylate, (5-methyl-2-oxo-1,3-dioxol-4-yl)methyl 4-(2-hydroxypropan-2-yl)-2-propyl-1-{[2'-(1H-tetrazol-5-yl)biphenyl-4-yl]methyl}-1H-imidazole-5-carboxylate, (5-methyl-2-oxo-1,3-dioxol-4-yl)methyl 5-(1-hydroxy-1-methyl-ethyl)-2-propyl-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]imidazole-4-carboxylate, (5-methyl-2-oxo-1,3-dioxol-4-yl)methyl 5-(2-hydroxypropan-2-yl)-2-propyl-3-({4-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl}methyl)imidazole-4-carboxylate, (5-Methyl-2-oxo-1,3-dioxolen-4-yl)methyl 4-(1-hydroxy-1-methylethyl)-2-propyl-1-[[2'-(1H-tetrazol-5-yl)biphenyl-4-yl]methyl]imidazole-5-carboxylate, (5-Methyl-2-oxo-1,3-dioxolen-4-yl)methyl 4-(1-hydroxy-1-methylethyl)-2-propyl-1-{4-[2-(tetrazol-5-yl)phenyl]phenyl}methylimidazole-5-carboxylate, (5-methyl-2-oxo-1,3-dioxolen-4-yl)methyl 4-(1-hydroxy-1-methylethyl)-2-propyl-1-{4-[2-(tetrazol-5-yl)phenyl]phenylmethyl}imidazol-5-carboxylate;, (5-Methyl-2-oxo-1,3-dioxolen-4yl)methyl 4-(1-hydroxy-1-methylethyl)-2-propyl-1-{4-[2-(tetrazol-5-yl)phenyl]phenyl}methylimidazole-5-carboxylate, (5-methyl-2-oxo-2H-1,3-dioxol-4-yl)methyl 4-(2-hydroxypropan-2-yl)-2-propyl-1-{[2'-(1H-1,2,3,4-tetrazol-5-yl)-[1,1'-biphenyl]-4-yl]methyl}-1H-imidazole-5-carboxylate, 1H-Imidazole-5-carboxylic acid, 4-(1-hydroxy-1-methylethyl)-2-propyl-1-[[2'-(2H-tetrazol-5-yl)[1,1'-biphenyl]-4-yl]methyl]-, (5-methyl-2-oxo-1,3-dioxol-4-yl)methyl ester, 5-(1-HYDROXY-1-METHYLETHYL)-2-PROPYL-3-[2'-(1H-TETRAZOL-5-YL)-BIPHENYL-4-YLMETHYL]-3H-IMIDAZOLE-4-CARBOXYLIC ACID 5-METHYL-2-OXO-[1,3]DIOXOL-4-YLMETHYL ESTER, 5-(2-hydroxypropan-2-yl)-2-propyl-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-4-imidazolecarboxylic acid (5-methyl-2-oxo-1,3-dioxol-4-yl)methyl ester, Olmesartan medoxomil|4-(1-Hydroxy-1-methylethyl)-2-propyl-1-[[2'-(2H-tetrazol-5-yl)[1,1'-biphenyl]-4-yl]methyl]-1H-Imidazole-5-carboxylic acid-(5-methyl-2-oxo-1,3-dioxol-4-yl)methyl ester, Olmetec; 4-(1-Hydroxy-1-methylethyl)-2-propyl-1-[[2'-(1Htetazol-5-yl)[1,1'-biphenyl]-4-yl]methyl]-1H-imidazole-5-carboxylic acid (5-methyl-2-oxo-1,3-dioxol-4-yl)methyl ester


ID: 2249

chemical graph of compound 2249



InChIKey: UQOQENZZLBSFKO-POPPZSFYSA-N
SMILES: CCCCC[C@@H](/C=C/[C@@H]1[C@H](C=CC1=O)C/C=C\CCCC(=O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5280884
synonyms found at PubChem are:
prostaglandin J2, PGJ2, 9-Deoxy-delta-9-prostaglandin D2, 9-Deoxy-delta-9-pgd2, 60203-57-8, 8-epi-15-J2t-IsoP, CHEBI:27485, UQOQENZZLBSFKO-POPPZSFYSA-N, Prosta-5,9,13-trien-1-oic acid, 15-hydroxy-11-oxo-, (5Z,13E,15S)-, 11-oxo-15S-hydroxy-5Z,9,13E-prostatrienoic acid, (5Z,13E,15S)-15-hydroxy-11-oxoprosta-5,9,13-trien-1-oic acid, 11-oxo-15S-hydroxy-5Z,9,13E-prostatrienoic acid-cyclo[8S,12R], PGJ2 (Prostaglandin J2), SR-05000002330, AC1NQXQ1, D0Y6OX, BSPBio_001498, BML1-G07, GTPL1885, SCHEMBL5700581, CHEMBL1397260, DTXSID4041105, MolPort-003-959-398, HMS1361K20, HMS1791K20, HMS1989K20, HMS3402K20, HMS3648L18, LMFA03010019, ZINC12496015, AKOS024418774, IDI1_033968, SMP2_000100, NCGC00161294-01, NCGC00161294-02, NCGC00161294-03, LS-176073, C05957, 11-oxo-15S-hydroxy-5Z,8Z,13E-prostatrienoate, 11-oxo-15S-hydroxy-5Z,8Z,13E-prostatrienoic acid, SR-05000002330-2, SR-05000002330-3, BRD-K56811497-001-03-2, (Z)-7-[(1S,5R)-5-[(E,3S)-3-hydroxyoct-1-enyl]-4-oxo-1-cyclopent-2-enyl]hept-5-enoic acid, (Z)-7-[(1S,5R)-5-[(E,3S)-3-hydroxyoct-1-enyl]-4-oxo-cyclopent-2-en-1-yl]hept-5-enoic acid, (Z)-7-[(1S,5R)-5-[(E,3S)-3-hydroxyoct-1-enyl]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid


ID: 2250

chemical graph of compound 2250



InChIKey: UQRORFVVSGFNRO-UHFFFAOYSA-N
SMILES: CCCCN1CC(C(C(C1CO)O)O)O

biological descriptors:

CFTR relevance: Placebo

Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Lebacq" "A Leonard" "P Lebecque" "T Leal" "P Wallemacq" "B Lubamba" "R Vanbever"


CID is 5150939
synonyms found at PubChem are:
N-(n-Butyl)deoxygalactonojirimycin, NCGC00018140-02, AC1NP69U, SCHEMBL719055, CHEMBL187262, SCHEMBL19627562, 1-Butyl-2-(hydroxymethyl)-3,4,5-piperidinetriol, 1-butyl-2-(hydroxymethyl)piperidine-3,4,5-triol


ID: 2251

chemical graph of compound 2251



InChIKey: UQSRXQMIXSZGLA-UHFFFAOYSA-N
SMILES: CCOC(=O)C1=C(C=C(C=C1C)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 75653
synonyms found at PubChem are:
Ethyl 2,4-dihydroxy-6-methylbenzoate, 2524-37-0, Ethyl orsellinate, Orsellinic acid, ethyl ester, Benzoic acid, 2,4-dihydroxy-6-methyl-, ethyl ester, o-Orsellinic acid, ethyl ester, UNII-3035H4GP23, 2,4-Dihydroxy-6-methylbenzoic Acid Ethyl Ester, UQSRXQMIXSZGLA-UHFFFAOYSA-N, 3035H4GP23, Benzoic acid,2,4-dihydroxy-6-methyl-, ethyl ester, NSC 149781, Spectrum_000785, ACMC-209gic, SpecPlus_000248, Spectrum2_000390, Spectrum3_000694, Spectrum4_001427, Spectrum5_000254, orsellinic acid ethyl ester, AC1L2P8A, AC1Q64CT, .beta.-Resorcylic acid, 6-methyl-, ethyl ester, BSPBio_002447, KBioGR_001874, KBioSS_001265, SPECTRUM200002, MLS002695995, DivK1c_006344, SPBio_000579, SCHEMBL1648471, 4-Carbethoxy-5-methylresorcinol, CHEMBL1601166, DTXSID4062488, CTK4F5293, KBio1_001288, KBio2_001265, KBio2_003833, KBio2_006401, KBio3_001667, CHEBI:113535, MolPort-001-763-843, ZINC160491, 2-Carbethoxy-3,5-dihydroxytoluene, 4-Ethoxycarbonyl-5-methylresorcinol, ZX-AT025328, .beta.-Resorcylic acid, ethyl ester, 2009AB, ANW-25666, CCG-38661, NSC149781, 2-Ethoxycarbonyl-3,5-dihydroxytoluene, AKOS015889573, CS-W000427, FCH1115422, NSC-149781, SDCCGMLS-0066439.P001, KS-0000025K, NCGC00095458-01, NCGC00095458-02, 4CN-1259, AJ-15596, AK-88792, CC-07467, KB-50832, SMR001562139, TS-02774, ZB007376, AX8000170, ST2406856, TC-114411, Ethyl 2,4-dihydroxy-6-methylbenzoate, 98%, FT-0634342, ss-Resorcylic acid, 6-methyl-, ethyl ester, 2,4-Dihydroxy-6-methyl-benzoic acid ethyl ester, Benzoic acid,4-dihydroxy-6-methyl-, ethyl ester, C-08933, SR-05000002432, 2,4-DIHYDROXY-6-METHYLBENZOICACIDETHYLESTER, J-015886, SR-05000002432-1, beta-Resorcylic acid, 6-methyl-, ethyl ester (8CI), BRD-K97487499-001-02-2, I01-19846, InChI=1/C10H12O4/c1-3-14-10(13)9-6(2)4-7(11)5-8(9)12/h4-5,11-12H,3H2,1-2H


ID: 2252

chemical graph of compound 2252



InChIKey: UQTZMGFTRHFAAM-ZETCQYMHSA-N
SMILES: C1=CC(=C(C=C1C[C@@H](C(=O)O)N)I)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 439744
synonyms found at PubChem are:
3-Iodo-L-tyrosine, 70-78-0, H-Tyr(3-I)-OH, 3-IODOTYROSINE, 3-IODO-TYROSINE, L-Tyrosine, 3-iodo-, Monoiodotyrosine, (S)-2-Amino-3-(4-hydroxy-3-iodophenyl)propanoic acid, 3-Monoiodo-L-tyrosine, IODOTYROSINE, 3-Iodo-4-hydroxyphenylalanine, H-3-Iodo-Tyr-OH, (2S)-2-amino-3-(4-hydroxy-3-iodophenyl)propanoic acid, UNII-FRQ98U4U27, Tyrosine, 3-iodo-, MLS000069664, FRQ98U4U27, CHEBI:27847, UQTZMGFTRHFAAM-ZETCQYMHSA-N, SMR000059143, I-7700, C9H10INO3, IYR, EINECS 200-744-8, L-Tyrosine-3-iodo, IOTYROSINE, NSC 210787, bmse000337, Tyrosine, 3-iodo-, L-, AC1L97YH, Lopac0_000673, KSC223I7D, 4-Hydroxy-3-iodophenylalanine, SCHEMBL159412, 3-Iodo-L-tyrosine (I-Tyr), CHEMBL479789, cid_439744, ZINC1575, DTXSID1075353, L-Tyrosine, 3-iodo- (9CI), BDBM37633, CTK1C3471, 4-Hydroxy-3-iodophenylalanine #, MolPort-003-848-222, ZX-AFC003197, HMS3262G07, ACT02993, EBD12375, KS-00000MM1, Tyrosine, 3-iodo-, L- (8CI), Tox21_500673, ANW-35953, CI-043, KM1371, MFCD00002608, S(-)-3-Iodo-4-hydroxy-phenylamine, S(-)-3-Iodo-4-hydroxyphenylalanine, SBB069112, AKOS015919312, AC-7495, AM83577, CCG-204759, CS-W008452, DB01758, FCH3512538, HY-W008452, LP00673, RTR-023384, NCGC00022269-03, NCGC00022269-04, NCGC00022269-05, NCGC00261358-01, AJ-08050, AK-86417, AS-18515, CC-15382, KB-70882, 3-Iodo-L-tyrosine, >=99.0% (HPLC), AX8006619, ST2414589, TR-023384, EU-0100673, FT-0615918, I0075, ST51005934, W8001, C02515, I 8250, 002T608, C-19077, SR-01000075606, SR-01000075606-1, (2S)-2-amino-3-(4-hydroxy-3-iodophenyl)propanoate, (2S)-2-amino-3-(4-hydroxy-3-iodo-phenyl)propionic acid, (2S)-2-azanyl-3-(3-iodanyl-4-oxidanyl-phenyl)propanoic acid, 1E933C28-2631-4076-821D-3F47E9A1B023, 2751-18-0, monoiodo-tyrosine, AC1OCG4V, MONOIODO-L-TYROSINE, 3-iodo-L-tyrosine zwitterion, CHEBI:59898, ZB000364, A836990, (2S)-2-ammonio-3-(4-hydroxy-3-iodophenyl)propanoate, (2S)-2-azaniumyl-3-(4-hydroxy-3-iodophenyl)propanoate, (2S)-2-azaniumyl-3-(4-hydroxy-3- iodophenyl)propanoate, (2S)-2-azaniumyl-3-(3-iodanyl-4-oxidanyl-phenyl)propanoate


ID: 2253

chemical graph of compound 2253



InChIKey: UQZKYYIKWZOKKD-UHFFFAOYSA-N
SMILES: CC1=CC=CC=C1C(C2=CC=CC=C2)OCCN(C)C.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 9568
synonyms found at PubChem are:
Orphenadrine hydrochloride, 341-69-5, Orphenadrine HCl, Mebedrol, Mephenamin, Mefenamin hydrochloride, Mephenamin forte, Mephenamin hydrochloride, Orfenadrin hydrochloride, Mephenamine hydrochloride, Orphenadrine (hydrochloride), BF 5930, BG 5930, BS 5930, EINECS 206-435-4, NSC 82357, MLS000069427, 2-Dimethylaminoethyl 2-methylbenzhydryl ether hydrochloride, Ethanamine, N,N-dimethyl-2-[(2-methylphenyl)phenylmethoxy]-, hydrochloride, SMR000058999, Disipal (TN), Ethanamine, N,N-dimethyl-2-((2-methylphenyl)phenylmethoxy)-, hydrochloride, Orphenadrine (Chloride), N,N-Dimethyl-2-(o-methyl-alpha-phenylbenzyloxy)ethylamine hydrochloride, beta-Dimethylaminoethyl 2-methylbenzhydryl ether hydrochloride, N,N-Dimethyl-2-(2-methylbenzhydryloxy)ethylamine hydrochloride, ETHYLAMINE, N,N-DIMETHYL-2-((o-METHYL-alpha-PHENYLBENZYL)OXY)-, HYDROCHLORIDE, CHEBI:60902, SR-01000002975, orphenadrine*HCl, N,N-dimethyl-2-[(2-methylphenyl)-phenylmethoxy]ethanamine;hydrochloride, Prestwick_663, Disipal hydrochloride, Orphenadrine Chloride, Opera_ID_658, AC1L1TBY, AC1Q3BLK, AC1Q3DQC, Orphenedrine hydrochloride, DSSTox_CID_5815, CAS-341-69-5, DSSTox_RID_77934, DSSTox_GSID_25815, REGID_for_CID_9568, MLS001148572, MLS002548882, MLS006011645, Disipal, Orphenadrinhydrochlorid, SCHEMBL1235378, CHEMBL1201023, DTXSID5025815, (+/-)-orphenadrine hydrochloride, MolPort-002-111-239, HMS1568P19, 247046-64-6 (citrate), HY-B1126, NSC82357, o-Methyldiphenhydramine hydrochloride, Tox21_301927, Tox21_500884, MFCD00012480, NSC-82357, AKOS024307520, WLN: 1N1&2OYR&R B1 &GH, API0003697, CCG-220239, CCG-222188, CS-4723, LP00884, LS-1218, MCULE-1907411306, NC00465, NCGC00089814-04, NCGC00094204-01, NCGC00094204-02, NCGC00255176-01, NCGC00261569-01, AN-23409, CPD000058999, SAM002264628, EU-0100884, FT-0631984, O0406, Orphenadrine hydrochloride, >=98.0% (AT), ST50320118, WLN: 1N1 & 2OYR & R B1 & GH, D02599, O 3752, Dimethyl-[2-(2-methyl-benzhydryloxy)-aethyl]-amin, dimethyl-[2-(2-methyl-benzhydryloxy)-ethyl]-amine, J-019475, SR-01000002975-2, SR-01000002975-7, dimethyl{2-[(2-methylphenyl)phenylmethoxy]ethyl}amine, chloride, N,N-dimethyl-2-(phenyl(o-tolyl)methoxy)ethanamine hydrochloride, N,N-dimethyl-2-[o-tolyl(phenyl)methoxy]ethanamine hydrochloride, Ethylamine,N-dimethyl-2-[phenyl-(o-tolyl)methoxy]-, hydrochloride, N,N-Dimethyl-2-[(.alpha.-o-tolylbenzyl)oxy]ethylamine hydrochloride, N,N-Dimethyl-2-[.alpha.-(o-tolyl)benzyloxy]ethylamine hydrochloride, dimethyl({2-[(2-methylphenyl)(phenyl)methoxy]ethyl})amine hydrochloride, Ethanamine,N-dimethyl-2-[(2-methylphenyl)phenylmethoxy]-, hydrochloride, Ethylamine,N-dimethyl-2-[.alpha.-(o-tolyl)benzyloxy]-, hydrochloride, N,N-Dimethyl-2-(o-methyl-.alpha.-phenylbenzyloxy)ethylamine hydrochloride, N,N-dimethyl-2-[(2-methylphenyl)-phenylmethoxy]ethanamine hydrochloride, Orphenadrine hydrochloride, European Pharmacopoeia (EP) Reference Standard, Ethanamine, N,N-dimethyl-2-((2-methylphenyl)phenylmethoxy)-, hydrochloride (9CI), Ethylamine,N-dimethyl-2-[(o-methyl-.alpha.-phenylbenzyl)oxy]-, hydrochloride, Orphenadrine for peak identification, European Pharmacopoeia (EP) Reference Standard, AC1LCW8R, AKOS015909563, I14-31866, N,N-dimethyl-2-[(2-methylphenyl)-phenylmethoxy]ethanamine; hydron; chloride, N,N-dimethyl-2-[(2-methylphenyl)(phenyl)methoxy]ethanaminium chloride, N,N-dimethyl-2-[(2-methylphenyl)(phenyl)methoxy]ethanamine hydrochloride


ID: 2254

chemical graph of compound 2254



InChIKey: URAYPUMNDPQOKB-UHFFFAOYSA-N
SMILES: CC(=O)OCC(COC(=O)C)OC(=O)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5541
synonyms found at PubChem are:
triacetin, Glyceryl triacetate, 102-76-1, Glycerol triacetate, Glycerin triacetate, Enzactin, Triacetine, Triacetylglycerol, Fungacetin, Glyped, Triacetyl glycerine, Vanay, Kesscoflex TRA, Kodaflex triacetin, 1,2,3-Propanetriol, triacetate, Acetin, tri-, Triacetina, Triacetinum, 1,2,3-triacetoxypropane, 1,2,3-Propanetriol triacetate, propane-1,2,3-triyl triacetate, Triacetyl glycerin, Triacetyl glycerol, 1,2,3-Propanetriyl triacetate, 1,2,3-Triacetylglycerol, Triacetin [INN], 1,2,3-Propanetriol, 1,2,3-triacetate, FEMA Number 2007, Triacetine [INN-French], Triacetinum [INN-Latin], Triacetina [INN-Spanish], NSC 4796, UNII-XHX3C3X673, FEMA No. 2007, HSDB 585, Triacetin (USP/INN), Acetic, 1,2,3-propanetriyl ester, ENZACTIN (TN), EINECS 203-051-9, 1,2,3-triacetyl-glycerol, TRIACETIN (GLYCEROL TRIACETATE), 2-(Acetyloxy)-1-[(acetyloxy)methyl]ethyl acetate, BRN 1792353, 2,3-diacetyloxypropyl acetate, 1,2,3-triacetyl-sn-glycerol, AI3-00661, CHEBI:9661, XHX3C3X673, Glycerol triacetate (Triacetin), E1518, C9H14O6, URAYPUMNDPQOKB-UHFFFAOYSA-N, 1,3-bis(acetyloxy)propan-2-yl acetate, NCGC00091612-04, Triacetin (1,2,3-Propanetriol triacetate), DSSTox_CID_6691, DSSTox_RID_78184, DSSTox_GSID_26691, triacetylglycerin, CAS-102-76-1, 2-acetyloxy-1-(acetyloxymethyl)ethyl acetate, Estol 1581, Triacetin [USP:INN:BAN], Enzacetin, Euzactin, Fungacet, Motisil, Blekin, tri-acetin, CCRIS 9355, EOIEyOOEao yen, EOIEy xEao yen, 3-Triacetoxypropane, Glycerine triacetate, Triacetin, 99%, Spectrum_000881, AC1L1KKQ, AC1Q1LBU, Spectrum2_000939, Spectrum3_001368, Spectrum4_000362, Spectrum5_001376, ACMC-1C1GI, D0Q6DX, EC 203-051-9, Triacetin, >=99.5%, AC1Q1L9A, SCHEMBL3870, BSPBio_002896, Glycerol triacetate tributyrin, KBioGR_000823, KBioSS_001361, 4-02-00-00253 (Beilstein Handbook Reference), KSC176O0H, MLS002152946, 1,3-Propanetriol, triacetate, DivK1c_000740, Glyceryl triacetate, >=99%, SPECTRUM1500585, Triacetin, analytical standard, SPBio_000878, Triacetin, 99%, FCC, FG, CHEMBL1489254, DTXSID3026691, CTK0H6703, FEMA 2007, HMS502E22, KBio1_000740, KBio2_001361, KBio2_003929, KBio2_006497, KBio3_002116, KS-00000YQB, EBD5636, NSC4796, MolPort-001-787-791, NINDS_000740, Ey x(3/4)<<, HMS1921G05, HMS2092O09, HMS2232I22, Pharmakon1600-01500585, Glycerol triacetate, 99% 500g, HY-B0896, NSC-4796, ZINC1530705, Tox21_111155, Tox21_201745, Tox21_300111, WLN: 1VO1YOV1 & 1OV1, ANW-14741, CCG-39680, LMGL03012615, MFCD00008716, NSC757364, s4581, SBB060703, Triacetin, 8CI, BAN, INN, USAN, 1,2,3-Propanetriol triacetate, 9CI, AKOS009028851, Tox21_111155_1, Glyceryl triacetate, >=99.0% (GC), LS-2356, MCULE-6622854116, NSC-757364, RP27112, RTR-033474, IDI1_000740, NCGC00091612-01, NCGC00091612-02, NCGC00091612-03, NCGC00091612-05, NCGC00091612-06, NCGC00091612-07, NCGC00091612-09, NCGC00254207-01, NCGC00259294-01, CJ-05210, CJ-24005, S168, SMR001224538, SBI-0051540.P002, TR-033474, FT-0626753, G0086, ST51046833, EN300-19216, D00384, E 1518, AB00052112_06, SR-05000002079, I14-2610, J-000781, SR-05000002079-1, 2-(Acetyloxy)-1-[(acetyloxy)methyl]ethyl acetate #, Z1258578263, Triacetin, GTA F.G (1,2,3-PROPANETRIOL TRIACETATE), Triacetin, United States Pharmacopeia (USP) Reference Standard, Triacetin, Pharmaceutical Secondary Standard; Certified Reference Material, 1,2,3-Propanetriol triacetate; 1,2,3-Triacetoxypropane; 1,2,3-Triacetylglycerol; Glycerol triacetate, InChI=1/C9H14O6/c1-6(10)13-4-9(15-8(3)12)5-14-7(2)11/h9H,4-5H2,1-3H


ID: 2255

chemical graph of compound 2255



InChIKey: URBFHJWLYXILMP-VOMIJIAVSA-N
SMILES: CN1CCC2=CC3=C(C=C2[C@@H]1[C@@H]4C5=C(C(=C(C=C5)OC)OC)C(=O)O4)OCO3.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 197834
synonyms found at PubChem are:
Hydrastine hydrochloride, Hydrastine HCl, beta-Hydrastine hydrochloride, UNII-562PDC2I9K, EINECS 227-692-9, 562PDC2I9K, 5936-28-7, Hydrastine hydrochloride [USP], Hydrastinhydrochlorid, Prestwick_262, MLS002153888, (+)-B-HYDRASTINE HCL, SCHEMBL1374184, CHEMBL1256988, HMS1569F04, AC1L5445, LS-76348, SMR001233238, Hydrastine hydrochloride, European Pharmacopoeia (EP) Reference Standard, (3S)-6,7-dimethoxy-3-[(5R)-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl]-3H-2-benzofuran-1-one hydrochloride


ID: 2256

chemical graph of compound 2256



InChIKey: URCDBMLCEGDNOK-CTRMUPKMSA-N
SMILES: C[C@H]1/C=C/C=C(/C(=O)NC2=CC(=C3C(=C2O)C(=C(C4=C3C(=O)[C@](O4)(O/C=C/[C@@H]([C@H]([C@H]([C@@H]([C@@H]([C@@H]([C@H]1O)C)O)C)OC(=O)C)C)OC)C)C)O)O)\C.[Na]

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 46782886
synonyms found at PubChem are:
Rifamycin SV sodium, Tuborin, Rifamastene, 5,6,9,17,19,21-Hexahydroxy-23-methoxy-2,4,12,16,18,20,22-heptamethyl-2,7-(epoxypentadeca[1,11,13]trienimino)naphtho[2,1-b]furan-1,11(2H)-dione 21-Acetate Sodium Salt


ID: 2257

chemical graph of compound 2257



InChIKey: URDOHUPGIOGTKV-JTBFTWTJSA-M
SMILES: CO/N=C(/C1=CC=CO1)\C(=O)N[C@H]2[C@@H]3N(C2=O)C(=C(CS3)COC(=O)N)C(=O)[O-].[Na+]

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6523269
synonyms found at PubChem are:
Cefuroxime sodium salt, CEFUROXIME SODIUM, Anaptivan, Biociclin, Sodium cefuroxime, Zinacef, Colifossim, Curoxima, Curoxime, Spectrazolr, Ultroxim, Bioxima, Cefofix, Cefumax, Cefurex, Curocef, Curoxim, Furoxil, Kesint, Ketocef, Lifurox, Medoxim, Cefuroxim Hexal, Cefuroxim Lilly, Cefuroxima Fabra, Cefuroxim AJ, Cefuroxim MN, Cefuroxim curasan, Cefuroxima Richet, Cetroxil [inj.], Cefuroxim Fresenius, Cefuroxim Genericsn, 56238-63-2, Froxal [inj.], Sharox [inj.], Zinnat [inj.], Cetroxil, Froxal, cefuroxime na, Cefuroxim Norcox, Cefuroxim Norcox [inj.], Kefurox, Cefuroxime (sodium), Sharox, cefuroximesodium, KEFUROX IN PLASTIC CONTAINER, ZINACEF IN PLASTIC CONTAINER, UNII-R8A7M9MY61, Zinacef (TN), Cefuroxime sodium [USAN:BAN:JAN], EINECS 260-073-1, CEFUROXIME AND DEXTROSE IN DUPLEX CONTAINER, CHEBI:3517, R8A7M9MY61, Cefuroxime for Injection and Dextrose for Injection in Duplex Container, Biofuroksym, Cefuroximine, Cefuril, Cefuroxim, KS-1040, Sodium (6R,7R)-7-(2-(2-furyl)glyoxylamido)-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylate, 7(sup 2)-(Z)-(O-methyloxime), carbamate (ester), Cefuroxime (TN), Sodium (6R-(6alpha,7beta(Z)))-3-(((aminocarbonyl)oxy)methyl)-7-(2-furyl(methoxyimino)acetamido)-8-oxo-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylate, Cefuroxime (USAN/INN), (6R,7R)-3-[[(Aminocarbonyl)oxy]methyl]-7-[[(2Z)-2-furanyl(methoxyimino)acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic Acid Sodium Salt, 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 3-(((aminocarbonyl)oxy)methyl)-7-((2-furanyl(methoxyimino)acetyl)amino)-8-oxo-, monosodium salt (6R-(6alpha,7beta(Z)))-, CXM, Biofurex, Cefurin, Novocef, Duxima, MLS000069576, Cefuroxime sodium [USP:BAN:JAN], sodium;(6R,7R)-3-(carbamoyloxymethyl)-7-[[(2Z)-2-(furan-2-yl)-2-methoxyiminoacetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate, Zinnat (TN), (6R,7R)-3-[(carbamoyloxy)methyl]-7-[(2Z)-2-(furan-2-yl)-2-(methoxyimino)acetamido]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, (6R,7R)-3-[(carbamoyloxy)methyl]-7-{[(2Z)-2-furan-2-yl-2-(methoxyimino)acetyl]amino}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 3-[(carbamoyloxy)methyl]-7beta-[(2Z)-2-(furan-2-yl)-2-(methoxyimino)acetamido]-3,4-didehydrocepham-4-carboxylic acid, DUXIMA SODIUM SALT, CEFURIN SODIUM SALT, NOVOCEF SODIUM SALT, SMR000058808, ZINACEF SODIUM SALT, D0Y2IE, BIOFUREX SODIUM SALT, ANAPTIVAN SODIUM SALT, BIOCICLIN SODIUM SALT, MLS001332625, MLS001332626, C16H15N4O8S.Na, Cefuroxime sodium (JAN/USP), SCHEMBL719536, Cefuroxime sodium (JP15/USP), CHEMBL2146124, MolPort-002-885-814, HMS2097O21, HMS3714O21, HY-B1256, s4620, AKOS015961772, AB53970, CCG-220720, CS-4733, AC-15028, AN-40200, BC208459, LS-149936, C08108, D00915, Cefuroxime sodium, European Pharmacopoeia (EP) Reference Standard, Cefuroxime sodium, United States Pharmacopeia (USP) Reference Standard, (6R,7R)-3-(carbamoyloxymethyl)-7-[[(2Z)-2-(2-furyl)-2-methoxyimino-acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate, sodium (6R,7R)-3-(carbamoyloxymethyl)-7-((E)-2-(furan-2-yl)-2-(methoxyimino)acetamido)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate, sodium (6R,7R)-3-(carbamoyloxymethyl)-7-[[(2Z)-2-(2-furyl)-2-methoxyimino-acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate, (6R,7R)-3-(Carbamoyloxymethyl)-7alpha-[[2-(2-furyl)-2-methoxyiminoacetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid sodium salt, 90013-55-1


ID: 2258

chemical graph of compound 2258



InChIKey: UREBDLICKHMUKA-DVTGEIKXSA-N
SMILES: C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2([C@]1(C(=O)CO)O)C)O)F)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 9782
synonyms found at PubChem are:
betamethasone, 378-44-9, Betadexamethasone, Flubenisolone, Celestone, Betamethazone, Rinderon, Betacorlan, Betacortril, Betamamallet, Betametasone, Betapredol, Betasolon, Betnelan, Betsolan, Celestene, Hormezon, Methazon, Visubeta, Bebate, Becort, Bedifos, Cidoten, beta-Methasone, Desacort-Beta, Rinderon A, beta-Methasone alcohol, Betafluorene, Betametasona, Betamethasonum, Betamethasone cream, Betamethasone alcohol, Betametasone [DCIT], Valisone, 9alpha-Fluoro-16beta-methylprednisolone, Cellestoderm, Celeston, Celestona, Betametasona [INN-Spanish], Betamethasonum [INN-Latin], Celestone Syrup and Tablets, 9-Fluoro-16beta-methylprednisolone, SCH 4831, Lotrisone, Luxiqo, Betamethasone Base, SCH-4831, Celestone (TN), NSC-39470, Rinderon (TN), UNII-9842X06Q6M, 9-alpha-Fluoro-16-beta-methylprednisolone, Betamethasone Valearate, HSDB 3015, Betamethasonvalerat Mikron, Betamethasone (Celestone), Betamethasone [USAN:BAN:INN:JAN], Betamethasone [USAN:INN:BAN:JAN], EINECS 206-825-4, NSC 39470, Prednisolone, 9-fluoro-16beta-methyl-, BRN 3176546, 9-Fluoro-11beta,17,21-trihydroxy-16beta-methylpregna-1,4-diene-3,20-dione, MLS000859943, CHEBI:3077, UREBDLICKHMUKA-DVTGEIKXSA-N, 9-Fluoro-11-beta,17,21-trihydroxy-16-beta-methylpregna-1,4-diene-3,20-dione, NCS-39470, 9-Fluoro-16.beta.-methylprednisolone, Pregna-1,4-diene-3,20-dione, 9-fluoro-11,17,21-trihydroxy-16-methyl-, (11beta,16beta)-, 9842X06Q6M, (8S,9R,10S,11S,13S,14S,16S,17R)-9-fluoro-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one, C22H29FO5, NCGC00164401-01, SMR000058601, 9alpha-Fluoro-16 beta-methyl-prednisolone, Corticosterone, 1-dehydro-9-fluoro-17-hydroxy-16beta-methyl-, 9.alpha.-Fluoro-16.beta.-methylprednisolone, DSSTox_CID_2667, 16-beta-Methyl-1,4-pregnadiene-9-alpha-fluoro-11-beta,17-alpha,21-triol-3,20-dione, 16beta-Methyl-1,4-pregnadiene-9alpha-fluoro-11beta,17alpha,21-triol-3,20-dione, 9-alpha-Fluoro-16-beta-methyl-1,4-pregnadiene-11-beta,17-alpha,21-triol-3,20-dione, DSSTox_RID_76681, Pregna-1,4-diene-3,20-dione, 9-fluoro-11beta,17,21-trihydroxy-16beta-methyl-, DSSTox_GSID_22667, (8S,9R,10S,11S,13S,14S,16S,17R)-9-fluoro-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-3-one, Pregna-1,4-diene-3,20-dione, 9-fluoro-11,17,21-trihydroxy-16-methyl-, (11.beta.,16.beta.)-, .beta.-Methasone, 9-Fluoro-11.beta.,17,21-trihydroxy-16.beta.-methylpregna-1,4-diene-3,20-dione, .beta.-Methasone alcohol, bethamethasone, NSC39470, Desacort-.beta., .beta.-Corlan, Betnovate (TN), Diprosone (TN), Lotrisone (TN), NCGC00091019-08, CAS-378-44-9, Prestwick_703, Prednisolone, 9-fluoro-16.beta.-methyl-, Betamethasone, topical, Betamethasone [USAN:USP:INN:BAN:JAN], Betamethasone, >=98%, Prestwick0_000362, Prestwick1_000362, Prestwick2_000362, Prestwick3_000362, CHEMBL632, D0CW1P, D0J5MP, D0Y4LP, EC 206-825-4, AC1L1TT4, cid_9782, SCHEMBL4565, BIDD:PXR0047, BSPBio_000483, 4-08-00-03501 (Beilstein Handbook Reference), MLS001066413, MLS001332616, MLS002153244, SPBio_002404, Corticosterone, 1-dehydro-9-fluoro-17-hydroxy-16.beta.-methyl-, BPBio1_000533, GTPL7061, 9-Fluoro-11,17,21-trihydroxy-16-methylpregna-1,4-diene-3,20-dione, DTXSID3022667, BDBM73823, Betamethasone (JP15/USP/INN), Betamethasone (JP17/USP/INN), (11beta,16beta)-9-Fluoro-11,17,21-trihydroxy-16-methylpregna-1,4-diene-3,20-dione, 1,4-Pregnadiene-3,20-dione-9alpha-fluoro-16 beta-methyl-11 beta,17alpha,21-triol, 9alpha-Fluoro-11beta,17alpha,21-trihydroxy-16beta-methyl-1,4-pregnadiene-3,20-dione, MolPort-003-845-025, BCPP000345, HMS1569I05, HMS2096I05, HMS2233I08, HMS3713I05, BCP02020, ZINC3876136, Tox21_112115, Tox21_301455, MFCD00062969, s1500, AKOS008901360, AKOS015894863, Tox21_112115_1, ACN-043339, API0001693, BCP9000393, CCG-220362, CS-1897, DB00443, EBD2157848, KS-5302, SMP1_000043, NCGC00164401-02, NCGC00164401-03, NCGC00255195-01, HY-13570, AB0012192, AB1009527, LS-118466, D1961, FT-0622922, LT00441022, Betamethasone, meets USP testing specifications, C06848, D00244, 20525-EP2272832A1, 20525-EP2295409A1, 20525-EP2298778A1, 20525-EP2308562A2, 20525-EP2314585A1, 20525-EP2314590A1, 20525-EP2371811A2, 378M449, Betamethasone, VETRANAL(TM), analytical standard, SR-01000780582, SR-01000780582-2, W-106509, BRD-K39188321-001-03-9, 378-44-9,956901-32-9(XHCl), Betamethasone, European Pharmacopoeia (EP) Reference Standard, Betamethasone, pharmaceutical impurity standard, >=95.0% (HPLC), Betamethasone, United States Pharmacopeia (USP) Reference Standard, (11.beta.,16.beta.)-9-Fluoro-11,17,21-trihydroxy-16-methylpregna-1,4-diene-3,20-dione, 1,4-Pregnadiene-3,20-dione-9alpha-fluoro-16 beta-methyl-11beta,17alpha,21-triol, 9-.alpha.-Fluoro-11-.beta.,17,21-trihydroxy-16-.beta.-methylpregna-1,4-diene-3,20-dione, 9-fluoro-16beta-methyl-11beta,17,21-trihydroxypregna-1,4-diene-3,20-dione, 9alpha-Fluoro-11beta,17alpha,21-trihydroxy-16beta-methylpregna-1,4-diene-3,20-dione, 9alpha-Fluoro-16 beta-methyl-11beta,17alpha, 21-trihydroxy-1,4-pregnadiene-3,20-dione, 9alpha-Fluoro-16beta-methyl-11beta,17alpha,21-trihydroxy-1,4-pregnadiene-3,20-dione, Betamethasone, Pharmaceutical Secondary Standard; Certified Reference Material, Celestone, Betadexamethasone, Flubenisolone, Sch-4831, NCS-39470, Betamethasone, Pregna-1,4-diene-3,20-dione, 9-fluoro-11-beta,17,21-trihydroxy-16-beta-methyl-, Pregna-1,4-diene-3,20-dione, 9-fluoro-11.beta.,17,21-trihydroxy-16.beta.-methyl-, Pregna-1,4-diene-3,20-dione, 9-fluoro-11beta,17,21-trihydroxy-16beta-methyl- (8CI), Pregna-1,4-diene-3,20-dione, 9alpha-fluoro-11beta,17alpha,21-trihydroxy-16beta-methyl-, (1R,2S,10S,11S,13S,14R,15S,17S)-1-fluoro-14,17-dihydroxy-14-(2-hydroxyacetyl)-2,13,15-trimethyltetracyclo[8.7.0.0;{2,7}.0;{11,15}]heptadeca-3,6-dien-5-one, 16-.beta.-Methyl-1,4-pregnadiene-9-.alpha.-fluoro-11-.beta.,17-.alpha.,21-triol-3,20-dione, 9-.alpha.-Fluoro-11-.beta.,17-.alpha.,21-trihydroxy-16-.beta.-methylpregna-1,4-diene-3,20-dione, 9-.alpha.-Fluoro-16-.beta.-methyl-1,4-pregnadiene-11-.beta.,17-.alpha.,21-triol-3,20-dione, 9-Fluoro-11,17,21-trihydroxy-16-methylpregna-1,4-diene-3,20-dione, (11.beta.,16.beta.) #


ID: 2259

chemical graph of compound 2259



InChIKey: UREZNYTWGJKWBI-UHFFFAOYSA-M
SMILES: CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OCCOCC[N+](C)(C)CC2=CC=CC=C2.[Cl-]

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 8478
synonyms found at PubChem are:
benzethonium chloride, 121-54-0, Quatrachlor, Hyamine, Phemeride, Phemerol Chloride, Benzethoniumchloride, Phemithyn, Disilyn, Kylacol, Solamin, Diapp, Polymine D, Hyamine 1622, Benzetonium chloride, Anti-germ 77, Benzethonii chloridum, Antiseptol, Banagerm, Cloruro de benzetonio, Chlorure de benzethonium, Benzetonio cloruro, Benzethoni chloridum, Inactisol, Benzethonium chloride 1622, Microklenz, UNII-PH41D05744, p-tert-Octylphenoxyethoxyethyldimethylbenzylammonium chloride, Formula 144, Phemerol chloride monohydrate, Caswell No. 614B, Diisobutylphenoxyethoxyethyl dimethyl benzyl ammonium chloride, Diisobutylphenoxyethoxyethyldimethyl benzyl ammonium chloride, CHEBI:31264, BZT (VAN), Benzetonio cloruro [DCIT], benzyldimethyl(2-{2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy}ethyl)azanium chloride, CCRIS 4748, HSDB 567, PH41D05744, 5929-09-9, Antiseptol (quarternary compound), Phemersol chloride, Benzethonii chloridum [INN-Latin], NCI-C61494, p-Diisobutyl phenoxyethoxyethyl dimethyl benzylammonium chloride, EINECS 204-479-9, (2-(2-(4-Diisobutylphenoxy)ethoxy)ethyl)dimethylbenzylammonium chloride, Cloruro de benzetonio [INN-Spanish], DSSTox_CID_3810, NSC 20200, Benzyldimethyl-p-(1,1,3,3-tetramethylbutyl)phenoxyethoxy-ethylammonium chloride, Chlorure de benzethonium [INN-French], EPA Pesticide Chemical Code 069154, DSSTox_RID_77195, DSSTox_GSID_23810, N,N-Dimethyl-N-(2-(2-(4-(1,1,3,3-tetramethylbutyl)phenoxy)ethoxy)ethyl)-benzenemethanaminium chloride, QAC, Diisobutyl phenoxy ethoxy ethyl dimethyl benzyl ammonium chloride, p-Diisobutyl(phenoxyethoxy)ethyl]dimethylbenzylammonium chloride, Benzenemethanaminium, N,N-dimethyl-N-(2-(2-(4-(1,1,3,3-tetramethylbutyl)phenoxy)ethoxy)ethyl)-, chloride, p-Diisobutylphenoxyethoxyethyldimethylbenzylammonium chloride monohydrate, 2-(2-(p-(Diisobutyl)phenoxy)ethoxy)ethyl dimethyl benzyl ammonium chloride, CHEMBL221753, Benzyldimethyl (2-(2-(p-(1,1,3,3-Tetramethylbutyl) Phenoxy) Ethoxy) Ethyl) Ammonium Chloride, Benzyldimethyl(2-(2-(4-(1,1,3,3-tetramethylbutyl)phenoxy)ethoxy)ethyl)ammonium chloride, Benzyldimethyl(2-(2-(p-(1,1,3,3-tetramethylbutyl)phenoxy)ethoxy)ethyl)ammonium chloride, Ammonium, benzyldimethyl(2-(2-(p-(1,1,3,3-tetramethylbutyl)phenoxy)ethoxy)ethyl)-, chloride, monohydrate, Benzenemethanaminium, N,N-dimethyl-N-[2-[2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]ethoxy]ethyl]-, chloride (1:1), N-benzyl-N,N-dimethyl-2-(2-(4-(2,4,4-trimethylpentan-2-yl)phenoxy)ethoxy)ethanaminium chloride, NSC20200, Ammonium, benzyldimethyl(2-(2-(p-(1,1,3,3-tetramethylbutyl)phenoxy)ethoxy)ethyl)-, chloride, SR-05000001572, NCGC00016373-03, CAS-121-54-0, Salanine, Neostelin green, [2-[2-(4-Diisobutylphenoxy)ethoxy]ethyl]dimethylbenzylammonium chloride, {2-[2-(4-diisobutylphenoxy)ethoxy]ethyl}dimethylbenzylammonium chloride, benzyl-dimethyl-[2-[2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy]ethyl]azanium;chloride, benzyldimethyl(2-{2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]ethoxy}ethyl)ammonium chloride, benzyldimethyl(2-{2-[p-(1,1,3,3-tetramethylbutyl)phenoxy]ethoxy}ethyl)ammonium chloride, Microklenz (TN), Benzenemethanaminium, N,N-dimethyl-N-(2-(2-(4-(1,1,3,3-tetramethylbutyl)phenoxy)ethoxy)ethyl)-, chloride (1:1), N,N-dimethyl-N-(2-{2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]ethoxy}ethyl)-benzenemethanaminium chloride, N-benzyl-N,N-dimethyl-2-{2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy}ethanaminium chloride, Prestwick_995, Hyamine (TN), p-Diisobutylphenoxyethoxyethyl dimethyl benzyl ammonium chloride, Neostelin green (TN), Benzethonium chloride [USP:INN:BAN:JAN], Benzenemethanaminium, N,N-dimethyl-N-(2-(2-(4-(1,1,3,3-tetramethylbutyl)phenoxy)ethoxy)- ethyl)-, chloride, N,N-Dimethyl-N-(2-(2-(4-(1,1,3,3-tetramethylbutyl)phenoxy)ethoxy)- ethyl)benzenemethanaminium chloride, EC 204-479-9, AC1L1R2Y, Benzethonium chloride, 97%, C27H42ClNO2, SCHEMBL21713, MLS002153968, AE>> UEthOONoi section sign, ARONIS24565, SPECTRUM1500138, DTXSID6023810, HMS502G17, KS-00000UZH, MolPort-001-794-650, UREZNYTWGJKWBI-UHFFFAOYSA-M, HMS1570M17, HMS1920G07, HMS2091M09, HMS2097M17, HMS2230M22, HMS3373H09, HMS3652D03, HMS3714M17, Pharmakon1600-01500138, BENZETHONIUM CHLORIDE, 98%, HY-B0942, KS-000046VJ, Tox21_110403, Tox21_202488, Benzethonium chloride, 97% 100g, CCG-39713, MFCD00011742, NSC-20200, NSC755908, s4162, AKOS005287417, Tox21_110403_1, ACN-034828, MCULE-8602828714, NE18983, NSC-755908, RL00966, Benzethonium chloride (JP17/USP/INN), NCGC00016373-08, NCGC00091528-01, NCGC00091528-02, NCGC00094597-01, NCGC00094597-02, NCGC00094597-03, NCGC00094597-04, NCGC00260037-01, AS-14646, BC675287, LS-16821, M019, SC-20328, SMR001233307, AB1011453, B0044, FT-0622657, FT-0635910, Hyamine(R) 1622 solution, 4 mM in H2O, Benzethonium chloride, tested according to USP, C12539, D01140, Benzethonium chloride, BioUltra, >=99.0% (AT), I06-1604, J-200196, SR-05000001572-1, SR-05000001572-3, F2173-1223, Z1317839149, Benzethonium chloride, >=97% (titration), >=98% (HPLC), [Diisobutyl(phenoxyethoxy)ethyl]dimethylbenzylammonium chloride, [[(Diisobutyl)phenoxyethoxyethyl]dimethylbenzyl]ammonium chloride, [[(Diisobutylphenoxy)ethoxy]ethyl] dimethyl benzyl ammonium chloride, Ammonium,1,3,3-tetramethylbutyl)phenoxy]ethoxy]ethyl]-, chloride, Ammonium,1,3,3-tetramethylbutyl)phenoxy]ethoxy]ethyl]-,chloride, (Diisobutylphenoxyethoxyethyl)dimethylbenzylammonium chloride; Hyamine? 1622, Benzethonium chloride, European Pharmacopoeia (EP) Reference Standard, Benzethonium chloride, United States Pharmacopeia (USP) Reference Standard, Benzethonium Chloride, Pharmaceutical Secondary Standard; Certified Reference Material, benzyl-dimethyl-[2-[2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy]ethyl]azanium chloride, Benzyldimethyl-[[[p-(1,3,3-tetramethylbutyl)phenoxy]ethoxy]ethyl]ammonium chloride, Benzyldimethyl[2-[2-[4-(1,3,3-tetramethylbutyl)phenoxy]ethoxy]ethyl]ammonium chloride, Benzyldimethyl[2-[2-[p-(1,3,3-tetramethylbutyl)phenoxy]ethoxy]ethyl]ammonium chloride, WLN: 1X1 & 1 & 1X1 & 1 & R DO2O2K1 & 1 & 1R & Q & G, 324034-09-5, 39362-38-4, Benzenemethanaminium, N,N-dimethyl-N-(2-(2-(4-(1,1,3,3-tetramethylbutyl)phenoxy)ethoxy)ethyl)-, chloride, monohydrate, Benzenemethanaminium,N-dimethyl-N-[2-[2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]ethoxy]ethyl]-, chloride, N-benzyl-N,N-dimethyl-2-(2-(4-(2,4,4-trimethylpentan-2-yl)phenoxy)ethoxy)ethan-1-aminium chloride, N-benzyl-N,N-dimethyl-2-{2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]ethoxy}ethanaminium chloride, UEth>>u paragraph signthorn(1/4)x>>u[2-[2-[4-(1,1,3,3-EA(1/4)x>>u paragraph sign inverted exclamation mark>>u)+/-(1/2)No>>u]OONo>>u]OO>>u]AE>> i section sign EUO masculine


ID: 2260

chemical graph of compound 2260



InChIKey: URFCJEUYXNAHFI-ZDUSSCGKSA-N
SMILES: C1[C@H](OC2=CC(=CC(=C2C1=O)O)O)C3=CC=CC=C3

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 68071
synonyms found at PubChem are:
Pinocembrin, 480-39-7, (+)-Pinocembrin, (2S)-pinocembrin, Dihydrochrysin, UNII-8T7C8CH791, NSC 43318, NSC 279005, NSC 661207, 4H-1-Benzopyran-4-one, 2,3-dihydro-5,7-dihydroxy-2-phenyl-, (2S)-, (S)-5,7-dihydroxyflavanone, (S)-5,7-dihydroxy-2-phenylchroman-4-one, CHEMBL399910, (2s)-5,7-dihydroxy-2-phenyl-2,3-dihydro-4h-chromen-4-one, CHEBI:28157, (S)-2,3-Dihydro-5,7-dihydroxy-2-phenyl-4H-1-benzopyran-4-one, 8T7C8CH791, Pinocembrin (6CI), 4H-1-Benzopyran-4-one, 2,3-dihydro-5,7-dihydroxy-2-phenyl-, (-)-, (2S)-5,7-dihydroxy-2-phenyl-3,4-dihydro-2H-1-benzopyran-4-one, 4H-1-Benzopyran-4-one, 2,3-dihydro-5,7-dihydroxy-2-phenyl-, (S)-, 4H-1-Benzopyran-4-one,2,3-dihydro-5,7-dihydroxy-2-phenyl-, (2S)-, SMR000232372, NSC43318, NSC-43318, NSC661207, Spectrum_001879, SpecPlus_000896, AC1Q6KIW, Spectrum2_001670, Spectrum3_001635, Spectrum4_001765, Spectrum5_000349, D0G5CS, AC1L28YZ, Oprea1_508274, BSPBio_003329, KBioGR_002249, KBioSS_002406, MLS000697595, MLS000728654, DivK1c_006992, SPBio_001859, DTXSID3075412, SCHEMBL10026578, BDBM26667, CTK4J0552, KBio1_001936, KBio2_002401, KBio2_004969, KBio2_007537, KBio3_002549, KS-00000SYA, ZINC73693, MolPort-002-509-256, URFCJEUYXNAHFI-ZDUSSCGKSA-N, HMS2205J20, API01036, CCG-39668, LMPK12140214, AKOS004111068, SDCCGMLS-0066749.P001, NCGC00178137-01, AK169965, LS-39552, ST023293, ZB002643, TX-010786, (2S)-5,7-dihydroxy-2-phenylchroman-4-one, FT-0698458, (2S)-5,7-dihydroxy-2-phenyl-chroman-4-one, C09827, SR-01000762561, SR-01000762561-3, BRD-K94689771-001-02-5, Pinocembrin, analytical standard, 95% (TLC), solid, (2S)-5,7-dihydroxy-2-phenyl-2,3-dihydrochromen-4-one, 4H-1-Benzopyran-4-one, 2,3-dihydro-5,7-dihydroxy-2-phenyl-, (S)-(-)-


ID: 2261

chemical graph of compound 2261



InChIKey: URGZBBCARSDFSL-PTRNVCADSA-N
SMILES: C[C@@]12CCC3[C@@]4([C@H](C(C5(C(C4=O)CC3(C1=CC(=O)O[C@H]2C6=COC=C6)O5)O)(C)C)CC(=O)OC)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6708727
synonyms found at PubChem are:
8beta-HYDROXYCARAPIN, 3,8-HEMIACETAL, KBio2_003664, Spectrum_000616, SpecPlus_000636, Spectrum2_000639, Spectrum3_000036, Spectrum4_001318, Spectrum5_000135, BSPBio_001731, KBioGR_001755, KBioSS_001096, SPECTRUM100105, DivK1c_006732, SPBio_000638, CHEMBL3039135, SCHEMBL12998453, KBio1_001676, KBio2_001096, KBio2_006232, KBio3_000871, CCG-38552, NCGC00179052-01, SR-05000002716, SR-05000002716-1, BRD-A17120244-001-02-6, BRD-A17120244-001-03-4


ID: 2262

chemical graph of compound 2262



InChIKey: URLZCHNOLZSCCA-UHFFFAOYSA-N
SMILES: CC(C)CC(C(=O)O)NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)CNC(=O)C(CC2=CC=C(C=C2)O)N

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3903
synonyms found at PubChem are:
leucine enkephalin, Tyr-Gly-Gly-Phe-Leu, Leucine-enkephalin, YGGFL, URLZCHNOLZSCCA-UHFFFAOYSA-N, 2-[[2-[[2-[[2-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]acetyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoic acid, ENKEPHALIN, LEUCINE, CCRIS 6338, EINECS 261-457-1, NSC350588, NSC 350588, [Leu]-enkephalin, Leucine_Enkephalin, Spectrum_001429, AC1L1GYW, Spectrum2_001177, Spectrum3_001521, Spectrum4_001048, Spectrum5_000656, D06EES, D08ZCL, AC1Q1P3H, BSPBio_002902, KBioGR_001316, KBioSS_001909, N-(N-(N-(N-L-Tyrosylglycyl)glycyl)-L-phenylalanyl)-L-leucine, DivK1c_001010, SCHEMBL631958, SPBio_001193, GTPL1613, CHEBI:91634, CTK8G9358, HMS503I21, KBio1_001010, KBio2_001909, KBio2_004477, KBio2_007045, KBio3_002402, NINDS_001010, CCG-40269, NSC-350588, IDI1_001010, SMP1_000176, NCGC00178398-01, AN-39733, LS-96081, L000867, BRD-A32836748-001-01-1, 14-Amino-5-benzyl-15-(4-hydroxyphenyl)-2-isobutyl-4,10,13-tetraoxo-3,6,9,12-tetraazapentadecan-1-oic acid, 2-[[2-[[2-[[2-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]acetyl]amino]acetyl]amino]-3-phenyl-propanoyl]amino]-4-methyl-pentanoic acid


ID: 2263

chemical graph of compound 2263



InChIKey: URPBIQPJABGDJD-VTVVEXCCSA-N
SMILES: CC(C)C1=CC2=C(C=C1)[C@]3(CCC[C@@](C3CC2=O)(C)C(=O)OC)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6710737
synonyms found at PubChem are:
7-OXOCALLITRISIC ACID, METHYL ESTER, Spectrum2_001460, Spectrum3_000942, Spectrum4_001041, Spectrum5_001669, KBioGR_001302, SPECTRUM1502023, SPBio_001359, AC1O8K01, CHEMBL1568605, KBio3_002004, CCG-38870, SDCCGMLS-0066700.P001, NCGC00095659-01, methyl (1R,4aS)-1,4a-dimethyl-9-oxo-7-propan-2-yl-3,4,10,10a-tetrahydro-2H-phenanthrene-1-carboxylate, methyl (1R,4aS)-7-isopropyl-1,4a-dimethyl-9-oxo-3,4,10,10a-tetrahydro-2H-phenanthrene-1-carboxylate


ID: 2264

chemical graph of compound 2264



InChIKey: USFUFHFQWXDVMH-UHFFFAOYSA-N
SMILES: CC1=NSC(=C1)NC(=O)NC2=CC3=C(C=C2)N(C=C3)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3277600
synonyms found at PubChem are:
SB 204741, 152239-46-8, SB204741, SB-204741, 1-(1-methylindol-5-yl)-3-(3-methyl-1,2-thiazol-5-yl)urea, N-(1-methyl-5-indolyl)-N'-(3-methyl-5-isothiazolyl)urea, SB-204,741, 1-(1-methyl-1H-indol-5-yl)-3-(3-methylisothiazol-5-yl)urea, N-(1-METHYL-1H-INDOLYL-5-YL)-N''-(3-METHYL-5-ISOTHIAZOLYL)UREA, N-(1-Methyl-1H-5-indolyl)-N'-(3-methyl-5-isothiazolyl)urea, 1-(1-methyl-1H-indol-5-yl)-3-(3-methyl-1,2-thiazol-5-yl)urea, SR-01000075765, AC1MLYNA, Tocris-1372, Lopac-S-0693, D04AZE, Lopac0_000255, GTPL221, MLS000862184, CHEMBL323356, SCHEMBL3377716, BDBM84991, CTK8F0087, ZINC16912, DTXSID80390956, CHEBI:140936, MolPort-003-959-484, USFUFHFQWXDVMH-UHFFFAOYSA-N, HMS2231C03, HMS3260D12, HMS3369K08, BCP28144, Tox21_500255, MFCD00923644, PDSP1_001580, PDSP2_001564, AKOS024456556, API0007588, CCG-204350, LP00255, RTX-011453, CAS_3277600, NSC_3277600, NCGC00015923-01, NCGC00015923-02, NCGC00015923-03, NCGC00015923-04, NCGC00015923-05, NCGC00015923-06, NCGC00025129-01, NCGC00025129-02, NCGC00025129-03, NCGC00260940-01, SMR000326947, ZB000747, KB-298203, B6708, EU-0100255, FT-0643481, S 0693, SB 204741, >98% (HPLC), A809277, C-18040, L000536, J-008905, SR-01000075765-1, SR-01000075765-3, BRD-K15391446-001-11-0, 1-(1-methyl-5-indolyl)-3-(3-methyl-5-isothiazolyl)urea, N-(1-Methyl-1H-indo-5-yl)-N'-(3-methyl-5-isothiazolyl)urea, N-(1-Methyl-1H-indol-5-yl)-N'-(3-methyl-5-isothiazolyl)urea, N-(1-Methyl-1H-indolyl-5-yl)-N''-(3-methyl-5-isothiazolyl) urea, 3-(3-METHYL-1,2-THIAZOL-5-YL)-1-(1-METHYLINDOL-5-YL)UREA, N-(1-Methyl-1H-5-indolyl)-N inverted exclamation marka-(3-methyl-5-isothiazolyl)urea


ID: 2265

chemical graph of compound 2265



InChIKey: USUMXADKOISKIL-UHFFFAOYSA-N
SMILES: CCCCCCCCCCCCCCCC(=O)NCC(COP(=O)([O-])OCC[N+](C)(C)C)OCC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 361655
synonyms found at PubChem are:
112989-01-2, rac-2-Ethoxy-3-hexadecanamido-1-propylphosphocholine, CP-49, NSC624873, rac-3-Hexadecanamido-2-ethoxypropyl phosphocholine, 3,5-Dioxa-9-aza-4-phosphapentacosan-1-aminium, 7-ethoxy-4-hydroxy-N,N,N-trimethyl-10-oxo-, inner salt, 4-oxide, (1)-, 3,5-Dioxa-9-aza-4-phosphapentacosan-1-aminium,7-ethoxy-4-hydroxy-N,N,N-trimethyl-10-oxo-, inner salt, 4-oxide, NSC 624873, ACMC-20cfp6, AC1Q5OOG, AC1Q5OOH, AC1L7J30, CHEMBL285629, SCHEMBL7631750, CTK4A8067, 2-ethoxy-3-(palmitoylamino)propyl 2-(trimethylammonio)ethyl phosphate, CCG-204641, NSC-624873, NCGC00015413-02, NCGC00015413-03, NCGC00015413-04, NCGC00093938-01, NCGC00162184-01, EU-0100551, E 3645, 2-ethoxy-3-(hexadecanoylamino)propyl 2-(trimethylammonio)ethyl phosphate, [2-ethoxy-3-(hexadecanoylamino)propyl] 2-(trimethylazaniumyl)ethyl phosphate, 2-[[2-ethoxy-3-(hexadecanoylamino)propoxy]-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium, 209532-03-6


ID: 2266

chemical graph of compound 2266



InChIKey: USUWCDUGDZBZMJ-UHFFFAOYSA-N
SMILES: C1=CC=C(C=C1)C2=NN(C(=O)C2C=O)C3=CC=CC=C3

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"MH Nantz" "LJ Galietta" "K By" "EJ Niedzinski" "M Eda" "MF Springsteel" "MJ Haddadin" "MJ Kurth" "AS Verkman"


CID is 205105
synonyms found at PubChem are:
1,3-Diphenyl-4-formyl-2-pyrazolin-5-one, 17364-40-8, 2-Pyrazolin-5-one, 1,3-diphenyl-4-formyl-, 5-oxo-1,3-diphenyl-4H-pyrazole-4-carbaldehyde, AC1L4DYX, SCHEMBL17290527, LS-128870, 1,3-Diphenyl-5-oxo-2-pyrazoline-4-carbaldehyde, 5-oxo-1,3-diphenyl-4,5-dihydro-1H-pyrazole-4-carbaldehyde


ID: 2267

chemical graph of compound 2267



InChIKey: UTSVPXMQSFGQTM-DCXZOGHSSA-N
SMILES: COC1=C2C(=C3[C@@H]4C=CO[C@@H]4OC3=C1)OC5=C(C2=O)C(=CC=C5)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5280389
synonyms found at PubChem are:
STERIGMATOCYSTIN, Sterigmatocystine, 10048-13-2, NSC 201423, NSC 204985, CCRIS 561, UNII-5F95211S5Z, HSDB 3540, EINECS 233-158-6, CHEBI:18227, NSC204985, 7H-Furo(3',2':4,5)furo(2,3-c)xanthen-7-one, 3a,12c-dihydro-8-hydroxy-6-methoxy-, (3aR-cis)-, 5F95211S5Z, 3a,12c-Dihydro-8-hydroxy-6-methoxy-7H-furo(3',2':4,5)furo(2,3-c)xanthen-7-one, (3AR-cis)3a,12c-dihydro-8-hydroxy-6-methoxy-7H-furo(3',2':4,5)furo(2,3-c)xanthen-7-one, 3a,12c-Dihydro-8-hydroxy-6-methoxy-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one, 7H-Furo(3',2':4,5)furo(2,3-c)xanthen-7-one, 3a,12c-dihydro-8-hydroxy-6-methoxy-, 8-Hydroxy-6-methoxy-3a,12c-dihydro-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one, 3a,2':4,5]furo[2,3-c]xanthen-7-one, WLN: T E6 C6 B655 DO KV PO RO SU&&&TTJ IQ MO1, Sterigmacocystin, 7H-Furo[3',5]furo[2,3-c]xanthen-7-one, 3a,12c-dihydro-8-hydroxy-6-methoxy-, 7H-Furo[3',5]furo[2,3-c]xanthen-7-one, 3a,12c-dihydro-8-hydroxy-6-methoxy-, (3aR-cis)-, NCIMech_000632, MLS004257378, SCHEMBL620489, CHEMBL524291, 8-hydroxy-6-(methyloxy)-3a,12c-dihydro-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one, MolPort-004-963-475, 7H-Furo(3',2':4,5)furo(2,3-c)xanthen-7-one, 3a,12c-dihydro-8-hydroxy-6-methoxy-, (3aR,12cS)-, ZINC5732865, CCG-35887, LMPK10000001, NSC201423, LS-7165, NSC-201423, NSC-204985, AN-17305, NCI60_001723, SMR003082510, ST50826206, C00961, J-000143, (12cS,3aR)-8-hydroxy-6-methoxy-12c,3a-dihydroxantheno[4',3'-5,4]furano[2,3-b]f uran-7-one, (3aR,12cS)-3a,12c-Dihydro-8-hydroxy-6-methoxy-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one, (3aR,12cS)-8-hydroxy-6-methoxy-3a,12c-dihydro-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one, (3aR-cis)-3a,12c-Dihydro-8-hydroxy-6-methoxy-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one, 105521-97-9


ID: 2268

chemical graph of compound 2268



InChIKey: UUKWKUSGGZNXGA-UHFFFAOYSA-N
SMILES: C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(=O)N

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 4511
synonyms found at PubChem are:
3,5-Dinitrobenzamide, nitromide, 121-81-3, Tristat, Unistat, Benzamide, 3,5-dinitro-, component of Unistat-3, Nitromide [USAN], component of Tristat, Nitroamide, UNII-9DUJ3CMK8S, C7H5N3O5, EINECS 204-499-8, NSC 60719, 9DUJ3CMK8S, BRN 1981935, UUKWKUSGGZNXGA-UHFFFAOYSA-N, NSC60719, Nitromide (USAN), NCGC00094736-01, DSSTox_CID_25836, DSSTox_RID_81163, DSSTox_GSID_45836, unistat-3, CAS-121-81-3, SR-05000002028, Nitromid, Spectrum_001065, ACMC-20anc0, AC1L1IBY, AC1Q5AHS, Spectrum2_001044, Spectrum3_000519, Spectrum4_000077, Spectrum5_001200, BSPBio_002077, KBioGR_000633, KBioSS_001545, 4-09-00-01351 (Beilstein Handbook Reference), MLS002207159, 3,5-Dinitrobenzamide, 97%, DivK1c_000813, SCHEMBL193674, SPECTRUM1500435, SPBio_000968, 3,5-DINITRO BENZAMIDE, CHEMBL1437065, DTXSID0045836, CTK0H4630, HMS502I15, KBio1_000813, KBio2_001545, KBio2_004113, KBio2_006681, KBio3_001577, UUKWKUSGGZNXGA-UHFFFAOYSA-, MolPort-002-461-990, NINDS_000813, HMS1920B06, HMS2091J06, Pharmakon1600-01500435, ACT07882, HY-B0945, ZINC1690424, Tox21_111321, 5264AH, CCG-39929, NSC-60719, NSC757245, SBB057213, AKOS001434379, Tox21_111321_1, MCULE-9213012419, NSC-757245, TRA0037962, VZ25861, IDI1_000813, UPCMLD0ENAT5895628:001, NCGC00094736-02, NCGC00094736-03, NCGC00094736-05, AN-43407, CC-13688, CJ-28117, LS-26754, NCI60_004694, SC-47147, SMR001306736, SBI-0051459.P003, AB0004874, DB-022109, KB-118561, TC-169911, FT-0614715, ST50308244, EN300-26564, Nitromide, VETRANAL(TM), analytical standard, A-8855, D05191, AB00052054_04, A804791, C-10956, I01-3079, J-004683, SR-05000002028-1, SR-05000002028-3, BRD-K76381435-001-02-9, BRD-K76381435-001-04-5, I14-10501, InChI=1/C7H5N3O5/c8-7(11)4-1-5(9(12)13)3-6(2-4)10(14)15/h1-3H,(H2,8,11)


ID: 2269

chemical graph of compound 2269



InChIKey: UUSHFEVEROROSP-UHFFFAOYSA-N
SMILES: CCCC1=C(C(=NC(=C1C(=O)SCC)CC)C2=CC=CC=C2)C(=O)OCCC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3661570
synonyms found at PubChem are:
MRS 1523, 212329-37-8, MRS1523, MRS-1523, CHEMBL111545, propyl 6-ethyl-5-ethylsulfanylcarbonyl-2-phenyl-4-propylpyridine-3-carboxylate, 3-propyl-6-ethyl-5-[(ethylthio)carbonyl]-2 phenyl-4-propyl-3-pyridine carboxylate, AC1MU7EM, Lopac-M-1809, D0ZL2A, Lopac0_000783, GTPL474, MLS002153514, SCHEMBL6371417, CTK8E7929, MolPort-003-958-657, UUSHFEVEROROSP-UHFFFAOYSA-N, HMS2234J15, HMS3262M08, HMS3373I03, ZINC2004584, Tox21_500783, BDBM50074225, MFCD03787977, 2,3-diethyl-4,5-dipropyl-6-phenylpyridine-3-thiocarboxylate-5-carboxylate, CCG-204868, LP00783, NCGC00015652-01, NCGC00015652-02, NCGC00015652-03, NCGC00015652-04, NCGC00094120-01, NCGC00094120-02, NCGC00261468-01, SMR001230846, MRS 1523, >98% (HPLC), RT-013954, EU-0100783, M 1809, L000991, SR-01000075580, J-013937, SR-01000075580-1, 3-propyl-6-ethyl-5-[(ethylthio)carbonyl]-2-phenyl-4-propyl-3-pyridine carboxylate, 6-Ethyl-5-ethylsulfanylcarbonyl-2-phenyl-4-propyl-nicotinic acid propyl ester, 3-Pyridinecarboxylic acid, 6-ethyl-5-((ethylthio)carbonyl)-2-phenyl-4-propyl-, propyl ester


ID: 2270

chemical graph of compound 2270



InChIKey: UUVWYPNAQBNQJQ-UHFFFAOYSA-N
SMILES: CN(C)C1=NC(=NC(=N1)N(C)C)N(C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 2123
synonyms found at PubChem are:
altretamine, HEXAMETHYLMELAMINE, 645-05-6, Hexalen, Hexastat, Hemel, Altretamina, Altretaminum, Melamine, hexamethyl-, 2,4,6-Tris(dimethylamino)-1,3,5-triazine, Altretaminum [INN-Latin], ENT 50852, NC 195, NCI-C50259, 2,4,6-Tris(dimethylamino)-s-triazine, Altretamina [INN-Spanish], N2,N2,N4,N4,N6,N6-hexamethyl-1,3,5-triazine-2,4,6-triamine, HMM, Altretamine (Hexalen), NSC 13875, HTM, HXM, s-Triazine, 2,4,6-tris(dimethylamino)-, UNII-Q8BIH59O7H, 1,3,5-Triazine-2,4,6-triamine, N,N,N',N',N'',N''-hexamethyl-, Hexalen (TN), Altretamine [USAN:INN:BAN], CCRIS 5492, MLS000069621, N,N,N',N',N'',N''-hexamethyl-1,3,5-triazine-2,4,6-triamine, C9H18N6, Altretamine (USP/INN), EINECS 211-428-4, BRN 0195058, Q8BIH59O7H, SMR000058181, AI3-50852, CHEBI:24564, UUVWYPNAQBNQJQ-UHFFFAOYSA-N, 2-N,2-N,4-N,4-N,6-N,6-N-hexamethyl-1,3,5-triazine-2,4,6-triamine, NSC13875, KB-913, NSC-13875, NCGC00015100-02, DSSTox_CID_2579, 2,4, 6-Tris(dimethylamino)-1,3,5-triazine, A 8723, DSSTox_RID_76641, DSSTox_GSID_22579, Hexinawas, 1,3,5-Triazine-2,4,6-triamine, N,N,N',N',N',N'-hexamethyl-, N~2~,N~2~,N~4~,N~4~,N~6~,N~6~-Hexamethyl-1,3,5-triazine-2,4,6-triamine, CAS-645-05-6, SR-01000000117, Hexalen [Antineoplastic], hexylen, Altretamin, Altretamine/, No-s-triazine, HSDB 7559, Altretamine, solid, Altretamine [USAN:USP:INN:BAN], Hexalen, Altretamine, Spectrum_001308, Altretamine Bellon Brand, Altretamine Chiesi Brand, AC1L1CYX, Opera_ID_1095, Prestwick0_000946, Prestwick1_000946, Prestwick2_000946, Prestwick3_000946, Spectrum2_000907, Spectrum3_000951, Spectrum4_001064, Spectrum5_001092, Lopac-A-8723, 2,4,6-Tris(dimethylami, ChemDiv2_005185, D02LPF, Bellon Brand of Altretamine, Cambridge id 5148727, Chiesi Brand of Altretamine, cid_2123, SCHEMBL4206, Altretamine Wassermann Brand, CHEMBL1455, Lopac0_000083, BSPBio_000912, KBioGR_001388, KBioSS_001788, ZINC905, MLS001076123, DivK1c_000772, SPECTRUM1503065, SPBio_000754, SPBio_003071, BPBio1_001004, GTPL7112, Wassermann Brand of Altretamine, DTXSID4022579, BDBM37631, CTK8F7682, HMS502G14, KBio1_000772, KBio2_001788, KBio2_004356, KBio2_006924, KBio3_002042, MGI Pharma Brand of Altretamine, MolPort-002-111-210, NINDS_000772, BCPP000413, HMS1383L15, HMS1570N14, HMS1922C05, HMS2090G17, HMS2092H16, HMS2097N14, HMS2234F09, HMS3259I20, HMS3260A08, HMS3372H17, HMS3654H11, HMS3714N14, Pharmakon1600-01503065, BCP27675, CCG-2238, HY-B0181, KS-00001F6N, 2,6-Tris(dimethylamino)-s-triazine, Tox21_110085, Tox21_202784, Tox21_500083, ABP000596, ENT-50852, NSC758231, s1278, STK749184, 2,4,6-Tris(dimethylamino-s-triazine, s-Triazine,4,6-tris(dimethylamino)-, AKOS001729401, Tox21_110085_1, BCP9000278, CS-2061, DB00488, KS-5247, LP00083, LS-1549, MCULE-1605383293, NC00595, NSC-758231, RP18094, VA10242, IDI1_000772, IDI1_003900, NCGC00015100-01, NCGC00015100-03, NCGC00015100-04, NCGC00015100-05, NCGC00015100-06, NCGC00015100-07, NCGC00015100-08, NCGC00015100-09, NCGC00015100-10, NCGC00015100-11, NCGC00015100-12, NCGC00015100-14, NCGC00015100-15, NCGC00021216-03, NCGC00021216-04, NCGC00021216-05, NCGC00021216-06, NCGC00021216-07, NCGC00260330-01, NCGC00260768-01, Rhone Poulenc Rorer Brand of Altretamine, Rhone-Poulenc Rorer Brand of Altretamine, AC-12006, AN-47064, BC203873, CAS-654-05-6, CPD000058181, NCI60_000871, SAM002564241, SC-26614, ST086739, ZB000200, 2,6-Tris(dimethylamino)-1,3,5-triazine, SBI-0050071.P003, AB0007992, AB2000024, AB00052308, EU-0100083, FT-0083576, FT-0651499, D02841, M-2093, 49712-EP2295426A1, 49712-EP2295427A1, 49712-EP2308833A2, 49712-EP2311825A1, AB00052308-16, AB00052308-17, AB00052308-18, AB00052308_19, AB00052308_20, 645A056, A834788, WLN: T6N CN ENJ BN1&1 DN1&1 FN1&1, 2,4,6-Tris(dimethylamino)-1,3,5-triazine, 96%, I06-0604, J-523408, SR-01000000117-2, SR-01000000117-4, SR-01000000117-6, BRD-K67043667-001-04-1, BRD-K67043667-001-15-7, Z57931197, 645-05-6,2975-00-0(HCl), A0567/0026158, Altretamine [2,4,6-Tris(dimethylamino)-1,3,5-triazine], [4,6-bis(dimethylamino)(1,3,5-triazin-2-yl)]dimethylamine, N2,N2,N4,N4,N6,N6-Hexamethyl-1,3,5-trazne-2,4,6-tramne, 1,5-Triazine-2,4,6-triamine, N,N,N',N',N'',N''-hexamethyl-, Altretamine, United States Pharmacopeia (USP) Reference Standard, N-[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]-N,N-dimethylamine, 1,3,5-Triazine-2,4,6-triamine, N,N,N',N',N'', N''-hexamethyl-, InChI=1/C9H18N6/c1-13(2)7-10-8(14(3)4)12-9(11-7)15(5)6/h1-6H


ID: 2271

chemical graph of compound 2271



InChIKey: UVJQIYZYQQKIAC-UHFFFAOYSA-N
SMILES: CCSC(=NC1=CC=C(C=C1)C(F)(F)F)N.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 2733516
synonyms found at PubChem are:
TFPI hydrochloride, 163490-78-6, ETPI HCl, s-ethyl-n-[4-(trifluoromethyl)phenyl]isothiourea hydrochloride, S-Ethyl N-[4-Triflurormethyl)phenyl]isothio Urea, Hydrochloride, CHEMBL542855, SR-01000076170, EU-0101170, D01RGM, AC1MBZ30, C10H11F3N2S.HCl, SCHEMBL4425282, MolPort-027-641-133, 1762AH, NCGC00094428-01, NCGC00094428-02, NCGC00094428-03, NCGC00094428-04, FT-0668409, T 7188, J-010049, SR-01000076170-1, SR-01000076170-4, ethyl 4-(trifluoromethyl)phenylcarbamimidothioate hydrochloride, S-Ethyl N-[4-(trifluoromethyl)phenyl]isothiourea hydrochloride, ethyl N'-[4-(trifluoromethyl)phenyl]carbamimidothioate hydrochloride, Carbamimidothioic acid,N-[4-(trifluoromethyl)phenyl]-,ethyl ester,hydrochloride(1:1), CARBAMIMIDOTHIOIC ACID,N-[4-(TRIFLUOROMETHYL)PHENYL]-, ETHYL ESTER, HYDROCHLORIDE (1:1), S-Ethyl N-[4-Triflurormethyl)phenyl]isothiourea, Hydrochloride, CTK8E8196, RT-015608, ST50826096, (ethylthioiminomethyl)[4-(trifluoromethyl)phenyl]amine, chloride


ID: 2272

chemical graph of compound 2272



InChIKey: UVKZSORBKUEBAZ-UHFFFAOYSA-N
SMILES: CN1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6726
synonyms found at PubChem are:
CYCLIZINE, Marezine, Ciclizina, Nautazine, Neo-devomit, Valoid, 1-Benzhydryl-4-methylpiperazine, Cyclizinum, 1-(Diphenylmethyl)-4-methylpiperazine, N-Benzhydryl-N'-methylpiperazine, N-Methyl-N'-benzhydrylpiperazine, Cyclizinum [INN-Latin], Ciclizina [INN-Spanish], 82-92-8, Compound 47-83, Emoquil, Wellcome, Ne-devomit, Wellcome preparation 47-83, Cyclizine chloride, Piperazine, 1-(diphenylmethyl)-4-methyl-, (N-Benzhydryl)(N'-methyl)diethylenediamine, 1-Benzhydryl-4-methylpiperazin, Wellcome prepn 47-83, Marzine, BW 47-83, Reis-fit, UNII-QRW9FCR9P2, Wellcome prepn. 47-83, Marezine hydrochloride, Cyclizine (INN), Cyclizine [INN:BAN:DCF], NSC 26608, (+-)-1-diphenylmethyl-4-methylpiperazine, HSDB 3309, N-Methyl-N'-benzyhydrylpiperazine, 1-Diphenylmethyl-4-methylpiperazine, EINECS 201-445-5, QRW9FCR9P2, BRN 0230441, CHEBI:3994, UVKZSORBKUEBAZ-UHFFFAOYSA-N, Marezine (TN), Piperazine, 1-(diphenylmethyl)-4-methyl-, monohydrochloride, NCGC00016421-01, CAS-303-25-3, SR-05000001595, Cyclizine [USP:INN:BAN:DCF], Emoquil (TN), Marzine (TN), Valoid (TN), Emoquil (Salt/Mix), Marzine (Salt/Mix), Spectrum_000854, SpecPlus_000917, AC1Q3ZTI, Prestwick0_000510, Prestwick1_000510, Prestwick2_000510, Prestwick3_000510, Spectrum2_001174, Spectrum3_000368, Spectrum4_000205, Spectrum5_001594, CHEMBL648, D08HRJ, SCHEMBL4690, Marezine, Valoid, Nausicalm, Oprea1_429421, BSPBio_000439, BSPBio_002095, KBioGR_000809, KBioSS_001334, 5-23-01-00232 (Beilstein Handbook Reference), DivK1c_007013, SPECTRUM1500211, SPBio_001187, SPBio_002360, AC1L1N61, BPBio1_000483, GTPL7151, DTXSID4022864, CTK8E3202, KBio1_001957, KBio2_001334, KBio2_003902, KBio2_006470, KBio3_001315, N-Benzhydryl-N-methyl piperazine, HMS1920A20, HMS2091I08, Pharmakon1600-01500211, 1-Benzhydryl-4-methylpiperazine #, NSC26608, WLN: T6N DNTJ AYR&R& D1, CCG-40322, NSC-26608, NSC756710, ZINC19156872, AKOS015839079, API0002140, DB01176, MCULE-5937988027, NSC-756710, (-)-1-Diphenylmethyl-4-methylpiperazine, NCGC00016421-02, NCGC00016421-03, NCGC00016421-04, NCGC00016421-09, NCGC00094634-01, NCGC00094634-02, KB-11173, SBI-0052576.P003, (+/-)-1-diphenylmethyl-4-methylpiperazine, LS-111945, TR-013041, A5580, AB00053084, C06930, D03621, AB00053084_08, L000701, I02-2669, SR-05000001595-1, BRD-K79501723-001-02-0, BRD-K79501723-003-03-4, BRD-K79501723-003-09-1


ID: 2273

chemical graph of compound 2273



InChIKey: UVTNFZQICZKOEM-UHFFFAOYSA-N
SMILES: CC(C)N(CCC(C1=CC=CC=C1)(C2=CC=CC=N2)C(=O)N)C(C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3114
synonyms found at PubChem are:
disopyramide, 3737-09-5, Dicorantil, Rythmodan, Disopiramida, Ritmodan, Disopyramidum, Searle 703, Isorythm, Lispine, Disopyramidum [INN-Latin], Disopiramida [INN-Spanish], Disopyramide Free Base, xi-Disopyramide, Rythmodan-La, Rythmodan P, SC 7031, SC-7031, Rythmodan P (TN), gamma-Diisopropylamino-alpha-phenyl-alpha-(2-pyridyl)butyramide, H 3292, CHEMBL517, alpha-(2-(Diisopropylamino)ethyl)-alpha-phenyl-2-pyridineacetamide, CHEBI:4657, alpha-Diisopropylaminoethyl-alpha-phenylpyridine-2-acetamide, UVTNFZQICZKOEM-UHFFFAOYSA-N, Disopyramide Monohydrochloride, Disopyramide [USAN:BAN:INN:JAN], EINECS 223-110-2, 4-(diisopropylamino)-2-phenyl-2-pyridin-2-ylbutanamide, NCGC00015358-18, 4-[di(propan-2-yl)amino]-2-phenyl-2-pyridin-2-ylbutanamide, Norpace (TN), 2-Pyridineacetamide, alpha-(2-(bis(1-methylethyl)amino)ethyl)-alpha-phenyl-, D 7644, DSSTox_CID_25536, DSSTox_RID_80938, DSSTox_GSID_45536, 4-(diisopropylamino)-2-phenyl-2-(pyridin-2-yl)butanamide, 4-[bis(propan-2-yl)amino]-2-phenyl-2-(pyridin-2-yl)butanamide, 2-Pyridineacetamide, alpha-(2-(diisopropylamino)ethyl)-alpha-phenyl-, alpha-[2-[Bis(1-methylethyl)amino]ethyl]-alpha-phenyl-2-pyridine acetamide, 2-Pyridineacetamide, .alpha.-[2-[bis(1-methylethyl)amino]ethyl]-.alpha.-phenyl-, CAS-3737-09-5, 54687-36-4, SR-01000003039, Rythmodan (TN), NCGC00016985-01, Prestwick_681, disopyramide tartrate, Lispine|||Ritmilen, Norpace (Salt/Mix), Spectrum_001008, Prestwick0_000266, Prestwick1_000266, Prestwick2_000266, Prestwick3_000266, Spectrum2_001033, Spectrum3_000404, Spectrum4_000524, Spectrum5_000943, D0M4YC, Lopac0_000402, Lopac0_000411, SCHEMBL16153, BSPBio_000112, BSPBio_001928, KBioGR_001127, KBioSS_001488, MLS002222242, DivK1c_000489, SPBio_001245, SPBio_002331, AC1L1F78, BPBio1_000124, GTPL7167, SC 13957 (Salt/Mix), DTXSID1045536, CTK1H1096, KBio1_000489, KBio2_001488, KBio2_004056, KBio2_006624, KBio3_001148, Disopyramide (JP15/USAN/INN), Disopyramide (JP17/USAN/INN), MolPort-003-846-985, NINDS_000489, HMS1568F14, HMS2095F14, HMS2234G08, HMS3261A06, HMS3369O21, HMS3712F14, Disopyramide [USAN:INN:BAN:JAN], Disopyramide 1.0 mg/ml in Methanol, Tox21_110727, Tox21_500402, BDBM50028893, MFCD00057366, 54687-36-4 (mono-hydrochloride), AKOS015894712, Tox21_110727_1, CCG-204495, DB00280, LP00402, MCULE-8866988334, IDI1_000489, NCGC00015358-04, NCGC00015358-05, NCGC00015358-06, NCGC00015358-08, NCGC00015358-09, NCGC00015358-10, NCGC00015358-11, NCGC00015358-12, NCGC00015358-13, NCGC00015358-14, NCGC00015358-15, NCGC00015358-19, NCGC00093829-01, NCGC00093829-02, NCGC00093829-03, NCGC00261087-01, AC-16018, SMR001307254, 22059-60-5 (phosphate (1:1)), SBI-0050388.P005, LS-185086, AB00053462, D2793, EU-0100402, FT-0667714, ST50411970, Y5028, C06965, D00303, 20509-EP2272972A1, 20509-EP2272973A1, 20509-EP2277872A1, 20509-EP2314585A1, AB00053462_16, AB00053462_17, C-44340, I05-3196, SR-01000003039-3, 4-Diisopropylamino-2-phenyl-2-(2-pyridyl)-butyramide, BRD-A29734509-001-03-8, BRD-A29734509-011-02-9, BRD-A29734509-011-06-0, SR-01000003039-10, 4-(Diisopropylamino)-2-phenyl-2-(2-pyridinyl)butanamide, 4-(Diisopropylamino)-2-phenyl-2-(2-pyridyl)butyramide, Z2786051711, 4-(Diisopropylamino)-2-phenyl-2-(2-pyridinyl)butanamide #, 4-[bis(methylethyl)amino]-2-phenyl-2-(2-pyridyl)butanamide, Disopyramide, European Pharmacopoeia (EP) Reference Standard, .alpha.-(2-(Diisopropylamino)ethyl)-.alpha.-phenyl-2-pyridineacetamide, .gamma.-Diisopropylamino-.alpha.-phenyl-.alpha.-(2-pyridyl)butyramide, 2-Pyridineacetamide, .alpha.-[2-(diisopropylamino)ethyl]-.alpha.-phenyl-, 4-[bis(propan-2-yl)amino]-2-phenyl-2-(pyridin-2-yl)butanimidic acid, racemic 2-phenyl-2-(2-pyridyl)-4-[N,N-bis(1-methylethyl)amino]butanamide, alpha-[2-[Bis(1-methylethyl)amino]ethyl]- alpha-phenyl-2-pyridine acetamide


ID: 2274

chemical graph of compound 2274



InChIKey: UWCVGPLTGZWHGS-ZORIOUSZSA-N
SMILES: CCCN1C[C@@H](C[C@H]2[C@H]1CC3=CNC4=CC=CC2=C34)CSC.CS(=O)(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 47812
synonyms found at PubChem are:
PERGOLIDE MESYLATE, 66104-23-2, PERGOLIDE MESYLATE SALT, Pergolide Methanesulfonate, Pergolide (mesylate), Pergolide mesilate, UNII-55B9HQY616, LY127809, Pergolide methanesulfonate salt, MLS000069837, CHEBI:8021, 55B9HQY616, CPD000058504, SMR000058504, 8-beta-((Methylthio)methyl)-6-propylergoline methanesulfonate, 8beta-((Methylthio)methyl)-6-propylergoline monomethanesulfonate, 8-beta-((Methylthio)methyl)-6-propylergoline monomethane sulfonate, DSSTox_CID_20583, DSSTox_RID_77029, DSSTox_GSID_40583, CHEMBL1275, Ergoline, 8-((methylthio)methyl)-6-propyl-, monomethanesulfonate, (8beta)-, Ergoline, 8-beta-((methylthio)methyl)-6-propyl-, methanesulfonate (1:1), SR-01000075395, NCGC00017366-04, LY 127809, Pergolide mesylate [USAN], Celance, Parkotil, Pharken, Nopar, (8b)-8-[(methylsulfanyl)methyl]-6-propylergoline methanesulfonate, SR-01000721840, Pergolide mesylate [USAN:USP], C19H26N2S.CH4O3S, (6aR,9R,10aR)-9-(methylsulfanylmethyl)-7-propyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline;methanesulfonic acid, Prestwick_652, CAS-66104-23-2, pergolide monomesylate, Opera_ID_186, Pergolide mehanesulfonate, Pergolide mesilate (JAN), Pergolide mesylate (USP), AC1L2IT6, pergolide monomethanesulfonate, SCHEMBL26920, MLS001148155, MLS001424320, MLS002222236, SPECTRUM1503269, 8beta-[(Methylthio)methyl]-6-propylergoline methanesulfonate salt, DTXSID6040583, CTK8G2324, HMS501G04, MolPort-003-666-477, Ergoline, methanesulfonate (1:1), HMS1568L12, HMS1922O13, HMS2052H09, HMS2093C05, HMS2095L12, HMS2231F08, HMS3263E09, HMS3712L12, Pharmakon1600-01503269, 66104-22-1 (Parent), EX-A1334, LY-141-B, Tox21_110820, Tox21_500984, CCG-39478, HY-13720A, MFCD00153859, NSC319773, NSC758442, s4000, AKOS015896681, Tox21_110820_1, AC-6874, AN-1514, CS-2629, LP00984, NC00428, NSC-319773, NSC-758442, NCGC00017366-08, NCGC00094284-01, NCGC00094284-02, NCGC00094284-03, NCGC00261669-01, Pergolide mesylate salt, >=98%, solid, LS-64480, Ergoline, (8.beta.)-, monomethanesulfonate, EU-0100984, D00502, P 8828, 104P232, I06-2189, Q-201548, SR-01000075395-1, SR-01000075395-3, SR-01000721840-3, 8-[(Methylthio)methyl]-6-propylergoline methanesulfonate, 8|A-[(Methylthio)methyl]-6-propylergoline methanesulfonate salt, (8beta)-8-[(methylsulfanyl)methyl]-6-propylergoline methanesulfonate, 8-.beta.-[(Methylthio)methyl]-6-propylergoline methanesulfonate, Pergolide mesilate, European Pharmacopoeia (EP) Reference Standard, (8beta)-8-[(methylsulfanyl)methyl]-6-propylergolin-6-ium methanesulfonate, Pergolide mesylate, United States Pharmacopeia (USP) Reference Standard, (6aR,9R,10aR)-9-((methylthio)methyl)-7-propyl-4,6,6a,7,8,9,10,10a-octahydroindolo[4,3-fg]quinoline methanesulfonate, (6aR,9R,10aR)-9-(methylthiomethyl)-7-propyl-4,6,6a,7,8,9,10,10a-octahydroindolo[4,3-fg]quinoline methanesulfonate


ID: 2275

chemical graph of compound 2275



InChIKey: UWFYSQMTEOIJJG-FDTZYFLXSA-N
SMILES: CC(=O)[C@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C=C(C4=CC(=O)[C@@H]5C[C@@H]5[C@]34C)Cl)C)OC(=O)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 9880
synonyms found at PubChem are:
CYPROTERONE ACETATE, 427-51-0, Androcur, Cyproterone 17-O-acetate, Cyproteron acetate, Cyproteron-R acetate, Cyprosterone acetate, SH 714, UNII-4KM2BN5JHF, SH 80714, Cyproteroneacetate, Cyproterone 17alpha-acetate, NSC-81430, SH-714, CCRIS 4385, Cyproterone acetate [USAN:JAN], HSDB 3592, EINECS 207-048-3, NSC 81430, 4KM2BN5JHF, C24H29ClO4, Cyproterone 17.alpha.-acetate, MLS000859908, CHEMBL139835, 3'H-Cyclopropa(1,2)pregna-1,4,6-triene-3,20-dione, 17-(acetyloxy)-6-chloro-1,2-dihydro-, (1beta,2beta)-, CHEBI:50743, UWFYSQMTEOIJJG-FDTZYFLXSA-N, NSC81430, 6-Chloro-1beta,2beta-dihydro-17-hydroxy-3'H-cyclopropa(1,2)-pregna-1,4,6-triene-3,20-dione acetate, NCGC00091032-03, DSSTox_CID_366, 6-Chloro-delta-6-1,2alpha-methylene-17alpha-hydroxyprogesterone acetate, 1,2-alpha-Methylene-6-chloro-delta(sup 6)-17-alpha-hydroxyprogesterone acetate, 1,2-alpha-Methylene-6-chloro-pregna-4,6-diene-3,20-dione 17-alpha-acetate, 6-Chloro-1,2-alpha-methylene-6-dehydro-17-alpha-hydroxyprogesterone acetate, 6-Chloro-delta(sup 6)-1,2-alpha-methylene-17-alpha-hydroxyprogesterone acetate, 1,2-alpha-Methylene-6-chloro-(sup 4,6)-pregnadiene-17-alpha-ol-3,20-dione 17-alpha-acetate, 17-alpha-Acetoxy-6-chloro-1-alpha,2-alpha-methylenepregna-4,6-diene-3,20-dione, 6-Chlor-delta(sup 6)-1,2-alpha-methylen-17-alpha-hydroxyprogesteronacetat [German], 6-Chloro-1,2-alpha-methylene-17-alpha-hydroxy-delta(sup 6)-progesterone acetate, 6-Chloro-17-hydroxy-1-alpha,2-alpha-methylenepregna-4,6-diene-3,20-dione acetate, DSSTox_RID_75542, Pregna-4,6-diene-3,20-dione, 6-chloro-17-hydroxy-1-alpha,2-alpha-methylene-, acetate, DSSTox_GSID_20366, (1R,3aS,3bR,7aR,8aS,8bS,8cS,10aS)-1-acetyl-5-chloro-8b,10a-dimethyl-7-oxo-1,2,3,3a,3b,7,7a,8,8a,8b,8c,9,10,10a-tetradecahydrocyclopenta[a]cyclopropa[g]phenanthren-1-yl acetate, 6-chloro-3,20-dioxo-1beta,2beta-dihydro-3'H-cyclopropa[1,2]pregna-4,6-dien-17-yl acetate, (1S,2S,3S,12S,16S,5R,11R,15R)-15-acetyl-9-chloro-2,16-dimethyl-6-oxopentacyclo [9.7.0.0<2,8>.0<3,5>.0<12,16>]octadeca-7,9-dien-15-yl acetate, 3'H-Cyclopropa(1,2)pregna-1,4,6-triene-3,20-dione, 6-chloro-1-beta,2-beta-dihydro-17-hydroxy-, acetate, 6-Chloro-1-beta,2-beta-dihydro-17-hydroxy-3'H-cyclopropa(1,2)pregna-1,4,6-triene-3,20-dione 17-acetate, SMR000326769, SR-01000075755, cyproviron, Cyprostat&reg, (1?,2?)-17-(Acetyloxy)-6-chloro-1,2-dihydro-3'H-cyclopropa[1,2]pregna-1,4,6-triene-3,20-dione, CAS-427-51-0, 2oz7, cid_9880, SCHEMBL5936, BIDD:PXR0052, Lopac0_000301, MLS001055462, MLS001066353, MLS002207305, MLS006011110, Cyproterone acetate, >=98%, Cyproterone Acetate Impurity F, (non-d)Cyproterone acetate-d5, AC1L1U14, GTPL2865, DTXSID5020366, MolPort-003-940-714, HMS2090A14, HMS2233J06, HMS3260N04, (2aR,3aS,3bS,3cS,5aS,6R,8aS,8bR)-6-acetyl-10-chloro-3b,5a-dimethyl-2-oxo-2,2a,3,3a,3b,3c,4,5,5a,6,7,8,8a,8b-tetradecahydrocyclopenta[a]cyclopropa[g]phenanthren-6-yl acetate, ZINC3814423, Tox21_111064, Tox21_201686, Tox21_302941, Tox21_500301, AC-929, BDBM50094569, DL-368, s2042, 6-Chlor-delta(sup 6)-1,2-alpha-methylen-17-alpha-hydroxyprogesteronacetat, AKOS008901350, AKOS015895238, Tox21_111064_1, AN-5495, CCG-204396, DB04839, LP00301, NCGC00091032-01, NCGC00091032-04, NCGC00091032-05, NCGC00091032-09, NCGC00256442-01, NCGC00259235-01, NCGC00260986-01, NCGC00262575-02, Progesterone,2.alpha.-methylene, acetate, 3'H-Cyclopropa[1,2]pregna-1,4,6-triene-3,20-dione, 17-(acetyloxy)-6-chloro-1,2-dihydro-, (1.beta.,2.beta.)-, BC201848, CC-26170, LS-58799, SC-16128, SMR000686068, ST075180, Progesterone,2.alpha.-methylene-, acetate, (acetyl-chloro-dimethyl-oxo-[?]yl) acetate, AB2000446, 1,6-diene-3,20-dione 17.alpha.-acetate, EU-0100301, C 3412, D01368, 49714-EP2280012A2, 49714-EP2295426A1, 49714-EP2295427A1, 49714-EP2298768A1, 49714-EP2311825A1, AB00698312-08, 1,6)-pregnadeine-17.alpha.-3,20-dione acetate, 427C510, C-22019, SR-01000075755-1, SR-01000075755-4, SR-01000075755-6, W-106262, 1,6)-pregnadiene-17.alpha.-ol-3,20-dione acetate, BRD-K41141507-001-16-2, WLN: L F3 E6 D665 IV JU LUTJ A1 E1 RV1 RQ, 17.alpha.-Acetoxy-6-chloro-1.alpha.,6-diene-3,20-dione, 6-Chloro-17-hydroxy-1.alpha.,6-diene-3,20-dione acetate, 1,6)-pregnadiene-17.alpha.-ol-3,20-dione 17alpha-acetate, 6-Chloro-1.beta.,2]pregna-1,4,6-triene-3,20-dione acetate, Cyproterone acetate, European Pharmacopoeia (EP) Reference Standard, 6-chloro-17-acetoxy-1alpha,2alpha-methylene-4,6-pregnadiene-3,20-dione, 1,2.alpha.-Methylene-6-chloro-.delta.(sup 6)-17.alpha.-hydroxyprogesterone acetate, 17alpha-acetoxy-6-chloro-1alpha,2alpha-methylene-4,6-pregnadiene-3,20-dione, 6-Chloro-.delta.(sup 6)-1,2.alpha.-methylene-17.alpha.-hydroxyprogesterone acetate, 6-Chloro-1,2.alpha.-methylene-17.alpha.-hydroxy-.delta.(sup 6)-progesterone acetate, 6-Chloro-1,2.alpha.-methylene-6-dehydro-17.alpha.-hydroxyprogesterone acetate, Cyproterone acetate for peak identification, European Pharmacopoeia (EP) Reference Standard, Pregna-4,20-dione, 6-chloro-17-hydroxy-1.alpha.,2.alpha.-methylene-, acetate, 3'H-Cyclopropa[1,4,6-triene-3,20-dione, 17-(acetyloxy)-6-chloro-1,2-dihydro-, (1.beta.,2.beta.)-, 3'H-Cyclopropa[1,4,6-triene-3,20-dione, 6-chloro-1.beta.,2.beta.-dihydro-17-hydroxy-, acetate, 3'H-Cyclopropa[1,4,6-triene-3,20-dione, 6-chloro-1.beta.,2.beta.-dihydro-17-hydroxy-,acetate, 6-chloro-3,20-dioxo-1beta,2beta-dihydro-3''H-cyclopropa[1,2]pregna-4,6-dien-17-yl acetate, acetic acid (8R,9S,10S,13S,14S,17R)-17-acetyl-6-(S)-chloro-10,13-dimethyl-3-(R)-oxo-1,2,3,8,9,10,11,12,13,14,15,16,17,20-tetradecahydro-cyclopropa[1,2]cyclopenta[a]phenanthren-17-yl ester


ID: 2276

chemical graph of compound 2276



InChIKey: UWNQSONNONTGTF-ZDFRXJMOSA-N
SMILES: CC(=O)O[C@@H]1CC2[C@]([C@H](C[C@H](C2(C)C)O)O)(C3[C@@]1(C4=CC(=O)O[C@H]([C@]4(CC3)C)C5=COC=C5)C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6710744
synonyms found at PubChem are:
1,3-DIDEACETYLDEOXYKHIVORIN, KBio3_002167, Spectrum2_001719, Spectrum3_001144, Spectrum4_001994, AC1O8K0M, BSPBio_002667, KBioGR_002555, SPECTRUM212126, SPBio_001738, CHEBI:111168, CCG-38790, SDCCGMLS-0066954.P001, NCGC00178544-01, [(1R,4bR,5R,8R,10S,10aS,12aS)-1-(furan-3-yl)-8,10-dihydroxy-4b,7,7,10a,12a-pentamethyl-3-oxo-1,5,6,6a,8,9,10,10b,11,12-decahydronaphtho[2,1-f]isochromen-5-yl] acetate


ID: 2277

chemical graph of compound 2277



InChIKey: UWUNPSYSMHUXCP-UHFFFAOYSA-N
SMILES: CC1=C(OC2=CC=CC=C2C1=O)C3=CC=CC=C3F

biological descriptors:

CFTR relevance: inactive

Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown

reference list:

"MH Nantz" "LJ Galietta" "K By" "EJ Niedzinski" "M Eda" "MF Springsteel" "MJ Haddadin" "MJ Kurth" "AS Verkman"


CID is 76329725
synonyms found at PubChem are:
CHEMBL2235746


ID: 2278

chemical graph of compound 2278



InChIKey: UXEQRVDJXHNPFC-YZWLQPDGSA-N
SMILES: CC(C)/C(=C/1\C2[C@]([C@@H](OC1=O)C3=COC=C3)(C([C@H]([C@@]45[C@]26[C@@H]([C@]7(C(C8(CC7([C@]4([C@H]8CC(=O)OC)C)OC(O5)(O6)C)C)OC(=O)C)OC)OC)OC)OC(=O)C(C)C)C)/OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6857763
synonyms found at PubChem are:
CHUKRASIN METHYL ETHER, CHEMBL3039293, Spectrum5_000166, BSPBio_001772, SPECTRUM100615, BDBM50442888, CCG-38641, SDCCGMLS-0066454.P001, NCGC00179018-01, SR-05000002783, SR-05000002783-1


ID: 2279

chemical graph of compound 2279



InChIKey: UXXCUDYYOMDFPX-GPRFVYSASA-N
SMILES: C1C[C@@H]([C@@H]([C@@H]2[C@@H]1CN3CCC4=C([C@@H]3C2)NC5=CC=CC=C45)C(=O)O)O.O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6419962
synonyms found at PubChem are:
Yohimbinic acid monohydrate, Yohimbic acid monohydrate, 207801-27-2, UNII-DN3BXM2IR8, DN3BXM2IR8, 522-87-2, DSSTox_CID_25578, DSSTox_RID_80974, DSSTox_GSID_45578, MLS002153893, (1R,2S,4aR,13bS,14aS)-2-hydroxy-1,2,3,4,4a,5,7,8,13,13b,14,14a-dodecahydroindolo[2',3':3,4]pyrido[1,2-b]isoquinoline-1-carboxylic acid hydrate, Prestwick_497, CAS-207801-27-2, SMR001233242, NCGC00017100-01, CHEMBL1484026, DTXSID7045578, CTK8F0566, C20H26N2O4.H2O, MolPort-003-926-543, UXXCUDYYOMDFPX-GPRFVYSASA-N, Yohimbinic acid monohydrate, 99%, HMS1569F22, HMS2096F22, HMS2235B06, Tox21_110776, AKOS030502397, Tox21_110776_1, Yohimban-16-carboxylic acid, 17-hydroxy-, monohydrate, (16alpha,17alpha)-, CCG-214492, CHM0032629, YOHIMBINIC ACID MONOHYDRATE 99, NCGC00178432-05, RT-016289, X6837, J-013619


ID: 2280

chemical graph of compound 2280



InChIKey: UXZFQZANDVDGMM-UHFFFAOYSA-N
SMILES: C1=CC2=C(C(=C(C=C2I)I)O)N=C1

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3728
synonyms found at PubChem are:
iodoquinol, 83-73-8, Diiodohydroxyquinoline, 5,7-diiodoquinolin-8-ol, 5,7-Diiodo-8-hydroxyquinoline, 5,7-Diiodo-8-quinolinol, Diiodoquin, DIIODOHYDROXYQUIN, Yodoxin, Diodoquin, Sebaquin, Diodohydroxyquin, Dijodoxichinoline, 8-Quinolinol, 5,7-diiodo-, Enterodiamoebin, Diamoebin, Dinoleine, Diodoquine, Diodoxylin, Direxiode, Disoquin, Embequin, Enterosept, Floraquin, Fluoraquin, Lanodoxin, Moebiquin, Quinadome, Searlequin, Dyodin, Ioquin, Zoaquin, Di-quinol, Stanquinate, Rafamebin, 5,7-Diiodo-oxine, Ioquin suspension, Dijodoxichinolinum, 5,7-Diodo-8-quinolinol, Diodoxyquinoleine, 8-Hydroxy-5,7-diiodoquinoline, Diiodoidrossichinolina, Panaquin, Diiodohidroxiquinoleina, Diiodohydroxyquinoleine, Diiodohydroxyquinolinum, Caswell No. 354, SS 578, NSC 8704, C9H5I2NO, Diiodoidrossichinolina [DCIT], UNII-63W7IE88K8, HSDB 3224, 5,7-Diiod-8-chinolinol [IUPAC], Diiodohydroxyquinolinum [INN-Latin], Diiodohydroxyquinoleine [INN-French], EINECS 201-497-9, Diiodohidroxiquinoleina [INN-Spanish], EPA Pesticide Chemical Code 024003, BRN 0153639, AI3-16443, MLS000069404, CHEBI:5950, 63W7IE88K8, NCGC00018098-04, SMR000059090, DSSTox_CID_3155, DSSTox_RID_76894, Diiodohydroxyquinoline (INN), Diiodohydroxyquinoline [INN], DSSTox_GSID_23155, Diodoxyquinoline, CAS-83-73-8, Iodoquinol [USAN], Iodoquinol [USAN:USP], 5,7-Diiod-8-chinolinol, Searlewuin, Meobiquin, component of Vytone, Iodoquinol (USP), Diiodohydroxyquinolin, Yodoxin (TN), Spectrum_000943, AC1L1GKT, 8-Quinolinol,7-diiodo-, Spectrum2_001041, Spectrum3_000470, Spectrum4_000020, Spectrum5_000872, Clioquinol EP Impurity C, 4,7-Diiodo-8-quinolinol, ACMC-209pt7, bmse000836, D06AEB, EC 201-497-9, cid_3728, SCHEMBL3460, BSPBio_002180, CBDivE_011080, KBioGR_000399, KBioSS_001423, ksc-8-193, CHEMBL86754, DivK1c_000119, SPECTRUM1500353, SPBio_000962, ARONIS008419, DTXSID6023155, 5,7-bis(iodanyl)quinolin-8-ol, BDBM66035, HMS500F21, KBio1_000119, KBio2_001423, KBio2_003991, KBio2_006559, KBio3_001400, UXZFQZANDVDGMM-UHFFFAOYSA-, NSC8704, MolPort-001-015-429, NINDS_000119, UXZFQZANDVDGMM-UHFFFAOYSA-N, WLN: T66 BNJ GI II JQ, HMS1920H05, HMS2091N15, HMS2230G24, HMS3369C20, KUC105860N, Pharmakon1600-01500353, HY-B1400, KS-000012ZY, NSC-8704, ZINC3830942, Tox21_110823, ANW-37721, CCG-40132, CH-644, MMV002817, NSC757077, s4565, STK070581, AKOS000120804, Tox21_110823_1, 5,7-Diiodo-8-hydroxyquinoline, 97%, CS-4910, DB09115, Iodoquinol (5,7-Diiodoquinolin-8-ol), MCULE-6767985681, NE10458, NSC-757077, IDI1_000119, KS-0000409J, TRA-0184419, NCGC00018098-01, NCGC00018098-02, NCGC00018098-03, NCGC00018098-05, NCGC00018098-07, NCGC00021685-03, NCGC00021685-04, AJ-45772, AN-34345, DS-17759, K494, SC-87246, SBI-0051417.P003, DB-056739, KB-196363, LS-142538, ST2418557, TR-054776, AM20061527, D1736, FT-0619847, ST45045165, C07636, D00581, AB00052024_12, AN-329/13210059, SR-01000002969, I08-0343, SR-01000002969-2, BRD-K75855670-001-06-8, F3034-0058, Iodoquinol, United States Pharmacopeia (USP) Reference Standard, InChI=1/C9H5I2NO/c10-6-4-7(11)9(13)8-5(6)2-1-3-12-8/h1-4,13H


ID: 2281

chemical graph of compound 2281



InChIKey: UYTMLDBQFLIQJA-GQCTYLIASA-N
SMILES: C1=COC(=C1)/C=N/O

biological descriptors:

CFTR relevance: inactive

Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown

reference list:

"MH Nantz" "LJ Galietta" "K By" "EJ Niedzinski" "M Eda" "MF Springsteel" "MJ Haddadin" "MJ Kurth" "AS Verkman"


CID is 6871288
synonyms found at PubChem are:
2-Furaldoxime, Furfural oxime, 2-furaldehyde oxime, Furfuryl oxime, 2-Furfuraldoxime, 2-Furancarboxaldehyde, oxime, alpha-Furfuraldoxime, 2-FURALDEHYDE, OXIME, 1121-47-7, NSC 1919, NSC 49237, BRN 0108675, AI3-00484, .alpha.-Furfuraldoxime, .beta.-Furfural oxime, WLN: T5OJ B1UNQ, Furfuraloxime, 620-03-1, (E)-1-(furan-2-yl)-N-hydroxymethanimine, (E)-furan-2-carbaldehyde oxime, (Z)-furfuraldoxime, NSC3929, AC1OB2GA, 2-furyl(hydroxyimino)methane, CHEMBL3577784, DTXSID6061521, NSC1919, (2E)-furan-2-carbaldehyde oxime, MolPort-000-144-147, MolPort-009-656-121, UYTMLDBQFLIQJA-XQRVVYSFSA-N, HMS1783M02, NSC-1919, NSC49237, BBL010522, NSC-49237, STK325338, AKOS000304645, ZINC100009862, PS-4057, (E)-1-(2-Furyl)-N-hydroxymethanimine, KB-24261, LS-69956, SC-77205, (E)-N-(furan-2-ylmethylidene)hydroxylamine, (NE)-N-(furan-2-ylmethylidene)hydroxylamine, ST45024095, (E)-N-[(furan-2-yl)methylidene]hydroxylamine, J-002714


ID: 2282

chemical graph of compound 2282



InChIKey: UYTMLDBQFLIQJA-XQRVVYSFSA-N
SMILES: C1=COC(=C1)/C=N\O

biological descriptors:

CFTR relevance: inactive

Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown

reference list:

"MH Nantz" "LJ Galietta" "K By" "EJ Niedzinski" "M Eda" "MF Springsteel" "MJ Haddadin" "MJ Kurth" "AS Verkman"


CID is 5354160
synonyms found at PubChem are:
furan-2-carbaldehyde oxime, Furfuraloxime, 1121-47-7, (E)-furan-2-carbaldehyde oxime, Furfuraldoxime, (E)-furfuraldoxime, AC1NS51H, SCHEMBL3079633, UYTMLDBQFLIQJA-GQCTYLIASA-N, ZINC8579610, (NZ)-N-(furan-2-ylmethylidene)hydroxylamine, (Z)-N-(furan-2-yl-methylene)-hydroxylamine, I14-21907, I14-23315


ID: 2283

chemical graph of compound 2283



InChIKey: UYVPXANKULGARL-UHFFFAOYSA-N
SMILES: CN1C2=C(C=CC(=C2)C(=O)NC(CP(=O)(O)O)C(=O)NC(CP(=O)(O)O)C(=O)O)N=C1C(C3=NC4=C(N3)C=C(C=C4)C(=O)NC(CP(=O)(O)O)C(=O)O)(F)F

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 501005
synonyms found at PubChem are:
CHEMBL106723, AC1L9U4W, BDBM50120038, 2-(2-{[1-(2-{1-[6-(1-Carboxy-2-phosphono-ethylcarbamoyl)-1H-benzoimidazol-2-yl]-1,1-difluoro-methyl}-3-methyl-3H-benzoimidazol-5-yl)-methanoyl]-amino}-3-phosphono-propanoylamino)-3-phosphono-propionic acid, 2-[[2-[difluoro-[6-[[1-[(1-hydroxy-1-oxo-3-phosphonopropan-2-yl)amino]-1-oxo-3-phosphonopropan-2-yl]carbamoyl]-1-methylbenzimidazol-2-yl]methyl]-3H-benzimidazole-5-carbonyl]amino]-3-phosphonopropanoic acid, 2-[[2-[difluoro-[6-[[2-[[2-hydroxy-2-oxo-1-(phosphonomethyl)ethyl]amino]-2-oxo-1-(phosphonomethyl)ethyl]carbamoyl]-1-methyl-benzimidazol-2-yl]methyl]-3H-benzimidazole-5-carbonyl]amino]-3-phosphono-propanoic acid, 2-[2-[1-Methyl-2-[difluoro[6-(1-carboxy-2-phosphonoethylcarbamoyl)-1H-benzimidazole-2-yl]methyl]-1H-benzimidazole-6-ylcarbonylamino]-3-phosphonopropionylamino]-3-phosphonopropionic acid, 2-{[2-({6-[1-(1-Carboxy-2-phosphono-ethylcarbamoyl)-2-phosphono-ethylcarbamoyl]-1-methyl-1H-benzoimidazol-2-yl}-difluoro-methyl)-3H-benzoimidazole-5-carbonyl]-amino}-3-phosphono-propionic acid


ID: 2284

chemical graph of compound 2284



InChIKey: UZOSLJNYISOLSY-WFUCIPNVSA-N
SMILES: C[C@H]1[C@H]2[C@H](CC3[C@@]2(C(=O)C=C4C3CC[C@@H]5[C@@]4(CC[C@@H](C5)OC(=O)C)C)C)OC16C(CC(CO6)C)Br

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6708715
synonyms found at PubChem are:
3beta-ACETOXY-23-BROMO-ISOALLOSPIROST-9 (11)-ENE-12-ONE, KBio2_001252, Spectrum_000772, SpecPlus_000595, Spectrum2_000274, Spectrum3_000068, Spectrum4_001350, Spectrum5_000259, BSPBio_001855, KBioGR_001879, KBioSS_001252, SPECTRUM100304, DivK1c_006691, SPBio_000148, CHEMBL3039167, KBio1_001635, KBio2_003820, KBio2_006388, KBio3_001055, CCG-39943, NCGC00178951-01


ID: 2285

chemical graph of compound 2285



InChIKey: UZWYJIMDOKHCEG-UHFFFAOYSA-N
SMILES: C1=CSC(=C1)C2=NOC(=C2)CO

biological descriptors:

CFTR relevance: inactive

Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown

reference list:

"MH Nantz" "LJ Galietta" "K By" "EJ Niedzinski" "M Eda" "MF Springsteel" "MJ Haddadin" "MJ Kurth" "AS Verkman"


CID is 5200459
synonyms found at PubChem are:
(3-(2-thienyl)isoxazol-5-yl)methan-1-ol, ZERO/005910, AC1NP9NB, MolPort-002-744-214, ZINC4343498, 3-(2-Thienyl)-5-isoxazolemethanol, SBB013780, STK785551, AKOS005621324, MCULE-8771953724, ST082950, (3-thiophen-2-yl-1,2-oxazol-5-yl)methanol, [3-(thiophen-2-yl)-1,2-oxazol-5-yl]methanol, 184868-43-7


ID: 2286

chemical graph of compound 2286



InChIKey: VABCILAOYCMVPS-UHFFFAOYSA-N
SMILES: CC(=O)CC(C1=CC=C(C=C1)[N+](=O)[O-])C2=C(C3=CC=CC=C3OC2=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 54676537
synonyms found at PubChem are:
ACENOCOUMAROL, Acenocoumarin, Nicoumalone, Nitrovarfarian, Nitrowarfarin, Sinthrome, Sintrom, 152-72-7, Nicumalon, Acenocumarol, Sinkumar, Syncoumar, Syncumar, Acenocoumarolum, Sincoumar, Sinthrom, Ascumar, Syntrom, Zotil, Acenokumarin, Neositron, Sintroma, Acenocumarolo, Acenocumarolum, Nitrophenylacetylethyl-4-hydroxycoumarine, Acenocoumarolum [INN-Latin], Minisintrom, Acitrom, Synthrom, Trombostop, Acenokumarin [Czech], Mini-sintrom, Acenocumarolo [DCIT], Acenocoumarol [INN], G-23350, 3-(alpha-Acetonyl-4-nitrobenzyl)-4-hydroxycoumarin, Mini-sintrom (TN), Acenocoumarol (INN), G 23350, 3-(alpha-Acetonyl-p-nitrobenzyl)-4-hydroxycoumarin, 4-Hydroxy-3-(1-(4-nitrophenyl)-3-oxobutyl)-2H-1-benzopyran-2-one, HSDB 3201, 3-(alpha-p-Nitrophenyl-beta-acetylethyl)-4-hydroxycoumarin, EINECS 205-807-3, 3-(alpha-(p-Nitrophenol)-beta-acetylethyl)-4-hydroxycoumarin, 3-(alpha-(4'-Nitrophenyl)-beta-acetylethyl)-4-hydroxycoumarin, 4-Hydroxy-3-[1-(4-nitrophenyl)-3-oxobutyl]-2H-chromen-2-one, G-23,350, (+/-)-ACENOCOUMARIN, MLS000539171, C19H15NO6, CHEBI:53766, G23350, 2H-1-Benzopyran-2-one, 4-hydroxy-3-(1-(4-nitrophenyl)-3-oxobutyl)-, Acenocoumarol-d4, SMR000162652, 2-hydroxy-3-[1-(4-nitrophenyl)-3-oxobutyl]-4h-chromen-4-one, 4-Hydroxy-3-[1-(4-Nitrophenyl)-3-oxobutyl]-2H-1-benzopyran-2-one, DSSTox_CID_2541, 3-(a-acetonyl-p-nitrobenzyl)-4-hydroxycoumarin, DSSTox_RID_76619, DSSTox_GSID_22541, AB-014/25000129, 3-(alpha-Acetonyl-p-nitrobenzyl)-4-hydroxy-coumarin, W-108047, 3-(alpha-Acetonyl-para-nitrobenzyl)-4-hydroxy-coumarin, Coumarin, 3-(alpha-acetonyl-p-nitrobenzyl)-4-hydroxy-, 2-hydroxy-3-[1-(4-nitrophenyl)-3-oxobutyl]chromen-4-one, 4-hydroxy-3-[1-(4-nitrophenyl)-3-oxobutyl]chromen-2-one, 2-hydroxy-3-[1-(4-nitrophenyl)-3-oxo-butyl]chromen-4-one, Mini Sintrom, 2H-1-Benzopyran-2-one, 4-hydroxy-3-[1-(4-nitrophenyl)-3-oxobutyl]-, 70897-81-3, (R)-(+)-Acenocoumarol, 4-hydroxy-3-(1-(4-nitrophenyl)-3-oxobutyl)-2H-chromen-2-one, Acenocoumarol [INN:BAN:NF], Sinthrome (TN), NCGC00016414-01, CAS-152-72-7, Prestwick_773, Sintrom (TN), 1185071-64-0, Opera_ID_1500, Prestwick0_000110, Prestwick1_000110, Prestwick2_000110, Prestwick3_000110, D05HFY, AC1L1S7P, AC1Q1Z5F, Acenocoumarol Alliance Brand, Acenocoumarol Novartis Brand, SCHEMBL33543, BSPBio_000100, MLS001074461, Acenocoumarol Ciba-Geigy Brand, SPBio_002039, Alliance Brand of Acenocoumarol, BPBio1_000110, CHEMBL397420, GTPL9015, Novartis Brand of Acenocoumarol, SCHEMBL1477562, Jsp002948, DTXSID2022541, CTK2H8029, CTK8F7500, Acenocoumarol, >=98% (HPLC), Ciba Geigy Brand of Acenocoumarol, Ciba-Geigy Brand of Acenocoumarol, MolPort-002-798-798, VABCILAOYCMVPS-UHFFFAOYSA-N, HMS1568E22, HMS2095E22, HMS2232P20, HMS3372J11, HMS3713F17, Pharmakon1600-01502411, HY-B1014, Tox21_110430, MFCD00137816, NSC760052, AKOS015962123, Tox21_110430_1, AB03786, API0000345, CCG-213077, CS-4527, DB01418, MCULE-6023926157, NSC-760052, NCGC00179658-01, NCGC00179658-04, AN-23328, LS-55093, SC-19741, ( inverted exclamation markA)-Acenocoumarin, KB-178379, AB00513804, FT-0660961, D07064, AB00513804_02, AB00527557-09, 152A727, 3-(|A-Acetonyl-p-nitrobenzyl)-4-hydroxy-coumarin, SR-01000678252, SR-01000678252-3, 3-(.alpha.-Acetonyl-4-nitrobenzyl)-4-hydroxycoumarin, 3-(.alpha.-Acetonyl-p-nitrophenyl)-4-hydroxycoumarin, BRD-A65051990-001-03-8, 3-(.alpha.-Acetonyl-p-nitrobenzyl)-4-hydroxy-coumarin, Coumarin, 3-(.alpha.-acetonyl-p-nitrobenzyl)-4-hydroxy-, 3-(.alpha.-p-Nitrophenyl-.beta.-acetylethyl)-4-hydroxycoumarin, 3-(.alpha.-(4-Nitrophenyl)-.beta.-acetylethyl)-4-hydroxycoumarin, 3-(.alpha.-(p-Nitrophenol)-.beta.-acetylethyl)-4-hydroxycoumarin, 4-Hydroxy-3-[1-(4-nitrophenyl)-3-oxobutyl]-2H-chromen-2-one #, Acenocoumarol, United States Pharmacopeia (USP) Reference Standard, 2H-1-Benzopyran-2-one, 4-hydroxy-3-(1-(4-nitrophenyl)-3-oxobutyl)-, (+-)-


ID: 2287

chemical graph of compound 2287



InChIKey: VABYUUZNAVQNPG-BQYQJAHWSA-N
SMILES: COC1=CC(=CC(=C1OC)OC)/C=C/C(=O)N2CCC=CC2=O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 637858
synonyms found at PubChem are:
Piperlongumine, Piplartine, 20069-09-4, Piperlongumin, Piplartin, UNII-SGD66V4SVJ, SGD66V4SVJ, CHEBI:8241, VABYUUZNAVQNPG-BQYQJAHWSA-N, ST079382, (E)-1-(3-(3,4,5-trimethoxyphenyl)acryloyl)-5,6-dihydropyridin-2(1H)-one, 5,6-Dihydro-1-[(2E)-1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propen-1-yl]-2(1H)-pyridinone, BRD2293, BRD-2293, 1-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]-2,3-dihydropyridin-6-one, (E)-5,6-Dihydro-1-[1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propenyl]-2(1H)-pyridinone, 1-[(2E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]-1,2,5,6-tetrahydropyridin-2-one, (E)-1-[3-(3,4,5-Trimethoxyphenyl)acryloyl]-5,6-dihydropyridin-2(1H)-one, 5,6-Dihydro-1-(1-oxo-3-[3,4,5-trimethoxyphenyl]-trans-2-propenyl)-2[1H]-pyridinone, 5,6-Dihydro-1-[1-oxo-3-(3,4,5-trimethoxyphenyl)-trans-2-propenyl]-2(1H)-pyridinone, Prestwick_399, PPLGM, AC1LCV4N, A1-00162, Prestwick2_000604, Prestwick3_000604, BSPBio_000508, MLS002153903, SCHEMBL173092, SPECTRUM1505135, BPBio1_000560, CHEMBL465843, SCHEMBL2465593, 1-[3-(3,4,5-Trimethoxy-phenyl)-acryloyl]-5,6-dihydro-1H-pyridin-2-one, ACon1_001541, CHEBI:92424, MolPort-001-741-398, HMS1569J10, HMS2096J10, HMS2234K24, Piperlongumine, >=97% (HPLC), ZINC899053, BCP13030, 2659AH, MFCD00075706, s7551, AKOS024284776, CCG-214375, 2(1H)-Pyridinone, 5,6-dihydro-1-(1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propenyl)-, (E)-, NCGC00096028-01, NCGC00096028-02, NCGC00096028-03, NCGC00096028-04, 4CN-2875, SMR001233252, ZB015157, P2361, C10166, C-54604, SR-01000841248, J-012992, N-(3,4,5-Trimethoxycinnamoyl)-D3-piperidin-2-one, SR-01000841248-2, BRD-K24132293-001-05-3, BRD-K24132293-001-09-5, BRD-K24132293-001-16-0, 5,6-Dihydro-1-(3,4,5-trimethoxycinnamoyl)-2(1H)-pyridinone, 5,6-Dihydro-1-(3,4,5-trimethoxycinnamoyl)-2(1H)-pyridone, 1-[(2E)-3-(3,4,5-Trimethoxyphenyl)-2-propenoyl]-5,6-dihydro-2(1H)-pyridinone #, 1-[(2E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]-1,5,6-trihydropyridin-2-one, 2(1H)-Pyridinone,5,6-dihydro-1-[(2E)-1-oxo- 3-(3,4,5-trimethoxyphenyl)-2-propenyl]-, 5,6-Dihydro-1-[1-oxo-3-(3,4,5-trimethoxyphenyl)-2-propenyl]-2(1H)-pyridinone, 9CI, Prop-2-en-1-one, 3-(3,4,5-trimethoxyphenyl)-1-(2,3-dihydropyridin-6(1H)-one-1-yl)-, (2E)-1-(1,2,5,6-Tetrahydro-2-oxopyridine-1-yl)-3-(3,4,5-trimethoxyphenyl)-2-propene-1-one


ID: 2288

chemical graph of compound 2288



InChIKey: VACCAVUAMIDAGB-UHFFFAOYSA-N
SMILES: CC1=NN=C(S1)NS(=O)(=O)C2=CC=C(C=C2)N

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5328
synonyms found at PubChem are:
sulfamethizole, 144-82-1, Sulfamethizol, Sulphamethizole, Rufol, Sulfamethizolum, Sulfamethylthiadiazole, Sulfametizol, Proklar, Sulfurine, Thiosulfil, Sulfapyelon, Urolucosil, Ayerlucil, Lucosil, Methazol, Microsul, Renasul, Salimol, Sulfstat, Tetracid, Thidicur, Ultrasul, Urocydal, Urodiaton, Urosulfin, Famet, Uroz, Sulfa gram, Thiosulfil Forte, 4-Amino-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide, Solfametizolo, Solfametizolo [DCIT], Sulfametizol [INN-Spanish], Sulfamethizolum [INN-Latin], Thiosulfil-A-Forte, SULFAMETHIAZOLE, Sulamethizole, Sulfamethazole, Benzenesulfonamide, 4-amino-N-(5-methyl-1,3,4-thiadiazol-2-yl)-, RP 2145, Sulfamethizole [USAN:INN:JAN], VK 53, Thiosulfil (TN), CCRIS 756, Sulphamethyltiadiazole, CHEBI:9331, 2-(p-Aminobenzenesulfonamido)-5-methylthiadiazole, C9H10N4O2S2, HSDB 4379, UNII-25W8454H16, 2-Methyl-5-sulfanilamido-1,3,4-thiadiazole, 2-Sulfanilamido-5-methyl-1,3,4-thiadiazole, 5-Methyl-2-sulfanilamido-1,3,4-thiadiazole, Sulfamethizole (Proklar), EINECS 205-641-1, N1-(5-Methyl-1,3,4-thiadiazol-2-yl)sulfanilamide, CHEMBL1191, AI3-50149, MLS000028603, N(sup 1)-(5-Methyl-1,3,4-thiadiazol-2-yl)-sulfanilamide, VACCAVUAMIDAGB-UHFFFAOYSA-N, 4-Amino-N-(5-Methyl-1,3,4-Thiadiazol-2-Yl)Benzene-1-Sulfonamide, N(sup 1)-(5-Methyl-1,3,4-thiadiazol-2-yl)sulfanilamide, NCGC00016407-05, NCGC00016407-08, CAS-144-82-1, SMR000058666, 4-Amino-N-[5-methyl-1,3,4-thiadiazol-2-yl]benzenesulfonamide, 25W8454H16, DSSTox_CID_3615, DSSTox_RID_77111, DSSTox_GSID_23615, N(1)-(5-Methyl-1,3,4-thiadiazol-2-yl)sulfanilamide, Sulfanilamide, N(sup 1)-(5-methyl-1,3,4-thiadiazol-2-yl)-, SR-01000003158, sulphamethazole, sulphamethiozole, [(4-aminophenyl)sulfonyl](5-methyl(1,3,4-thiadiazol-2-yl))amine, Prestwick_114, Sulfamethizole [USP:INN:BAN:JAN], Spectrum_000992, AC1Q2PXR, Opera_ID_1595, Prestwick0_000742, Prestwick1_000742, Prestwick2_000742, Prestwick3_000742, Spectrum2_001322, Spectrum3_000570, Spectrum4_000640, Spectrum5_001078, D07JJS, Epitope ID:122233, AC1L1K3Z, SCHEMBL26453, BSPBio_000724, BSPBio_001960, KBioGR_001260, KBioSS_001472, MLS002303066, DivK1c_000141, SPECTRUM1500549, SPBio_001443, SPBio_002663, BPBio1_000798, DTXSID5023615, CTK8B3741, HMS500H03, KBio1_000141, KBio2_001472, KBio2_004040, KBio2_006608, KBio3_001460, ZINC57493, MolPort-000-876-475, NINDS_000141, Sulfamethizole (JP15/USP/INN), Sulfamethizole (JP17/USP/INN), HMS1570E06, HMS1921A19, HMS2092I21, HMS2097E06, HMS2233L09, HMS3371A13, HMS3655F05, HMS3714E06, Pharmakon1600-01500549, HY-B0333, KS-000014AV, Tox21_110425, Tox21_201035, 2735AH, ANW-43072, BDBM50295558, CCG-39260, LS-853, NSC757327, s1957, SBB058179, AKOS002666345, Tox21_110425_1, API0004271, CS-2375, DB00576, MCULE-8287230974, NSC-757327, IDI1_000141, SMP1_000284, NCGC00016407-01, NCGC00016407-02, NCGC00016407-03, NCGC00016407-04, NCGC00016407-06, NCGC00016407-07, NCGC00016407-09, NCGC00016407-11, NCGC00024107-03, NCGC00024107-04, NCGC00024107-05, NCGC00258588-01, ABA-10163325, AN-43960, AS-10177, SC-62410, SBI-0051523.P003, AB2000390, KB-271162, TR-043817, AB00052098, B2039, S0360, ST51015120, C08050, D00870, AB00052098_15, AB00052098_16, Sulfamethizole, VETRANAL(TM), analytical standard, J-008011, SR-01000003158-2, SR-01000003158-3, Sulfamethizole, analytical standard, >=99% (HPLC), BRD-K31682896-001-05-9, BRD-K31682896-001-15-8, Sulfamethizole, European Pharmacopoeia (EP) Reference Standard, 4-amino-N-(5-methyl[1,3,4]thiadiazol-2-yl)-benzenesulfonamide, 4-amino-n-[5-methyl-1,3,4-thiadiazol-2-yl]-benzenesulfonamide, benzenesulfonamide,4-amino-n-(5-methyl-1,3,4-thiadiazol-2-yl)-, Sulfamethizole, United States Pharmacopeia (USP) Reference Standard, 4-oxo-3-phenyl-10-oxa-3-aza-tricyclo[5.2.1.0*1,5*] dec-8-ene-6-carboxylic acid


ID: 2289

chemical graph of compound 2289



InChIKey: VAOCPAMSLUNLGC-UHFFFAOYSA-N
SMILES: CC1=NC=C(N1CCO)[N+](=O)[O-]

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 4173
synonyms found at PubChem are:
metronidazole, 443-48-1, Flagyl, Metronidazol, Anagiardil, Trichazol, 2-Methyl-5-nitroimidazole-1-ethanol, Gineflavir, Meronidal, Metronidaz, Novonidazol, Trichopol, Trivazol, Danizol, Mexibol, Vagilen, Clont, MetroGel, Flagemona, Giatricol, Metronidazolo, Sanatrichom, Takimetol, Trichocide, Trichomol, Trikacide, Acromona, Atrivyl, Deflamon, Efloran, Entizol, Flagesol, Monagyl, Monasin, Orvagil, Trichex, Tricocet, Trikamon, Trikojol, Trikozol, Trimeks, Vagimid, Vertisal, Wagitran, Arilin, Bexon, Elyzol, Eumin, Flagil, Klion, Klont, Nalox, Tricom, Bayer 5360, neo-Tric, Tricowas B, 2-(2-Methyl-5-nitro-1H-imidazol-1-yl)ethanol, Deflamon-wirkstoff, Protostat, Satric, MetroCream, MetroLotion, MetroGel-Vaginal, CONT, NIDA, Methronidazole, Metromidol, Trichopal, Flegyl, Fossyol, Flagyl Er, Metronidazolum, Noritate, 1H-Imidazole-1-ethanol, 2-methyl-5-nitro-, Metro I.V., Metrolyl, Metric 21, Trichomonacid 'pharmachim', Metro Gel, 1-(2-Hydroxyethyl)-2-methyl-5-nitroimidazole, Metrodzhil, Metrogyl, Metrolag, Metrotop, Rathimed, Vandazole, Zadstat, Metric, Metronidazole in Plastic Container, RP 8823, Tricho cordes, Metronidazolo [DCIT], Tricho-gynaedron, 2-Methyl-1-(2-hydroxyethyl)-5-nitroimidazole, 2-Methyl-3-(2-hydroxyethyl)-4-nitroimidazole, SC 10295, NSC-50364, 1-(2-Hydroxy-1-ethyl)-2-methyl-5-nitroimidazole, Mexibol 'silanes', Metro I.V. In Plastic Container, Metronidazol [INN-Spanish], Metronidazolum [INN-Latin], APMN, 1-(beta-Ethylol)-2-methyl-5-nitro-3-azapyrrole, Flagyl I.V. RTU, Flagyl 375, giniflavir, Trichobrol, Florazole, Mepagyl, Metrozine, Nidagel, Nidagyl, Rosased, Zidoval, Metryl, Caswell No. 579AA, Ginefla vir, 1-(beta-Hydroxyethyl)-2-methyl-5-nitroimidazole, Metronidazole Phosphoester, Metro Cream, 1-Hydroxyethyl-2-methyl-5-nitroimidazole, Apo-Metronidazole, 2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethan-1-ol, FLAGYL I.V. RTU IN PLASTIC CONTAINER, 1-(beta-Oxyethyl)-2-methyl-5-nitroimidazole, NSC 50364, Noritate (TN), CCRIS 410, Metronidazole Monohydrochloride, UNII-140QMO216E, Flagyl (TN), Flagyl I.V., Imidazole-1-ethanol, 2-methyl-5-nitro-, HSDB 3129, 2-(2-methyl-5-nitroimidazol-1-yl)ethanol, Metrogel-vaginal (TN), 2-(2-methyl-5-nitro-imidazol-1-yl)ethanol, METRONIDAZOLE USP, METRO I.V, NSC69587, EINECS 207-136-1, Metronidazole [USAN:INN:BAN:JAN], NSC 69587, EPA Pesticide Chemical Code 120401, BRN 0611683, 2-(2-methyl-5-nitro-1-imidazolyl)ethanol, MLS000028590, CHEBI:6909, CB-01-14 MMX, Methyl-5-nitroimidazole-1-ethanol, VAOCPAMSLUNLGC-UHFFFAOYSA-N, 140QMO216E, BAY-5360, NSC50364, ZERO/004064, 2-Methyl-5-nitro-1-imidazoleethanol, IDR-90105, RP-8823, NCGC00016446-06, CAS-443-48-1, SMR000058175, 2-(2-methyl-5-nitroimidazolyl)ethan-1-ol, DSSTox_CID_892, M0924, DSSTox_RID_75848, DSSTox_GSID_20892, 1-(.beta.-Ethylol)-2-methyl-5-nitro-3-azapyrrole, 1-(.beta.-Hydroxyethyl)-2-methyl-5-nitroimidazole, WLN: T5N CNJ A2Q B1 ENW, Metro cream & gel, WLN: T6NTJ DQ ANU1- ET5N CNJ A1 BNW, SR-01000000244, lagyl, metropol, metrotab, nidazole, Polibiotic, Trikhopol, Flazol, Flagyl, Filmet, Metro IV, Mexibol (silanes), Metronidazole,(S), Prestwick_334, Anabact (TN), MetroGel (TN), Cimetrol 500LPCI, Metronidazole(Flagyl), Rozex (TN), Metronidazole, BioXtra, Metronidazole (Flagyl), PubChem15970, Spectrum_001035, Trichomonacid pharmachim, Metronidazole [USAN:USP:INN:BAN:JAN], ACMC-209jxc, 2-Methyl-5-nitro-1H-imidazole-1-ethanol, HELIDAC (Salt/Mix), AC1L1HKS, Maybridge1_001999, Opera_ID_1585, Prestwick0_000081, Prestwick1_000081, Prestwick2_000081, Prestwick3_000081, Spectrum2_000883, Spectrum3_000506, Spectrum4_000060, Spectrum5_001289, CHEMBL137, D0A2ZX, AC1Q2P2Z, NCIOpen2_000337, SCHEMBL23042, BSPBio_000002, BSPBio_002031, KBioGR_000559, KBioSS_001515, Metronidazole, 99% 25g, 5-23-05-00063 (Beilstein Handbook Reference), KSC911O0J, MLS000758286, MLS001424018, ARONIS24285, BIDD:GT0107, DivK1c_000007, SPECTRUM1500412, SPBio_000666, SPBio_001941, BAYER-5360, BPBio1_000004, DTXSID2020892, Flagyl I.V. RTU (Salt/Mix), BCBcMAP01_000184, CTK8B1704, HMS500A09, HMS547C19, KBio1_000007, KBio2_001515, KBio2_004083, KBio2_006651, KBio3_001531, KS-00000GNW, Metronidazole (JP15/USP/INN), Metronidazole (JP17/USP/INN), Metronidazole, analytical standard, MolPort-000-141-892, NINDS_000007, HMS1568A04, HMS1920N19, HMS2051G07, HMS2090B19, HMS2091F14, HMS2095A04, HMS2231E11, HMS3373O05, HMS3393G07, HMS3655E22, HMS3712A04, Pharmakon1600-01500412, ZINC113442, BCP13757, HY-B0318, Tox21_110441, Tox21_202413, Tox21_302794, ANW-30094, BBL005452, BDBM50375309, CCG-40016, FP-250, MFCD00009750, NSC-69587, NSC757118, s1907, SBB001486, SBB041018, STK177359, Metronidazole 2.0 mg/ml in Methanol, 69198-10-3 (mono-hydrochloride), AKOS000269646, AKOS005169650, Tox21_110441_1, CS-2358, DB00916, KS-5140, LS-1264, MCULE-6891596695, NC00020, NSC-757118, RP02657, RTR-036813, TRA0003669, 1-(2-Hydroxyethyl)-2-methyl-5-nitroimidazole N-(5-carboxy-5-aminopentane)carbamate, IDI1_000007, KS-000048I4, SMP1_000189, NCGC00016446-01, NCGC00016446-02, NCGC00016446-03, NCGC00016446-04, NCGC00016446-05, NCGC00016446-07, NCGC00016446-08, NCGC00016446-09, NCGC00016446-11, NCGC00016446-12, NCGC00022059-03, NCGC00022059-04, NCGC00022059-05, NCGC00256513-01, NCGC00259962-01, AC-23968, AJ-11436, AN-23451, BAS 02983617, BC200966, CJ-00822, CPD000058175, KB-55045, KB-91535, SAM001247010, SC-46607, ST024769, ZB003814, 1-hydrox yethyl-2-methyl-5-nitroimidazole, SBI-0051447.P003, AB0008438, AB2000365, KB-279824, Metronidazole, SAJ first grade, >=99.0%, TR-036813, AB00052046, BB 0218386, FT-0603394, ST24027485, 2-(2-Methyl-5-nitro-imidazol-1-yl)-ethanol, C07203, D00409, M-2794, 74568-EP2275420A1, 74568-EP2292612A2, 74568-EP2305640A2, 74568-EP2305662A1, 74568-EP2308857A1, AB00052046-17, AB00052046_18, AB00052046_19, A826552, Metronidazole, VETRANAL(TM), analytical standard, 2-(2-methyl-5-nitro-1H-imidazol-1-yl)-1-ethanol, 2-(2-Methyl-5-nitro-1H-imidazol-1-yl)ethanol #, I14-0667, Metronidazole, Antibiotic for Culture Media Use Only, Q-201403, SR-01000000244-4, SR-01000000244-5, BRD-K52020312-001-05-2, BRD-K52020312-001-15-1, Z87001124, F1773-0073, Metronidazole, certified reference material, TraceCERT(R), Metronidazole, British Pharmacopoeia (BP) Reference Standard, Metronidazole, European Pharmacopoeia (EP) Reference Standard, Metronidazole, United States Pharmacopeia (USP) Reference Standard, Metronidazole solution, 2.0 mg/mL in methanol, ampule of 1 mL, certified reference material, Metronidazole, Pharmaceutical Secondary Standard; Certified Reference Material, MNZ


ID: 2290

chemical graph of compound 2290



InChIKey: VAOSOCRJSSWBEQ-SPIKMXEPSA-N
SMILES: C1NCCN(C1)C2=NC3=CC=CC=C3C=C2.C(=C\C(=O)O)\C(=O)O.C(=C\C(=O)O)\C(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6420043
synonyms found at PubChem are:
Quipazine dimaleate, Quipazine dimaleate salt, 2-(1-Piperazinyl)quinoline dimaleate, 150323-78-7, Prestwick_905, SR-01000075574, PubChem22721, AC1O4WIF, CHEMBL1315073, MolPort-023-275-906, HMS1569L16, HMS2096L16, HMS3713L16, AKOS024458588, ACM4774247, CCG-220617, NCGC00094311-01, B6383, EU-0101019, Q 1004, SR-01000075574-1, SR-01000075574-3, SR-01000075574-7


ID: 2291

chemical graph of compound 2291



InChIKey: VAPNKLKDKUDFHK-UHFFFAOYSA-H
SMILES: CC1=C(C=C(C=C1)C(=O)NC2=C3C(=CC(=CC3=C(C=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])NC(=O)C4=CC(=CC=C4)NC(=O)NC5=CC=CC(=C5)C(=O)NC6=C(C=CC(=C6)C(=O)NC7=C8C(=CC(=CC8=C(C=C7)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])C.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5360
synonyms found at PubChem are:
SURAMIN SODIUM, 129-46-4, Suramin hexasodium, suramin hexasodium salt, Suramin sodium salt, Antrypol, Moranyl, Naganinum, Naphuride sodium, Fourneau 309, Suramine sodium salt, Suramin (sodium salt), Suramin Hexasodium [USAN], Suramina sodica [INN-Spanish], Suramine sodique [INN-French], Suraminum natricum [INN-Latin], BAY 205, NF060, UNII-89521262IH, EINECS 204-949-3, CI-1003, SK 24728, 309 F, NSC 34936, Metaret, 89521262IH, Suramin hexasodium (USAN), 1-(3-Benzamido-4-methylbenzamido)naphthalene-4,6,8-trisulfonic acid sym-3''-urea sodium salt, Suramina sodica, Suramine sodique, Suraminum natricum, 1,3,5-Naphthalenetrisulfonic acid, 8,8'-(carbonylbis(imino-3,1-phenylenecarbonylimino(4-methyl-3,1-phenylene)carbonylimino))bis-, hexasodium salt, 1,3,5-Naphthylenetrisulfonic acid, 8,8'-(ureylenebis(m-phenylenecarbonylimino(4-methyl-m-phenylene)carbonylimino))di-, hexasodium salt, 8,8'-[Carbonylbis[imino-3,1-phenylenecarbonylimino(4-methyl-3,1-phenylene)carbonylimino]]bis-1,3,5-naphthalenetrisulfonic acid hexasodium salt, 8,8'-carbonylbis[imino-3,1-phenylenecarbonylimino(4-methyl-3,1-phenylene)carbonylimino]bis-1,3,5-naphthalenetrisulfonic acid hexasodium, Hexasodium 8,8'-(ureylenebis(m-phenylenecarbonylimino(4-methyl-m-phenylene)carbonylimino))di-1,3,5-naphthalenetrisulfonate, NSC-34936, C51H34N6Na6O23S6, 309f, hexasodium 8-[[4-methyl-3-[[3-[[3-[[2-methyl-5-[(4,6,8-trisulfonatonaphthalen-1-yl)carbamoyl]phenyl]carbamoyl]phenyl]carbamoylamino]benzoyl]amino]benzoyl]amino]naphthalene-1,3,5-trisulfonate, NF 060, CI 1003, Bayer-205, Suramin sodium [INN], Lopac-S-149, AC1Q1ULR, Suramin. Hexasodium Salt, Bayer 205 (TN), AC1L1K6H, AC1L1R5V, SPECTRUM1502032, CHEBI:9364, CHEMBL413376, 145-63-1 (Parent), CTK7G6720, HY-B0879A, DTXSID30156024, MolPort-003-665-583, HMS2092P13, HMS3263N05, HMS3267N08, Tox21_501182, CCG-39868, MFCD00210217, NF-060, AKOS024456621, Suramin sodium salt, >=99% (TLC), CS-4445, LP01182, TRA0095799, NCGC00016201-01, NCGC00016201-02, NCGC00016201-03, NCGC00094436-01, NCGC00094436-02, NCGC00261867-01, LS-95868, TX-011184, B6752, EU-0101182, FT-0603341, S-149, D00808, M02480, W-108361, 1,3,5-Naphthalenetrisulfonic acid, 8,8'-(carbonylbis(imino-3,1-phenylenecarbonylimino(4-methyl-3,1-phenylene)carbonylimino))bis-, hexasodium salt (9CI), 1,3,5-naphthylenetrisulfonic acid, 8,8'-[ureylenebis[m-phenylene-carbonylimino(4-methyl-m-phenylene)-carbonylimino]] di- hexasodium salt, 8,8'-Carbonylbisimino-3,1-phenylenecarbonylimino-(4-methyl-3,1-phenylene)carbonyliminobis-1,3,5-naphthalenetrisulfonic acid hexasodium, 90586-65-5, hexapotassium 8-{4-methyl-3-[3-({[3-({2-methyl-5-[(4,6,8-trisulfonatonaphthalen-1-yl)carbamoyl]phenyl}carbamoyl)phenyl]carbamoyl}amino)benzamido]benzamido}naphthalene-1,3,5-trisulfonate, hexasodium 8-[(4-methyl-3-{[3-({[3-({2-methyl-5-[(4,6,8-trisulfonatonaphthalen-1-yl)carbamoyl]phenyl}carbamoyl)phenyl]carbamoyl}amino)benzoyl]amino}benzoyl)amino]naphthalene-1,3,5-trisulfonate, hexasodium 8-{4-methyl-3-[3-({[3-({2-methyl-5-[(4,6,8-trisulfonatonaphthalen-1-yl)carbamoyl]phenyl}carbamoyl)phenyl]carbamoyl}amino)benzamido]benzamido}naphthalene-1,3,5-trisulfonate


ID: 2292

chemical graph of compound 2292



InChIKey: VBCPVIWPDJVHAN-UHFFFAOYSA-N
SMILES: CC(COC1=CC=CC=C1)N(CCCl)CC2=CC=CC=C2.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6141
synonyms found at PubChem are:
Dibenzyline, Bensylyt NEN, Dibenzyline chloride, Phenoxybenzamine Hcl, CCRIS 506, EINECS 200-569-7, Phenoxybenzamine hydrochloride [USP], AI3-52044, N-Benzyl-N-phenoxyisopropyl-beta-chlorethylamine hydrochloride, N-Phenoxyisopropyl-N-benzyl-beta-chloroethylamine hydrochloride, N-2-Phenoxyisopropyl-N-benzyl-beta-chloroethylamine hydrochloride, Benzylamine, N-(2-chloroethyl)-N-(1-methyl-2-phenoxyethyl)-, hydrochloride, Benzenemethanamine, N-(2-chloroethyl)-N-(1-methyl-2-phenoxyethyl)-, hydrochloride, AC1L1LVX, 59-96-1 (Parent), benzyl-(2-chloroethyl)-(1-phenoxypropan-2-yl)azanium chloride, 34238-85-2, AC1LCW89, AKOS026750046, N-benzyl-N-(2-chloroethyl)-1-phenoxypropan-2-amine; hydron; chloride, Phenoxybenzamine hydrochloride, 63-92-3, N-benzyl-N-(2-chloroethyl)-1-phenoxypropan-2-amine hydrochloride, Dibenzyline hydrochloride, Phenoxybenzamine.HCl, Phenoxybenzamine chloride, Benzene methanamine, Phenoxybenzamine (hydrochloride), NCI-C01661, MLS000069374, CHEBI:8078, 2-(N-Benzyl-2-chloroethylamino)-1-phenoxypropane hydrochloride, benzyl(2-chloroethyl)(1-phenoxypropan-2-yl)amine hydrochloride, N-(2-Chloroethyl)-N-(1-methyl-2-phenoxyethyl)benzenemethanamine hydrochloride, CPD000058422, N-2-Phenoxyisopropyl-N-benzyl-chloroethylamine hydrochloride, SMR000058422, Dibenzyline (TN), Benzyl(2-chloroethyl)(1-methyl-2-phenoxyethyl)amine hydrochloride, DSSTox_CID_1127, N-(2-Chloroethyl)-N-(1-methyl-2-phenoxyethyl)benzylamine hydrochloride, DSSTox_RID_75958, DSSTox_GSID_21127, N-(2-Chloroethyl)-N-(1-methyl-2-phenoxyethyl)-benzylamine Hydrochloride, Phenoxybenzamine hydrochloride (USP), SR-01000000017, fenoxybenzamin, N-benzyl-N-(2-chloroethyl)-1-phenoxypropan-2-amine;hydrochloride, Bensylyte HCl, Phenoxybenzamine hydrochloride [USAN], Opera_ID_300, AC1NR4GD, CAS-63-92-3, Dibenzyline hyd rochloride, C18H23Cl2NO, phenoxybenzamide hydrochloride, SCHEMBL50729, MLS002222313, Phenyoxybenzamine hydrochloride, SPECTRUM2300176, AC1Q396G, CHEMBL1200787, DTXSID0021127, CTK6H8164, HY-B0431A, AOB5790, MolPort-003-666-770, HMS1570N10, Pharmakon1600-02300176, Phenoxybenzamine Hydrochloride,(S), BCP28467, NSC37448, Tox21_201588, Tox21_302978, WLN: G2N1R&Y1&1OR &GH, ANW-45430, CCG-39614, MFCD00055152, NSC-37448, NSC759572, AKOS015966790, AC-8077, AN-8367, CS-2537, LP00235, LS-1516, MCULE-2455465785, NC00598, NE47907, NSC-759572, NCGC00089748-02, NCGC00089748-06, NCGC00093699-01, NCGC00093699-02, NCGC00093699-03, NCGC00093699-04, NCGC00256370-01, NCGC00259137-01, AS-16927, H533, SAM002548984, SAM002564244, AB0013102, AB2000604, RT-000645, ST2407428, B-019, D0158, EU-0100235, FT-0603264, N-benzyl-N-(2-chloroethyl)-1-phenoxypropan, S2499, EN300-52514, C07436, D00507, Phenoxybenzamine hydrochloride, >=97%, powder, 055P152, J-009731, SR-01000000017-2, SR-01000000017-6, N-Phenoxyisopropyl-N-benzyl-2-chloroethylamine Hydrochloride, N-2-phenoxyisopropyl- N-benzyl-chloroethylamine hydrochloride, N-benzyl-N-(2-chloroethyl)-1-phenoxy-propan-2-amine hydrochloride, N-(2-Chloroethyl)-N-(1-methyl-2-phenoxyethyl)benzylamine, hydrochloride, Phenoxybenzamine hydrochloride, United States Pharmacopeia (USP) Reference Standard, Phenoxybenzamine Hydrochloride, Pharmaceutical Secondary Standard; Certified Reference Material


ID: 2293

chemical graph of compound 2293



InChIKey: VBHKTXLEJZIDJF-UHFFFAOYSA-N
SMILES: C1=CC(=C(C2=C1C(=O)C3=C(C=CC(=C3C2=O)O)O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5004
synonyms found at PubChem are:
quinalizarin, 1,2,5,8-Tetrahydroxyanthraquinone, Alizarinbordeaux, Alizarine Bordeaux B, 81-61-8, Khinalizarin, Quinalizarine, 1,2,5,8-tetrahydroxyanthracene-9,10-dione, Alizarine Bordeaux, C.I. Mordant Violet 26, 1,4,5,6-Tetrahydroxyanthraquinone, 1,2,5,8-Tetrahydroxy-9,10-anthraquinone, 9,10-Anthracenedione, 1,2,5,8-tetrahydroxy-, Alizarin Bordeaux BD, C.I. 58500, 1,2,5,8-Tetrahydroxy-9,10-anthracenedione, NSC 144046, 1,2,5,8-Tetrahydroxyanthracinon, UNII-6D43C3LYSG, NSC 4896, Anthraquinone, 1,2,5,8-tetrahydroxy-, CCRIS 5598, NSC4896, EINECS 201-366-6, BRN 1889617, 6D43C3LYSG, CHEMBL29898, 1,2,5,8-Tetrahydroxyanthra-9,10-quinone, CHEBI:37495, MFCD00001205, 1,5,8-Tetrahydroxyanthracinon, 9, 1,2,5,8-tetrahydroxy-, 1,5,8-Tetrahydroxyanthraquinone, Anthraquinone,2,5,8-tetrahydroxy-, 1,5,8-Tetrahydroxy-9,10-anthraquinone, 1,2,5,8-Tetrahydroxy anthraquinone, Alizarinbordeux, Chinalizarin, Quinalizarin, E, TXQ, Mordant Violet 26, Spectrum_000952, 3fl5, AC1L1JEC, Spectrum2_001362, Spectrum3_000778, Spectrum4_000998, Spectrum5_000846, D0Q0MM, D0X7HJ, BSPBio_002456, KBioGR_001435, KBioSS_001432, 4-08-00-03683 (Beilstein Handbook Reference), DivK1c_000144, SCHEMBL138122, SPECTRUM1500759, SPBio_001284, DTXSID4052558, CTK3E8610, HMS500H06, KBio1_000144, KBio2_001432, KBio2_004000, KBio2_006568, KBio3_001676, C14H8O6, PHF 016, Quinalizarin, >=95% (HPLC), MolPort-002-132-047, NINDS_000144, VBHKTXLEJZIDJF-UHFFFAOYSA-N, HMS1923K15, NSC-4896, ZINC3874832, 1,2,5,8-Tetrahydroxy-Anthraquinone, BBL012309, BDBM50041419, CCG-38979, NSC144046, SBB056977, STK803167, AKOS004901435, DB08660, MCULE-6434498680, NSC-144046, 1, 2, 5, 8-Tetrahydroxyanthraquinone, IDI1_000144, NCGC00095268-01, NCGC00095268-02, NCGC00095268-03, AN-24045, CC-02789, LS-20711, NCI60_004175, 1,5,8,10-tetrahydroxy-2,9-anthraquinone, 2,5,8,9-tetrahydroxy-1,10-anthraquinone, 2,8,9,10-tetrahydroxy-1,5-anthraquinone, 4,5,6,9-tetrahydroxy-1,10-anthraquinone, 4,7,8,9-tetrahydroxy-1,10-anthraquinone, 4,8,9,10-tetrahydroxy-1,7-anthraquinone, 5,6,9,10-tetrahydroxy-1,4-anthraquinone, 5,8,9,10-tetrahydroxy-1,2-anthraquinone, FT-0606262, ST50993100, X6974, 1,2,5,8-Tetrahydroxyanthra-9,10-quinone #, A840172, C-17130, SR-01000196297, 1,2,5,8-tetrakis(oxidanyl)anthracene-9,10-dione, SR-01000196297-1, I14-109284


ID: 2294

chemical graph of compound 2294



InChIKey: VBTQNRFWXBXZQR-UHFFFAOYSA-N
SMILES: CC(=O)NBr

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 4353
synonyms found at PubChem are:
n-bromoacetamide, 79-15-2, Acetamide, N-bromo-, UNII-0AQ6MWH7ZB, CCRIS 4590, EINECS 201-181-0, 0AQ6MWH7ZB, VBTQNRFWXBXZQR-UHFFFAOYSA-N, Acetobromamide, N-bromo-acetamide, sJYHIabIKTp@, ACMC-209pgg, N-Bromoacetamide, powder, Lopac-B-2377, AC1L1HZ1, AC1Q1KF2, SCHEMBL1658, Lopac0_000191, AC1Q281G, CHEMBL1256514, DTXSID5024633, CTK2H9510, MolPort-001-781-467, HMS3260H03, ZINC3874381, Tox21_500191, 6847AF, ANW-37262, AKOS015836195, CCG-204286, FCH3459524, HCH0026837, LP00191, LS-1773, KS-000015C0, NCGC00015145-01, NCGC00015145-02, NCGC00015145-03, NCGC00015145-04, NCGC00093667-01, NCGC00093667-02, NCGC00260876-01, AN-42138, AS-39373, BP-10839, KB-79312, AB1004261, DB-003101, TR-025220, B0530, EU-0100191, FT-0653546, B 2377, SR-01000075710, S14-0966, SR-01000075710-1


ID: 2295

chemical graph of compound 2295



InChIKey: VCCRNZQBSJXYJD-UHFFFAOYSA-N
SMILES: C1=CC=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5281616
synonyms found at PubChem are:
Galangin, 548-83-4, Norizalpinin, 3,5,7-Trihydroxyflavone, 3,5,7-Trihydroxy-2-phenyl-4H-chromen-4-one, 3,5,7-triOH-Flavone, UNII-142FWE6ECS, 3,5,7-Trihydroxy-2-phenyl-4-benzopyrone, 4H-1-Benzopyran-4-one, 3,5,7-trihydroxy-2-phenyl-, EINECS 208-960-4, NSC407229, FLAVONE, 3,5,7-TRIHYDROXY-, NSC 407229, NSC-407229, 4H-Benzopyran-4-one, 3,5,7-trihydroxy-2-phenyl-, BRN 0272179, 142FWE6ECS, 3,5,7-trihydroxy-2-phenylchromen-4-one, CHEBI:5262, CHEMBL309490, VCCRNZQBSJXYJD-UHFFFAOYSA-N, 3,5,7-trihydroxy-2-phenyl-4H-benzopyran-4-one, TNP00099, 3,5,7-Trihydroxy-2-phenyl-4H-1-benzopyran-4-one, 3,5,7-trihydroxy-2-phenyl-chromen-4-one, Q-100620, 4H-1-Benzopyran-4-one, 3,5,7-trihydroxy-2-phenyl- (9CI), teptochrysin, CCRIS 8471, Galangin,(S), PubChem9856, 3,7-Trihydroxyflavone, 5,7-Dihydroxyflavonol, AC1NQYQM, D0Y7HG, 3,5,7-Trihydroxy-Flavone, GTPL410, 5-18-04-00567 (Beilstein Handbook Reference), MLS002473087, SCHEMBL117225, AC1Q795U, AMBZ0237, BIDF1019, MEGxp0_000533, ACon1_000977, cid_5281616, CTK8B4968, DTXSID70203288, MolPort-001-740-694, ZX-AFC002769, Galangin;3,5,7-Trihydroxyflavone, HMS2268D24, ZINC120273, HY-N0382, KS-00000HC8, ANW-46870, BDBM50049391, LMPK12111653, MFCD00006833, SBB063756, Galangin, autophagy inducing flavonoid, AKOS003672546, AC-6383, AM85813, CCG-208629, CS-5619, MCULE-8693579543, QC-1282, RTX-010875, NCGC00017220-01, NCGC00017220-02, NCGC00017220-03, NCGC00142457-01, NCGC00169794-01, 4CN-1052, AJ-11682, AK-35610, AN-10056, AS-14766, BC202332, LS-69046, M515, SC-05259, SMR000112582, ST056288, AB0015257, AX8015785, KB-234079, ST2404607, FT-0626589, N1958, 3,5,7-tris(oxidanyl)-2-phenyl-chromen-4-one, C10044, 3,5,7-trihydroxy-2-phenyl-1-benzopyran-4-one, 3,5,7-Trihydroxy-2-phenyl-4H-chromen-4-one #, 4H-1-Benzopyran-4-one,5,7-trihydroxy-2-phenyl-, 548G834, A830393, SR-05000002165, I01-2804, SR-05000002165-2, BRD-K16503581-001-01-5, BRD-K16503581-001-04-9, 3,5,7-Trihydroxy-2-phenyl-4H-1-benzopyran-4-one, 9CI


ID: 2296

chemical graph of compound 2296



InChIKey: VCKPUUFAIGNJHC-UHFFFAOYSA-N
SMILES: C1=CC(=C(C(=C1)O)N)C(=O)CC(C(=O)O)N

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 89
synonyms found at PubChem are:
3-Hydroxykynurenine, 3-Hydroxy-dl-kynurenine, Hydroxykynurenine, 2147-61-7, 484-78-6, 2-amino-4-(2-amino-3-hydroxyphenyl)-4-oxobutanoic acid, DL-3-Hydroxykyunrenine, Kynurenine, 3-hydroxy-, 3-(3-Hydroxyanthraniloyl)alanine, dl-3-Hydroxykynurenine, CCRIS 4426, 3-(3-hydroxyanthraniloyl)-alanine, NSC 96400, CHEBI:1547, Kynurenine, 3-hydroxy (R,S), ALANINE, 3-(3-HYDROXYANTHRANILOYL)-, 3-hydroxy-kynurenine, Hydroxykinurenine, OH-Kynurenine, Prestwick_659, Prestwick0_000451, Prestwick1_000451, Prestwick2_000451, Prestwick3_000451, rac 3-Hydroxy Kynurenine, AC1L18GD, AC1Q5S3Q, WLN: ZR BQ FV1YZVQ, BSPBio_000522, SCHEMBL180582, SPBio_002461, BPBio1_000576, CHEMBL442576, BCBcMAP01_000037, CTK4J0834, VCKPUUFAIGNJHC-UHFFFAOYSA-N, HMS1569K04, NSC96400, ANW-43661, NSC-96400, 3-(2-amino-3-hydroxybenzoyl)alanine, AKOS016004491, VC30850, SMP1_000159, NCGC00179533-01, AN-25063, LS-16128, AX8011997, KB-227577, TR-010086, FT-0634065, C02794, A815406, Benzenebutanoic acid, a,2-diamino-3-hydroxy-g-oxo-, J-014094, alpha,2-Diamino-3-hydroxy-beta-oxobenzenebutanoic acid, Benzenebutanoic acid,2-diamino-3-hydroxy-.gamma.-oxo-, alpha,2-Diamino-3-hydroxy- gamma-oxobenzenebutanoic acid, 2-amino-4-(2-amino-3-hydroxy-phenyl)-4-oxo-butanoic acid, Benzenebutanoic acid, alpha,2-diamino-3-hydroxy-gamma-oxo-, (+-)-alpha,2-Diamino-3-hydroxy-gamma-oxobenzenebutanoic acid, .alpha.,2-Diamino-3-hydroxy-.gamma.-oxobenzenebutanoic acid, Benzenebutanoic acid, alpha,2-diamino-3-hydroxy-gamma-oxo- (9CI), 2-azanyl-4-(2-azanyl-3-oxidanyl-phenyl)-4-oxidanylidene-butanoic acid, Benzenebutanoic acid, alpha,2-diamino-3-hydroxy-gamma-oxo-, (+-)-


ID: 2297

chemical graph of compound 2297



InChIKey: VCMMXZQDRFWYSE-UHFFFAOYSA-N
SMILES: CC1=CC(=O)C2=C(C1=O)C=CC=C2O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 10205
synonyms found at PubChem are:
Plumbagin, 481-42-5, Plumbagine, 5-Hydroxy-2-methyl-1,4-naphthoquinone, Plumbaein, Plumbagone, 2-Methyljuglone, 5-hydroxy-2-methylnaphthalene-1,4-dione, 5-Hydroxy-2-methyl-[1,4]naphthoquinone, 5-Hydroxy-2-methyl-1,4-naphthalenedione, 2-Methyl-5-hydroxy-1,4-naphthoquinone, 1,4-Naphthalenedione, 5-hydroxy-2-methyl-, UNII-YAS4TBQ4OQ, NSC 236613, NSC 688284, CCRIS 6671, YAS4TBQ4OQ, EINECS 207-569-6, BRN 1870475, AI3-38055, CHEBI:8273, CHEMBL295316, VCMMXZQDRFWYSE-UHFFFAOYSA-N, 1,4-NAPHTHOQUINONE, 5-HYDROXY-2-METHYL-, NSC236613, NSC688284, ST069355, 5-Hydroxy-2-methyl-naphthalene-1,4-dione, 5-HYDROXY-2-METHYL-1,4-NAPTHOQUINONE, A1-00788, W-202844, 5-hydroxy-2-methyl-1,4-dihydronaphthalene-1,4-dione, SR-05000002263, Pumbagin, AC1L1UPE, RTK1, D0P0IE, 1, 5-hydroxy-2-methyl-, SCHEMBL34186, BSPBio_002546, 4-08-00-02376 (Beilstein Handbook Reference), Plumbagin from Plumbago indica, SPECTRUM1505129, GTPL7003, DTXSID8075413, 5-Hydroxy-2-methylnaphthoquinone, ACon1_001611, CTK3J2033, ZINC58187, MolPort-000-165-362, WLN: L66 BV EVJ C1 GQ, ZX-AT017261, ACM481425, ANW-41868, BDBM50012070, MFCD00001682, SBB012388, AKOS015969699, CCG-208032, CCG-208410, FCH1115124, MCULE-9327502882, NSC-236613, NSC-688284, RL03796, RTC-030441, NCGC00094567-01, NCGC00094567-02, NCGC00094567-03, NCGC00094567-04, NCGC00094567-05, NCGC00094567-06, AJ-09824, AK-35295, CC-21846, LS-95646, NCI60_001904, PS-11338, SC-45896, ZB002343, 5-Hydroxy-2-methyl-[1,4]naphthoquin one, 2-methyl-5-oxidanyl-naphthalene-1,4-dione, DB-051524, TC-030441, FT-0602795, P1139, 5- HYDROXY,2-METHYL-1,4-NAPHTOQUINONE, C10387, K-9170, A827479, C-07762, 1,4-Naphthalenedione, 5-hydroxy-2-methyl- (9CI), SR-05000002263-2, SR-05000002263-3, 1,4-Dihydro-1,4-dioxo-5-hydroxy-2-methylnaphthalene, BRD-K36137799-001-02-4, BRD-K36137799-001-03-2, I14-57333, InChI=1/C11H8O3/c1-6-5-9(13)10-7(11(6)14)3-2-4-8(10)12/h2-5,12H,1H


ID: 2298

chemical graph of compound 2298



InChIKey: VCNDHJFYRZQMHX-KPKJPENVSA-N
SMILES: COC1=CC2=C(C=C1)C(=O)/C(=C/C3=CC(=C(C=C3)OC)O)/CO2

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5946498
synonyms found at PubChem are:
SAPPANONE A DIMETHYL ETHER, AC1NZWZ7, Spectrum5_000317, BSPBio_001785, SPECTRUM201136, SCHEMBL4734315, CHEMBL1489223, SCHEMBL16636357, CCG-39042, SDCCGMLS-0066385.P001, NCGC00095498-01, NCGC00095498-02, SR-05000002568, SR-05000002568-1, BRD-K32857660-001-02-7, (3E)-3-[(3-hydroxy-4-methoxyphenyl)methylidene]-7-methoxychromen-4-one


ID: 2299

chemical graph of compound 2299



InChIKey: VCRGLZYPNNAVRP-JTQLQIEISA-N
SMILES: CC1(CCC(CC1)NC(=O)[C@H](CCC(=O)O)N)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3074827
synonyms found at PubChem are:
Neboglamine, Nebostinel, CR 2249, Neboglamine [INN], 163000-63-3, UNII-12EA34U5B8, 12EA34U5B8, CR-2249, NCGC00094157-01, (S)-4-Amino-5-((4,4-dimethylcyclohexyl)amino)-5-oxopentanoic acid, (S)-4-Amino-N-(4,4-dimethylcyclohexyl)glutaramic acid, (S)-4-Amino-5-[(4,4-dimethylcyclohexyl)amino]-5-oxopentanoic acid, Pentanoic acid, 4-amino-5-((4,4-dimethylcyclohexyl)amino)-5-oxo-, (S)-, Pentanoic acid,4-amino-5-[(4,4-dimethylcyclohexyl)amino]-5-oxo-, (4S)-, D0VX5O, AC1MIO91, DSSTox_CID_25787, DSSTox_RID_81128, DSSTox_GSID_45787, Lopac0_000826, SCHEMBL1353060, ZINC6138, CHEMBL1255840, DTXSID2045787, HMS3262F13, Tox21_111254, Tox21_500826, CR-224, CCG-204910, LP00826, XY-2401, (S)-CR-2249, NCGC00094157-02, NCGC00094157-03, NCGC00261511-01, LS-101790, CAS-163000-63-3, EU-0100826, N 2034, SR-01000076022, SR-01000076022-1, (s)-4-amino-5-(4,4-dimethylcyclohexylamino)-5-oxopentanoic acid, (4S)-4-amino-5-[(4,4-dimethylcyclohexyl)amino]-5-oxopentanoic acid, Pentanoic acid,4-amino-5-[(4,4-dimethylcyclohexyl)amino]-5-oxo-,(4S)-


ID: 2300

chemical graph of compound 2300



InChIKey: VCSFYFAZNRGDJK-UHFFFAOYSA-N
SMILES: CC1=C2C(=C(C(=C1Cl)OC(=O)C)Cl)OC3=C(C(=C(C(=C3OC2=O)Cl)OC(=O)C)Cl)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6710615
synonyms found at PubChem are:
KBio2_003121, Spectrum_000113, AC1O8JRL, Spectrum4_001980, Spectrum5_000891, NORDIPLOICIN DIACETATE, KBioGR_002485, KBioSS_000553, KBio2_000553, KBio2_005689, (3-acetyloxy-2,4,8,10-tetrachloro-1,7-dimethyl-6-oxobenzo[b][1,4]benzodioxepin-9-yl) acetate


ID: 2301

chemical graph of compound 2301



InChIKey: VCTHNOIYJIXQLV-UHFFFAOYSA-N
SMILES: CC1=CC(=CC=C1)CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=C(C=C4)Cl.Cl.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 64713
synonyms found at PubChem are:
Meclizine dihydrochloride, 1104-22-9, Meclozine dihydrochloride, Bonamine, Meclizine hydrochloride, Postafen, Vertizine, Taizer, 1-((4-Chlorophenyl)(phenyl)methyl)-4-(3-methylbenzyl)piperazine dihydrochloride, V-Cline, Duremesin, Meclizine Hcl, Ancolan dihydrochloride, Postafene dihydrochloride, meclizine diHCl, Meclizine (dihydrochloride), Parachloramine dihydrochloride, Meclizine hydrochloride anhydrous, meclizinedi hydrochloride, EINECS 214-164-8, NSC 28728, UNII-V5604WJ3XP, UNII-408UZ554UD, V5604WJ3XP, 408UZ554UD, 1-[(4-chlorophenyl)(phenyl)methyl]-4-[(3-methylphenyl)methyl]piperazine dihydrochloride, 1-p-Chlorbenzhydryl-m-methylbenzylpiperazine dihydrochloride, DSSTox_CID_25348, DSSTox_RID_80816, Piperazine, 1-((4-chlorophenyl)phenylmethyl)-4-((3-methylphenyl)methyl)-, dihydrochloride, DSSTox_GSID_45348, 569-65-3 (Parent), 1-[(4-chlorophenyl)-phenylmethyl]-4-[(3-methylphenyl)methyl]piperazine dihydrochloride, Piperazine, 1-(p-chloro-alpha-phenylbenzyl)-4-(m-methylbenzyl)-, dihydrochloride, Piperazine, 1-[(4-chlorophenyl)phenylmethyl]-4-[(3-methylphenyl)methyl]-, dihydrochloride, SR-01000000274, 1-[(4-chlorophenyl)-phenylmethyl]-4-[(3-methylphenyl)methyl]piperazine;dihydrochloride, Piperazine, 1-((4-chlorophenyl)phenylmethyl)-4-((3-methylphenyl)methyl)-, hydrochloride (1:2), Piperazine, 1-[(4-chlorophenyl)phenylmethyl]-4-[(3-methylphenyl)methyl]-, hydrochloride (1:2), Prestwick_534, ancolandihydrochloride, NCGC00016563-01, CAS-1104-22-9, AC1L21SH, AC1Q3A7M, C25H27ClN2.2HCl, SPECTRUM1500376, C25H29Cl3N2, (+-)-meclizine dihydrochloride, SCHEMBL2193375, CHEMBL1324020, DTXSID9045348, CTK8E8265, KS-00000GIY, MolPort-003-666-221, HMS1569K16, HMS1920J17, Meclizine Hydrochloride (anhydrous), BCP02929, HY-B0349, Tox21_110497, CCG-38908, s1986, AKOS015891690, Tox21_110497_1, BCP9000902, CS-2388, MCULE-6706083805, NE58451, Meclizine hydrochloride anhydrous, (+)-, Meclizine hydrochloride anhydrous, (-)-, NCGC00018296-07, NCGC00094712-01, NCGC00094712-02, AC-28134, AN-48505, BR-54924, DS-14608, BCP0726000289, Meclizine dihydrochloride anhydrous, (+)-, Meclizine dihydrochloride anhydrous, (-)-, Meclozine dihydrochloride anhydrous, (+)-, Meclozine dihydrochloride anhydrous, (-)-, AB0004700, AB2000406, KB-113127, LS-111207, TR-002148, FT-0603544, M2755, ST24026804, W0051, EN300-71543, 104M229, J-002420, Q-201344, SR-01000000274-3, 1-p-chlorbenzhydryl-m-methylbenzylpiperazinedihydrochloride, 1-(4-Chlorobenzhydryl)-4-(3-methylbenzyl)piperazine Dihydrochloride, 1-((4-chlorophenyl)phenylmethyl)-4-((3-methylphenyl)methyl)-piperazindih, 1-(p-chloro-alpha-phenylbenzyl)-4-(m-methylbenzyl)-piperazindihydrochlorid, 1-[(4-Chlorophenyl)phenyl- methyl]-4-[3-methylphenyl)- methyl]piperazine, 1-[(4-Chlorophenyl)phenyl-methyl]-4-[3-methylphenyl)-methyl]piperazine, 1-[(4-chlorophenyl)phenylmethyl]-4-[(3-methylphenyl)methyl]-piperazindihyd, 1-([4-chlorophenyl]phenylmethyl)-4-([3-methylphenyl]-methyl)piperazine dihydrochloride, 1-[(4-chlorophenyl)-phenyl-methyl]-4-(m-tolylmethyl)piperazine dihydrochloride, 1-[(4-Chlorophenyl)phenylmethyl]4-[(3-methylphenyl)methyl]piperazine dihydrochloride, 163837-33-0, 163837-34-1, 1639-65-2, Piperazine, 1-((4-chlorophenyl)phenylmethyl)-4-((3-methylphenyl)methyl)-, dihydrochloride, (+)-, Piperazine, 1-((4-chlorophenyl)phenylmethyl)-4-((3-methylphenyl)methyl)-, dihydrochloride, (-)-, Piperazine, 1-((4-chlorophenyl)phenylmethyl)-4-((3-methylphenyl)methyl)-, hydrochloride (1:2), (+)-, Piperazine, 1-((4-chlorophenyl)phenylmethyl)-4-((3-methylphenyl)methyl)-, hydrochloride (1:2),(-)-, Meclizinedihydrochloride, AKOS015896578, I06-2391


ID: 2302

chemical graph of compound 2302



InChIKey: VCUVETGKTILCLC-UHFFFAOYSA-N
SMILES: CC1(CCC=[N+]1[O-])C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 1774
synonyms found at PubChem are:
3317-61-1, 5,5-Dimethyl-1-pyrroline N-oxide, DMPO, 5,5-Dimethyl-1-pyrroline-N-oxide, 5,5-Dimethyl-1-pyrroline-1-oxide, 2,2-Dimethyl-3,4-dihydro-2H-pyrrole 1-oxide, 2,2-dimethyl-1-oxido-3,4-dihydropyrrol-1-ium, 2H-Pyrrole, 3,4-dihydro-2,2-dimethyl-, 1-oxide, UNII-7170JZ1QF3, ACMC-209hyz, Lopac-D-5766, AC1L1C7I, 3,4-Dihydro-2,2-dimethyl-2H-pyrrole 1-oxide, Lopac0_000350, 5,5-Dimethylpyrroline-Noxide, KSC224E9L, MLS002153283, CHEMBL79824, SCHEMBL130517, CTK1C4295, DTXSID30186826, MolPort-003-927-493, VCUVETGKTILCLC-UHFFFAOYSA-N, 7170JZ1QF3, HMS3261E21, AC1Q2273, ZINC2563972, ZX-AT015862, Tox21_500350, 5,5-Dimethyl-1 -pyrroline N-oxide, ANW-27561, FCH918327, MFCD00005279, 5,5-Dimethyl-1-Pyrrolidine-N-oxide, AKOS005257654, ACM3317611, CCG-204445, LP00350, RTR-032380, NCGC00015351-01, NCGC00015351-02, NCGC00015351-03, NCGC00015351-04, NCGC00093786-01, NCGC00093786-02, NCGC00261035-01, AS-15638, BR-41638, CC-20872, CJ-09657, Q108, SC-26624, SMR000326756, 5,5-Dimethyl-1-pyrroline N-oxide, 97%, AB0017403, AM20090502, B7401, D2362, EU-0100350, FT-0653618, 5,5-Dimethyl-1-pyrroline N-oxide, >=97%, D 5766, S-2810, 2,2-dimethyl-3,4-dihydropyrrol-1-ium-1-olate, C-34413, SR-01000075491, J-019063, S11-0032, SR-01000075491-1, 2,2-dimethyl-3,4-dihydro-2H-pyrrol-1-ium-1-olate, 5,5-Dimethyl-1-pyrroline N-oxide, for ESR-spectroscopy


ID: 2303

chemical graph of compound 2303



InChIKey: VDCDWNDTNSWDFJ-UHFFFAOYSA-N
SMILES: C1=C(C=C(C(=C1[N+](=O)[O-])O)O)[N+](=O)[O-]

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3870203
synonyms found at PubChem are:
3,5-dinitrocatechol, 7659-29-2, 3,5-dinitrobenzene-1,2-diol, 3,5-Dinitro-1,2-benzenediol, 3,5-Dinitropyrocatechol, OR-486, OR486, UNII-VK0VA22GY2, Pyrocatechol, 3,5-dinitro-, 1,2-Benzenediol, 3,5-dinitro-, BRN 2217246, VK0VA22GY2, CHEMBL168276, 3,5-DINITRO-BENZENE-1,2-DIOL, 3,5-DINITROCATECHOL (OR-486), DNC, SR-01000075610, OR 486, Ro 12812, Ro 01-2812, Spectrum_000187, Tocris-0483, Lopac-D-131, AC1MZC4M, Spectrum2_001109, Spectrum4_000747, Spectrum5_001163, Entacapone EP Impurity E, D09AYR, 3,5-Dinitrocatechol, solid, Lopac0_000477, KBioGR_001074, KBioSS_000667, MLS002153481, DivK1c_000067, SPECTRUM1503631, SPBio_001218, SCHEMBL1283419, CTK9A4338, HMS500D09, KBio1_000067, KBio2_000667, KBio2_003235, KBio2_005803, DTXSID00227391, MolPort-000-917-537, NINDS_000067, VDCDWNDTNSWDFJ-UHFFFAOYSA-N, HMS2231O07, HMS3261O16, HMS3266E12, HMS3372N08, ZINC2170217, Tox21_500477, BBL002796, BDBM50017846, CCG-39769, MFCD00069263, STK384959, AKOS003672486, DB02105, FCH1329734, LP00477, MCULE-2217464591, IDI1_000067, NCGC00015309-01, NCGC00015309-02, NCGC00015309-03, NCGC00015309-04, NCGC00015309-05, NCGC00015309-06, NCGC00024612-01, NCGC00024612-02, NCGC00024612-03, NCGC00024612-04, NCGC00261162-01, (OR-486), KB-95520, LS-29968, SMR000326837, KB-179776, B5006, EU-0100477, FT-0714708, ST50411667, T8169, C-54149, SR-01000075610-1, SR-01000075610-3


ID: 2304

chemical graph of compound 2304



InChIKey: VDSCKSOYNLTQSY-VGJPRPLGSA-N
SMILES: CC(=CCCC1(C=CC2=C(O1)C(=C3C(=C2O)C(=O)C4=CCCC5C4(O3)[C@](OC5(C)C)(C/C=C(\C)/C(=O)O)C(=O)O)CC=C(C)C)C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6857794
synonyms found at PubChem are:
GARCINOLIC ACID, CHEMBL1456870, Spectrum5_000026, BSPBio_002525, SPECTRUM201539, SCHEMBL13287227, BDBM50442867, CCG-38526, SDCCGMLS-0066909.P001, NCGC00095508-01, NCGC00095508-02, SR-05000002772, SR-05000002772-1


ID: 2305

chemical graph of compound 2305



InChIKey: VDUWPHTZYNWKRN-UHFFFAOYSA-N
SMILES: CCN1C2=CC3=C(C=C2C(=O)C(=N1)C(=O)O)OCO3

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 2762
synonyms found at PubChem are:
cinoxacin, Cinobac, 28657-80-9, Cinoxacine, Cinoxacino, Cinoxacinum, Compound 64716, Cinobactin, Uronorm, Clinoxacin, Cinx, Azolinic Acid, Cinoxacine [INN-French], Cinoxacinum [INN-Latin], Cinoxacino [INN-Spanish], Lilly 64716, UNII-LMK22VUH23, Cinobac (TN), NSC 304467, MLS000069630, 1-Ethyl-6,7-methylenedioxy-4(1H)-oxocinnoline-3-carboxylic acid, Cinoxacin [USAN:BAN:INN:JAN], EINECS 249-133-8, 1-ethyl-4-oxo-[1,3]dioxolo[4,5-g]cinnoline-3-carboxylic acid, BRN 1084304, LMK22VUH23, 1-Ethyl-1,4-dihydro-4-oxo(1,3)dioxolo(4,5-g)cinnoline-3-carboxylic acid, SMR000058232, CHEBI:3716, VDUWPHTZYNWKRN-UHFFFAOYSA-N, C12H10N2O5, TNP00246, 1-Ethyl-4-oxo-1,4-dihydro[1,3]dioxolo[4,5-g]cinnoline-3-carboxylic acid, NSC304467, NCGC00015277-02, CAS-28657-80-9, DSSTox_CID_2822, (1,3)Dioxolo(4,5-g)cinnoline-3-carboxylic acid, 1,4-dihydro-1-ethyl-4-oxo-, (1,3)Dioxolo(4,5-g)cinnoline-3-carboxylic acid, 1-ethyl-1,4-dihydro-4-oxo-, 1-Ethyl-1,4-dihydro-4-oxo[1,3]dioxolo[4,5-g]cinnoline-3-carboxylic acid, 1-Ethyl-4-oxo-1,4-dihydro-[1,3]dioxolo[4,5-g]cinnoline-3-carboxylic acid, C 8645, DSSTox_RID_76745, DSSTox_GSID_22822, [1,3]Dioxolo[4,5-g]cinnoline-3-carboxylic acid, 1-ethyl-1,4-dihydro-4-oxo-, 1-ethyl-4-oxo-1H,4H,7H-[1,3]dioxolo[4,5-g]cinnoline-3-carboxylic acid, 1-ethyl-4-oxohydro-7H-1,3-dioxoleno[4,5-g]cinnoline-3-carboxylic acid, SR-01000000129, Noxigram, CCRIS 8206, 1-ethyl-1,4-dihydro-4-oxo-[1,3]dioxolo[4,5-g]cinnoline-3-carboxylic acid, Prestwick_239, Cinoxacin [USAN:USP:INN:BAN:JAN], PubChem16235, Spectrum_000152, AC1L1EEQ, Opera_ID_1392, Prestwick0_000780, Prestwick1_000780, Prestwick2_000780, Prestwick3_000780, Spectrum2_000570, Spectrum3_000352, Spectrum4_000289, Spectrum5_000749, Lopac-C-8645, D07UXP, cid_2762, CHEMBL1208, Cinoxacin (JAN/USP/INN), Lopac0_000309, Oprea1_131085, SCHEMBL43770, BSPBio_000860, BSPBio_002043, KBioGR_000818, KBioSS_000632, MLS001148076, DivK1c_000318, SPECTRUM1500190, SPBio_000360, SPBio_002799, Cinoxacin (JP17/USP/INN), AC1Q317Y, BPBio1_000946, DTXSID8022822, BDBM39350, CTK1A2019, HMS500P20, KBio1_000318, KBio2_000632, KBio2_003200, KBio2_005768, KBio3_001263, ZINC32350, MolPort-001-794-447, NINDS_000318, HMS1570K22, HMS1920O11, HMS2091E18, HMS2097K22, HMS2235K07, HMS3260N20, HMS3370B19, HMS3714K22, Pharmakon1600-01500190, HY-B1085, Tox21_110121, Tox21_500309, 2323AH, CCG-39160, MFCD00056776, NSC756695, SBB003082, AKOS022507372, Tox21_110121_1, CS-4652, DB00827, LP00309, MCULE-3390574434, NSC-304467, NSC-756695, IDI1_000318, NCGC00015277-01, NCGC00015277-03, NCGC00015277-04, NCGC00015277-05, NCGC00015277-06, NCGC00015277-07, NCGC00015277-08, NCGC00015277-09, NCGC00015277-10, NCGC00015277-11, NCGC00015277-12, NCGC00015277-13, NCGC00015277-14, NCGC00015277-17, NCGC00023754-03, NCGC00023754-04, NCGC00023754-05, NCGC00023754-06, NCGC00023754-07, NCGC00260994-01, LS-62687, ST044511, SBI-0050297.P004, EU-0100309, FT-0602947, C08052, D00872, AB00051948_17, AB00051948_18, A819523, J-017182, SR-01000000129-2, SR-01000000129-4, SR-01000000129-7, BRD-K14704277-001-05-1, BRD-K14704277-001-15-0, 1-Ethyl-1,3]dioxolo[4,5-g]cinnoline-3-carboxylic acid, Cinoxacin, United States Pharmacopeia (USP) Reference Standard, [1,5-g]cinnoline-3-carboxylic acid, 1-ethyl-1,4-dihydro-4-oxo-, 1-Ethyl-1,4-dihydro-4-oxo(1,3)dioxolo(4,5-g)cinnoline-3-carboxylicacid, 1-ethyl-4-oxidanylidene-[1,3]dioxolo[4,5-g]cinnoline-3-carboxylic acid, [1,3]Dioxolo[4,5-g]cinnoline-3-carboxylicacid, 1-ethyl-1,4-dihydro-4-oxo-


ID: 2306

chemical graph of compound 2306



InChIKey: VDVJGIYXDVPQLP-UHFFFAOYSA-N
SMILES: C1OC2=C(O1)C=C(C=C2)C(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 7196
synonyms found at PubChem are:
PIPERONYLIC ACID, 94-53-1, 1,3-Benzodioxole-5-carboxylic acid, Heliotropic acid, Benzo[d][1,3]dioxole-5-carboxylic acid, 3,4-Methylenedioxybenzoic acid, 2H-1,3-Benzodioxole-5-Carboxylic Acid, benzo[1,3]dioxole-5-carboxylic acid, Protocatechuic acid methylene ether, 5-Benzodioxolecarboxylic acid, 3,4-Dioxymethylenebenzoic acid, 3,4-Methylene dioxybenzoic acid, UNII-QX3V1NO0KH, 3,4-(Methylenedioxy)benzoic acid, NSC 10072, Benzoic acid, 3,4-(methylenedioxy)-, EINECS 202-342-8, QX3V1NO0KH, AI3-05972, VDVJGIYXDVPQLP-UHFFFAOYSA-N, 2H-benzo[d]1,3-dioxolene-5-carboxylic acid, piperonylsaure, PiperonylicAcid, 4ddk, PubChem9772, Spectrum_001164, ACMC-209rsh, Piperonylic acid, 99%, Spectrum3_001022, Spectrum4_001152, 5-carboxy-1,3-benzodioxole, 3,4-dioxymethylenebenzoicacid, BSPBio_002803, KBioGR_001723, KBioSS_001644, SPECTRUM500580, KSC486O0R, SCHEMBL142318, AC1L1O84, AC1Q73V3, AMBZ0455, CHEMBL573781, protocatechuic acid methylenether, 3,4-methylenedioxy-benzoic acid, DTXSID6059104, CTK3I6708, KBio2_001644, KBio2_004212, KBio2_006780, KBio3_002023, VDVJGIYXDVPQLP-UHFFFAOYSA-, 3,4-(Methylendioxy)benzoic acid, 3,4-(methylenedioxy)benzoic-acid, Benzoic acid,4-(methylenedioxy)-, CHEBI:107644, MolPort-000-142-196, BDBM153299, SP346, ZINC158540, 1,3-Benzodioxole-5-carboxylicacid, 1,3-Benzodioxole-5-carboxylic aci, 3, 4-(Methylenedioxy)benzoic acid, 3,4-(Methylenedioxy)-Benzoic acid, ACT03321, CS-D1455, KS-00000CG1, NSC10072, STR05605, ANW-40287, BBL011979, HTS006395, KM3294, MFCD00005830, NSC-10072, SBB003897, STK397540, 1,3-Benzodioxole -5-carboxylic acid, 1,3-benzodioxole-5-carbons&#xe4;ure, AKOS000113163, benzo[1,3]-dioxole-5-carboxylic acid, BS-3899, CCG-214272, FR-1276, MCULE-6703120222, RP02454, RTR-029546, SDCCGMLS-0065919.P001, SDCCGMLS-0065919.P002, TRA0044984, Benzo[d][I,3]dioxole-5-carboxylic acid, NCGC00095970-01, NCGC00095970-02, AC-11342, AJ-15209, AN-42695, KB-47592, LS-34652, SC-07412, ST097623, 1,3-Benzodioxole-5-carboxylic acid, 9CI, Piperonylic acid, purum, >=97.0% (T), AB1000155, DB-011499, TR-029546, AM20060211, FT-0631477, P0459, ST24024630, AZ0001-0307, AE-562/40258182, I04-0207, Piperonylic Acid; 3,4-(Methylenedioxy)benzoic acid, W-100193, BRD-K52148119-001-01-5, BRD-K52148119-001-02-3, F3318-0150, Z256709122, InChI=1/C8H6O4/c9-8(10)5-1-2-6-7(3-5)12-4-11-6/h1-3H,4H2,(H,9,10), 0HN, 1160950-49-1


ID: 2307

chemical graph of compound 2307



InChIKey: VEBVPUXQAPLADL-POYOOMFHSA-N
SMILES: C[C@@H]1C[C@@H]2[C@@H](C2(C)C)[C@@H]3C=C([C@H]([C@]4([C@@]1(C3=O)C=C([C@@H]4O)C)O)O)CO

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 442042
synonyms found at PubChem are:
ingenol, 30220-46-3, UNII-IC77UZI9G8, IC77UZI9G8, CHEBI:5922, (1aR,2S,5R,5aR,6S,8aS,9R,10aR)-5,5a,6-trihydroxy-4-(hydroxymethyl)-1,1,7,9-tetramethyl-1a,2,5,5a,6,9,10,10a-octahydro-1H-2,8a-methanocyclopenta[a]cyclopropa[e][10]annulen-11-one, AC1L9C5K, SCHEMBL317087, (non-Isotopelabelled)Ingenol-D5, CHEMBL2165402, SCHEMBL17691258, BCBcMAP01_000158, MolPort-028-751-180, VEBVPUXQAPLADL-POYOOMFHSA-N, ACT03354, HY-N0865, ZINC27652832, AKOS025289536, ACN-035202, CS-3912, SMP1_000044, CC-29554, C09112, C-20567, J-017834, 1aalpha,2alpha,5beta,5abeta,6beta,beta,9 alpha, 10,10aalpha-Octahydro-5,5a,6-trihydroxy-4-(hydroxymethyl)-1,1,7,9-tetramethyl-1H-2,8aalpha-methano cyclopenta(a)cyclopropa(e)cyclodecen-11-one, 1H-2,8a-ethanocyclopenta[a]yclopropa[e]yclodecen-11-ne, 1a,2,5,5a,6,9,10,10a-ctahydro-5,5a,6-rihydroxy-4-(hydroxymethyl)-1,1,7,9-etramethyl-, (1aR,2S,5R,5aR,6S,8aS,9R,10aR)-, 1H-2,8a-Methanocyclopenta[a]cyclopropa[e]cyclodecen-11-one,1a,2,5,5a,6,9,10,10a-octahydro-5,5a,6-trihydroxy-4-(hydroxymethyl)-1,1,7,9-tetramethyl-,(1aR,2S,5R,5aR,6S,8aS,9R,10aR)-


ID: 2308

chemical graph of compound 2308



InChIKey: VEJJMTHWRMKGKN-SJRAPUSDSA-N
SMILES: CC(C)C1=C(C=CC2=C1CCC3[C@@]2(CCC[C@]3(C)C(=O)OC)C)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6708566
synonyms found at PubChem are:
TOTAROL-19-CARBOXYLIC ACID, METHYL ESTER, KBio2_001155, Spectrum_000675, SpecPlus_000134, AC1O8FDJ, Spectrum2_000366, Spectrum3_000125, Spectrum4_001402, Spectrum5_000164, BSPBio_001770, KBioGR_001784, KBioSS_001155, SPECTRUM100612, DivK1c_006230, SPBio_000491, SCHEMBL4632168, KBio1_001174, KBio2_003723, KBio2_006291, KBio3_000930, CHEBI:110168, CCG-38640, SDCCGMLS-0066455.P001, SR-05000002593, SR-05000002593-1, BRD-A77488069-001-03-4, methyl (1S,4aS)-7-hydroxy-1,4a-dimethyl-8-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylate


ID: 2309

chemical graph of compound 2309



InChIKey: VEQOALNAAJBPNY-UHFFFAOYSA-N
SMILES: CC1=CC(=O)N(N1C)C2=CC=CC=C2

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 2206
synonyms found at PubChem are:
antipyrine, Phenazone, 60-80-0, Antipyrin, Phenazon, Analgesine, Anodynine, Anodynin, Azophen, Fenazone, 2,3-Dimethyl-1-phenyl-5-pyrazolone, Antipirin, Phenozone, Apirelina, Azophene, Methozin, Phenylone, Pyrazophyl, Sedatine, Sedatin, Dimethyloxychinizin, Antipyrinum, Dimethyloxyquinazine, Oxydimethylquinazine, Phenazonum, Azophenum, Fenazona, Parodyne, Phenylon, 3-Antipyrine, Fenazon [Czech], Auralgan, Fenazon, Fenazona [INN-Spanish], Phenazone (pharmaceutical), 3H-Pyrazol-3-one, 1,2-dihydro-1,5-dimethyl-2-phenyl-, Oxydimethylquinizine, 1-Phenyl-2,3-dimethyl-5-pyrazolone, 1-Phenyl-2,3-dimethylpyrazole-5-one, CHEBI:31225, Phenazonum [INN-Latin], 2,3-Dimethyl-1-phenyl-3-pyrazolin-5-one, UNII-T3CHA1B51H, NSC 7945, 1,2-Dihydro-1,5-dimethyl-2-phenyl-3H-pyrazol-3-one, 1,5-Dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one, CCRIS 1369, EINECS 200-486-6, T3CHA1B51H, 1,5-dimethyl-2-phenyl-2,3-dihydro-1H-pyrazol-3-one, AI3-15293, VEQOALNAAJBPNY-UHFFFAOYSA-N, Phenazone (INN), Phenazone [INN], 1,5-dimethyl-2-phenylpyrazol-3-one, 1,5-dimethyl-2-phenyl-pyrazol-3-one, CAS-60-80-0, NCGC00016274-04, DSSTox_CID_1117, 1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one, DSSTox_RID_75949, DSSTox_GSID_21117, Antipyrine [JAN], SMR000238140, Antipyrine [USP:JAN], SR-05000001566, .beta.-Antipyrine, Prestwick_26, Antipyrine Crystals, component of Auralgan, Spectrum_000058, Prestwick0_000029, Prestwick1_000029, Prestwick2_000029, Prestwick3_000029, Spectrum2_000088, Spectrum3_000305, Spectrum4_000152, Spectrum5_000842, ACMC-209mm6, Antipyrine (JP17/USP), D03IRR, Epitope ID:124927, EC 200-486-6, AC1L1D5U, ANTIPYRINE CRYSTALLINE, Propyphenazone EP impurity A, SCHEMBL20452, BSPBio_000097, BSPBio_001870, KBioGR_000624, KBioSS_000438, KSC912A0P, MLS001331753, MLS001332401, MLS001332402, MLS002154179, DivK1c_000484, SPECTRUM1500128, SPBio_000016, SPBio_002018, Antipyrine, analytical standard, AC1Q404E, BPBio1_000107, CHEMBL277474, DTXSID6021117, CTK8B2007, HMS501I06, KBio1_000484, KBio2_000438, KBio2_003006, KBio2_005574, KBio3_001370, ZINC61044, NSC7945, Antipyrine, >=99.0% (RT), MolPort-001-783-067, NINDS_000484, HMS1568E19, HMS1920E09, HMS2091K09, HMS2095E19, HMS2272G04, HMS3652C09, HMS3712E19, Pharmakon1600-01500128, WLN: T5NNVJ A1 BR& E1, HY-B0171, KS-000010VJ, NSC-7945, Tox21_110342, Tox21_201600, Tox21_303026, Antipyrine, Sigma Reference Standard, ANW-33580, BBL001832, BDBM50103600, CCG-38904, NSC755874, s3173, SBB017226, STK328171, 1,5-Dimethyl-2-phenyl-3-pyrazolone, AKOS000588788, Tox21_110342_1, CS-2044, DB01435, LS-7645, MCULE-9945022433, NSC-755874, RTR-020954, IDI1_000484, Antipyrine, analytical reference material, Antipyrine, tested according to Ph.Eur., NCGC00016274-01, NCGC00016274-02, NCGC00016274-03, NCGC00016274-05, NCGC00016274-06, NCGC00016274-07, NCGC00016274-10, NCGC00094591-01, NCGC00094591-02, NCGC00094591-03, NCGC00178937-01, NCGC00178937-02, NCGC00256527-01, NCGC00259149-01, AN-23639, AS-13248, CJ-00513, H725, KB-47423, SC-25842, ST009485, ZB002422, SBI-0051287.P003, AB1009247, Antipyrine, Vetec(TM) reagent grade, 98%, TR-020954, D1876, FT-0609690, A19580, BIM-0051287.0001, C13244, D01776, AF-960/00437050, I14-7751, Q-201552, SR-05000001566-1, SR-05000001566-3, 2,3-Dimethyl-1-phenyl-3-pyrazolin-5-one; Phenazone, BRD-K46937689-001-05-1, BRD-K46937689-001-08-5, Z56869297, 3H-Pyrazol-3-one,1,2-dihydro-1,5-dimethyl-2-phenyl-, F2173-0728, 1,5-Dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one #, Phenazone, European Pharmacopoeia (EP) Reference Standard, Antipyrine, United States Pharmacopeia (USP) Reference Standard, 1,2-Dihydro-1,5-dimethyl-2-phenyl-3H-pyrazol-3-one; Phenazone, 123175-91-7, 5779-41-9


ID: 2310

chemical graph of compound 2310



InChIKey: VEXVWZFRWNZWJX-NBKAJXASSA-N
SMILES: CCC(C)CCCC(=O)N[C@@H](CCN)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCN)C(=O)N[C@H]1CCNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC1=O)CCN)CC(C)C)CC(C)C)CCN)CCN)[C@@H](C)O.OS(=O)(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 91885449
synonyms found at PubChem are:
Colistin (sulfate), Colistin sulphate, AOB5071, HMS3713B13, HY-A0089, Q-200889


ID: 2311

chemical graph of compound 2311



InChIKey: VEYWWAGBHABATA-UHFFFAOYSA-N
SMILES: CN(C)CCN(CC1=CC=C(C=C1)Cl)C2=CC=CC=N2.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 25294
synonyms found at PubChem are:
Chlorpyramin hydrochlorid [German], N-p-Chlorobenzyl-N',N'-dimethyl-N-2-pyridylethylenediamine hydrochloride, ETHYLENEDIAMINE, N-(p-CHLOROBENZYL)-N',N'-DIMETHYL-N-(2-PYRIDYL)-, HYDROCHLORIDE, N-p-Chlorbenzyl-N-alpha-pyridyl-N',N'-dimethyl-aethylendiamin-hydrochlorid [German], 59-32-5 (Parent), Chlorpyramine HCl, Chlorpyramin hydrochlorid, C16H20ClN3.HCl, AC1L18UL, N-p-Chlorbenzyl-N-alpha-pyridyl-N',N'-dimethyl-aethylendiamin-hydrochlorid, 10458-04-5, LS-68401, 2-[(4-chlorophenyl)methyl-pyridin-2-ylamino]ethyl-dimethylazanium chloride, Chloropyramine hydrochloride, 6170-42-9, Chloropyramine HCl, Alergosan, Nilfan, Allergan S hydrochloride, Chlorpiramin hydrochloride, Halopyramine hydrochloride, Chlorpyramin HCl, Chlorpyramine hydrochloride, UNII-FWA92Z14NN, Chloropyramine monohydrochloride, Chloropyribenzamine hydrochloride, FWA92Z14NN, MLS000028842, N1-(4-Chlorobenzyl)-N2,N2-dimethyl-N1-(pyridin-2-yl)ethane-1,2-diamine hydrochloride, SMR000058807, DSSTox_CID_28785, DSSTox_RID_83054, DSSTox_GSID_48859, Sinopen, Sinopen hydrochloride, Suprastin hydrochloride, SR-01000721869, NCGC00016672-01, NCGC00016672-04, CAS-6170-42-9, N'-[(4-chlorophenyl)methyl]-N,N-dimethyl-N'-pyridin-2-ylethane-1,2-diamine;hydrochloride, Prestwick_999, Avapena (TN), EINECS 228-216-2, NSC 409949, N-[(4-Chlorophenyl)methyl]-N',N'-dimethyl-N-2-pyridinyl-1,2-ethanediamine, chlorpyramin hydrochloride, Opera_ID_1968, G 12144, MLS001077290, MLS002222287, MLS006010746, SCHEMBL538104, AC1L2Z74, CHEMBL550011, DTXSID9048859, CTK8F8612, KS-00002WWA, MolPort-003-940-661, HMS1570B15, Pharmakon1600-01506064, HY-B1305, Tox21_113349, BDBM50015561, KM0536, NSC409949, NSC759320, AKOS015961969, Tox21_113349_1, API0001961, CCG-213982, CS-7974, H70C429, KS-5156, MCULE-9479121493, NSC-409949, NSC-759320, AC-12197, AK128947, BC209159, KB-76064, AX8021808, FT-0623695, ST51014943, D07679, SR-01000721869-2, SR-01000721869-3, W-105107, 2-[p-Chlorobenzyl-(2-dimethylaminoethyl)amino]pyridine hydrochloride, Chloropyramine hydrochloride, analytical standard, for drug analysis, [2-(dimethylamino)ethyl][(4-chlorophenyl)methyl]-2-pyridylamine, chloride, N-p-Chlorobenzyl-N',N'-dimethyl-N-(2-pyridyl)ethylenediamine hydrochloride, 1, N-[(4-chlorophenyl)methyl]-N',N'-dimethyl-N-2-pyridinyl-, monohydrochloride, N'-[(4-chlorophenyl)methyl]-N,N-dimethyl-N'-pyridin-2-ylethane-1,2-diamine hydrochloride, N\'-[(4-chlorophenyl)methyl]-N,N-dimethyl-N\'-pyridin-2-ylethane-1,2-diamine,hydrochloride, N1-(4-Chlorobenzyl)-N2,N2-dimethyl-N1-(pyridin-2-yl)ethane-1,2-diaminehydrochloride, Pyridine, 2-((p-chlorobenzyl)(2-(dimethylamino)ethyl)amino)-, monohydrochloride (8CI), 1,2-Ethanediamine, N-((4-chlorophenyl)methyl)-N',N'-dimethyl-N-2-pyridinyl-, monohydrochloride (9CI), N-p-Chlorobenzyl-N inverted exclamation marka,N inverted exclamation marka-dimethyl-N-(2-pyridyl)ethylenediamine, AKOS026749848


ID: 2312

chemical graph of compound 2312



InChIKey: VEZXCJBBBCKRPI-UHFFFAOYSA-N
SMILES: C1COC1=O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 2365
synonyms found at PubChem are:
beta-propiolactone, 2-Oxetanone, Propiolactone, 57-57-8, Oxetan-2-one, Propanolide, Betaprone, 3-Propanolide, 1,3-Propiolactone, 3-Propiolactone, beta-Propionolactone, beta-Propiolakton, Hydracrylic acid beta-lactone, Propiolactona, Propiolactonum, Propiolattone, .beta.-Propiolactone, beta-Propanoic acid lactone, beta-Proprolactone, 3-Hydroxypropionic acid lactone, Caswell No. 709, betapron, Propiolattone [DCIT], Propionolactone, Oxetanone, beta-Propiolakton [Czech], UNII-6RC3ZT4HB0, Propiolactonum [INN-Latin], NSC 21626, Propiolactona [INN-Spanish], CCRIS 536, .beta.-Proprolactone, HSDB 811, Propiolactone, beta-, BPL, Propiolactone [USAN:INN:BAN], .beta.-Propionolactone, Propiolactone .beta.-, 3-Hydroxypropionic acid beta-lactone, EINECS 200-340-1, EPA Pesticide Chemical Code 010901, BRN 0001360, 6RC3ZT4HB0, beta-lactone hydracrylic acid, Propanoic acid, 3-hydroxy-, beta-lactone, Propionic acid, 3-hydroxy-, beta-lactone, .beta.-Propanoic acid lactone, AI3-24257, Hydracrylic acid .beta.-lactone, 3-Hydroxypropionic acid, lactone, CHEBI:49073, VEZXCJBBBCKRPI-UHFFFAOYSA-N, NSC21626, NSC-21626, NCGC00090802-01, b-Propiolactone, oxetan-2one, 2-Oxooxetane, 2-Oxacyclobutanone, Betaprone (TN), beta3-Propiolactone, .beta.-Propiolakton, .beta.-Propriolactone, PubChem2546, Spectrum_000216, AC1L1DIN, AC1Q6HOK, Spectrum2_001982, Spectrum4_001274, WLN: T4OVTJ, DSSTox_CID_1197, D0Z8AA, EC 200-340-1, Propiolactone (USAN/INN), Hydracrylic acid |A-lactone, DSSTox_RID_76006, DSSTox_GSID_21197, KBioGR_001888, KBioSS_000696, 5-17-09-00003 (Beilstein Handbook Reference), Hydracrylic Acid beta Lactone, 57-57-8 oxetan-2-one, DivK1c_001003, SPECTRUM1503234, SPBio_002163, Hydracylic acid, .beta.lactone, beta-Propiolactone, 97% 1g, .beta.-lactone hydracrylic acid, Propanoic acid, .beta.-lactone, Propionic acid, .beta.-lactone, CHEMBL1200627, DTXSID8021197, CTK1G9546, HMS503I07, KBio1_001003, KBio2_000696, KBio2_003264, KBio2_005832, Hydracrylic acid, .beta.-lactone, beta-Hydroxypropionic Acid Lactone, MolPort-003-666-464, NINDS_001003, HMS1922K19, HMS2092P12, HT882, Pharmakon1600-01503234, BCP07366, ZINC1482154, Tox21_111026, ANW-41466, CCG-39865, LS-230, MFCD00005169, NSC758422, AKOS015906936, 3-Hydroxypropionic acid .beta.-lactone, DB09348, NE10380, NSC-758422, TRA0065015, Beta-PROPIOLACTONE (2-OXETANONE), beta-Propiolactone, Grade II, >=90%, CAS-57-57-8, IDI1_001003, Beta-PROPIOLACTONE (2 -OXETANONE), NCGC00090802-02, NCGC00090802-03, AN-41727, SC-05460, SBI-0051797.P002, DB-003748, KB-174014, TR-031896, AM20020040, FT-0622937, Propanoic acid, 3-hydroxy-, .beta.-lactone, Propionic acid, 3-hydroxy-, .beta.-lactone, C19297, D05630, 55444-EP2374895A1, AB00052333_02, SR-05000001970, InChI=1/C3H4O2/c4-3-1-2-5-3/h1-2H, SR-05000001970-1, I14-20462


ID: 2313

chemical graph of compound 2313



InChIKey: VFBCRODCTUZSIA-IITZXRADSA-N
SMILES: CC(=O)O[C@H]1[C@@]2(CC3=C4CC(=O)O[C@H]([C@@]4(CCC3[C@@](C2OC(=O)C)([C@H](C1(C)C)CC(=O)OC)C)C)C5=COC=C5)OC(=O)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6710696
synonyms found at PubChem are:
KBio2_007406, Spectrum_001785, KBioSS_002271, KBio2_002270, KBio2_004838, 2-DIHYDROFISSINOLIDE ACETATE


ID: 2314

chemical graph of compound 2314



InChIKey: VFENFLGNSRQELY-RFPFOJJUSA-N
SMILES: C1CCN[C@@H](C1)C2CC(C3CCCCN3C2)C(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6710683
synonyms found at PubChem are:
APHYLLIC ACID, Spectrum_001504, AC1O8JWI, Spectrum2_000725, Spectrum3_001636, Spectrum4_001677, Spectrum5_000613, BSPBio_003331, KBioGR_002233, KBioSS_001984, SPBio_000650, CHEMBL3039242, KBio2_001984, KBio2_004552, KBio2_007120, KBio3_002551, NCGC00178135-01, 3-[(2S)-piperidin-2-yl]-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine-1-carboxylic acid


ID: 2315

chemical graph of compound 2315



InChIKey: VFMMPHCGEFXGIP-UHFFFAOYSA-N
SMILES: C1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C4=CC=CC=C4C=C3

biological descriptors:

CFTR relevance: effective CFTR activator

Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown

reference list:

"MH Nantz" "LJ Galietta" "K By" "EJ Niedzinski" "M Eda" "MF Springsteel" "MJ Haddadin" "MJ Kurth" "AS Verkman"


CID is 11790
synonyms found at PubChem are:
7,8-Benzoflavone, alpha-Naphthoflavone, 604-59-1, 2-Phenyl-4H-benzo[h]chromen-4-one, alpha-Naphthylflavone, 2-phenylbenzo[h]chromen-4-one, Benzo(h)flavone, 7,8-BF, 4H-Naphtho[1,2-b]pyran-4-one, 2-phenyl-, .alpha.-Naphthoflavone, 2-Phenyl-benzo[h]chromen-4-one, 2-Phenyl-4H-naphtho(1,2-b)pyran-4-one, CCRIS 3607, 2-Phenylbenzo(h)chromen-4-one, EINECS 210-071-1, NSC 407011, BRN 0210862, benzo[h]flavone, MLS003171601, CHEMBL283196, CHEBI:76995, VFMMPHCGEFXGIP-UHFFFAOYSA-N, 4H-NAPHTHO(1,2-b)PYRAN-4-ONE, 2-PHENYL-, N-1500, Naphthoflavon, Alpha-Naphtoflavone, BHF, Alpha-Naphtholflavone, PubChem9838, 7,8 - Benzoflavone, .alpha.-Naphthylflavone, D0I7GE, 7,8-Benzoflavone (7CI), Oprea1_054595, Oprea1_802803, 4H-Naphtho[1, 2-phenyl-, 5-17-10-00726 (Beilstein Handbook Reference), BIDD:ER0569, SCHEMBL121594, AC1L1Y50, DTXSID2040650, ZINC38933, MolPort-001-759-204, TNP00080, ZX-AT002210, ANF,2-phenylbenzo[h]chromen-4-one, 9008AB, BDBM50014323, MFCD00004985, NSC407011, OR1158, 2-phenyl-4-benzo[h][1]benzopyranone, AKOS000505579, DB07453, MCULE-2454889877, NSC-407011, PS-7270, TRA0030110, 2-Phenyl-4H-benzo[h]chromen-4-one #, KS-0000021Y, NCGC00017210-01, NCGC00017210-02, NCGC00142408-01, AJ-08808, AK122395, AN-21598, BAS 07630283, CC-24019, LS-95578, SMR000112233, ST055359, ZB001073, AX8113561, 4CH-024804, B0056, FT-0622183, ST24041007, A832737, C-34092, I14-51343


ID: 2316

chemical graph of compound 2316



InChIKey: VFPOVCXWKBYDNF-UHFFFAOYSA-N
SMILES: CN1C=C(N=C1C2=CC=C(C=C2)OCC(CNCCOC3=CC(=C(C=C3)O)C(=O)N)O)C(F)(F)F.CS(=O)(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 10008573
synonyms found at PubChem are:
CGP 20712A methanesulfonate, 105737-62-0, CGP-20712A methanesulfonate salt, SR-01000076208, cgp20712amethansulfonatesalt, MLS001056797, SCHEMBL5487355, CHEMBL1256955, AOB5539, DTXSID90434017, MolPort-003-940-677, HMS2235M14, HMS3261I09, HMS3371L20, Tox21_500364, BN0131, AKOS032953954, CCG-221668, LP00364, NCGC00016121-02, NCGC00093798-01, NCGC00261049-01, SMR000326979, LS-193326, C-231, EU-0100364, SR-01000076208-1, CGP-20712A methanesulfonate salt, solid, >=98% (HPLC), ( inverted exclamation markA)-2-Hydroxy-5-[2-[[2-hydroxy-3-[4-[1-methyl-4-(trifluoromethyl)-1H-imidazol-2-yl]phenoxy]propyl] amino]ethoxy]-benzamide methanesulfonate salt, (+/-)-2-Hydroxy-5-[2-[[2-hydroxy-3-[4-[1-methyl-4-(trifluoromethyl)-1H-imidazol-2-yl]phenoxy]propyl]amino]ethoxy]-benzamide methanesulfonate, Benzamide, 2-hydroxy-5-(2-((2-hydroxy-3-(4-(1-methyl-4-(trifluoromethyl)-1H-imidazol-2-yl)phenoxy)propyl)amino)ethoxy]-, monomethanesulfonate (salt)


ID: 2317

chemical graph of compound 2317



InChIKey: VFQVOTVAPPYKEC-UHFFFAOYSA-N
SMILES: CC(=O)OC1=CC(=CC(=C1OC(=O)C)OC(=O)C)C2=COC3=CC(=C(C(=C3C2=O)OC(=O)C)OC(=O)C)OC(=O)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3505890
synonyms found at PubChem are:
IRIGINOL HEXAACEATATE, KBio2_000874, Spectrum_000394, SpecPlus_000026, AC1MQQF1, Spectrum2_000400, Spectrum3_000267, Spectrum4_001559, Spectrum5_000158, BSPBio_001714, KBioGR_002058, KBioSS_000874, SPECTRUM211012, DivK1c_006122, SPBio_000619, CHEMBL1440119, SCHEMBL13287286, KBio1_001066, KBio2_003442, KBio2_006010, KBio3_001214, CCG-38671, AKOS027324332, SDCCGMLS-0066468.P001, NCGC00095530-01, NCGC00095530-02, NCGC00179065-01, SR-05000002752, SR-05000002752-1, [2,3-diacetyloxy-5-(5,6,7-triacetyloxy-4-oxochromen-3-yl)phenyl] acetate


ID: 2318

chemical graph of compound 2318



InChIKey: VFTRKSBEFQDZKX-UHFFFAOYSA-N
SMILES: C1=CC=C2C(=C1)C(=CN2)CC3=CNC4=CC=CC=C43

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3071
synonyms found at PubChem are:
3,3'-Diindolylmethane, 1968-05-4, di(1H-indol-3-yl)methane, diindolylmethane, 3,3'-Methylenediindole, 3,3'-Methylenebis-1H-indole, DIM, 1H-Indole, 3,3'-methylenebis-, 3,3'-Di-indolylmethane, 3-Diindolyl methane, ARUNDINE, 3,3'-methylenebis(1H-indole), 3,3-Diindolylmethane, 3,3'-Diindolymethane, UNII-SSZ9HQT61Z, SSZ9HQT61Z, 3-(1H-indol-3-ylmethyl)-1H-indole, bis-1H-indol-3-ylmethane, BIS(3-INDOLYL)METHANE, CCRIS 5806, CHEBI:50182, 3,3'-methanediylbis(1H-indole), VFTRKSBEFQDZKX-UHFFFAOYSA-N, 3,3,-diindolylmethane, D-3720, Infemin, Plant Indole, Di-3-indolylmethane, NSC708486, PubChem8119, 3,3-Methylenediindole, 3,3/'-Diindolylmethane, Spectrum2_001711, Spectrum3_001989, Spectrum5_001955, AC1L1F3Z, AC1Q28LK, CBiol_001839, Oprea1_472633, Oprea1_740951, BSPBio_001290, BSPBio_003589, CBDivE_010856, KBioGR_000010, KBioSS_000010, MLS006011847, SCHEMBL325162, SPECTRUM1505331, SPBio_001722, ACMC-20976o, 3,3'-di(indol-3-yl)methane, BML3-F11, CHEMBL446452, 3,3'-Diindolylmethane (DIM), 3,3'-METHYLENEBISINDOLE, DTXSID8037047, CTK5J6945, KBio2_000010, KBio2_002578, KBio2_005146, KBio3_000019, KBio3_000020, KBio3_003002, KS-00000NOQ, MolPort-001-815-286, Bio1_000125, Bio1_000614, Bio1_001103, Bio2_000010, Bio2_000490, HMS1361A12, HMS1791A12, HMS1989A12, HMS3402A12, ZINC187911, 3,3'-diindolylmethane, AldrichCPR, ACT06989, ALBB-016048, BCP00470, ZX-AN014753, ANW-13582, BBL015828, BN0879, CCG-39861, CD-276, GR-207, HB 236, HSCI1_000069, MFCD00195766, s4728, STK263696, AKOS003627372, AM84671, CHM0022567, CS-1652, DB11875, KS-5266, MCULE-3718375492, NSC-708486, RL02473, RTR-009133, IDI1_033760, NCGC00095348-01, NCGC00095348-02, NCGC00095348-03, NCGC00095348-04, NCGC00095348-05, NCGC00095348-06, NCGC00095348-07, AC-11611, AJ-17733, AK-45887, HY-15758, NCI60_038418, SC-19468, SMR001828114, 3,3'-Diindolylmethane, >=98% (HPLC), 3,3'-Diindolylmethane, analytical standard, AB1008418, AX8008848, LS-173787, ST2406774, TR-009133, FT-0614061, M1399, A15023, M-1632, 4,5-Diphenyl-2-(2-methoxyphenyl)-1H-imidazole, 968D054, C-15017, I06-1549, BRD-K37846922-001-05-2, BRD-K37846922-001-06-0, BRD-K37846922-001-09-4, DIM; 3,3'-Methylene-bisindole; di-3-Indolylmethane, 3,3'-Diindolylmethane; 1H-Indole,3,3'-methylenebis-, C444299000


ID: 2319

chemical graph of compound 2319



InChIKey: VGEMBOFBPSNOIO-UHFFFAOYSA-N
SMILES: CN1C=CC2=CC3=C(CCN3C(=O)NC4=CN=CC=C4)C=C21.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 11957707
synonyms found at PubChem are:
SB 206553 hydrochloride, N-3-Pyridinyl-, 1197334-04-5, NCGC00094422-01, DSSTox_CID_22622, DSSTox_RID_80061, DSSTox_GSID_42622, CAS-1197334-04-5, SR-01000075586, EU-0101163, SB206553 Hydrochloride, CHEMBL1256921, DTXSID4042622, SCHEMBL10321748, AOB5061, MolPort-003-959-512, Tox21_111278, Tox21_501163, BN0666, AKOS024456731, Tox21_111278_1, CCG-222467, LP01163, NCGC00015917-06, NCGC00261848-01, 3,5-DIHYDRO-5-METHYL-N-3-PYRIDINYLBENZO[1,2-B:4,5-B']DIPYRROLE-1(2H)-CARBOXAMIDE HYDROCHLORIDE, S-180, J-009550, SR-01000075586-1, SR-01000075586-3, 3,5-dihydro-5-methyl-benzo[1,2-b:4,5-b']dipyrrole-1(2H)-carboxamide hydrochloride, 5-Methyl-1-(3-pyridylcarbamoyl)-1,2,3,5-tetrahydropyrrolo[2,3-f]indole hydrochloride, 5-methyl-N-pyridin-3-yl-3,5-dihydropyrrolo[2,3-f]indole-1(2H)-carboxamide hydrochloride


ID: 2320

chemical graph of compound 2320



InChIKey: VGEOUKPOQQEQSX-OALZAMAHSA-M
SMILES: CC(=O)OCC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)CSC3=CC=NC=C3)SC1)C(=O)[O-].[Na+]

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 441388
synonyms found at PubChem are:
CEPHAPIRIN SODIUM, cefapirin sodium, Sodium cefapirin, 24356-60-3, Sodium cephapirin, UNII-431LFF7I7J, Cefatrexyl, Ambrocef, Cefadyl, Cefatrex, Cefapirin sodium salt, Sodium 7-(pyrid-4-ylthioacetamido)cephalosporanate, Cephapirin sodium salt, Brisfirina, Cephatrexyl, Brisporin, Bristocef, 431LFF7I7J, CHEBI:3545, Cefadyl IM/IV, BL-P-1322, Cefa-Lak (Veterinary), BLP 1322, 7-(alpha-(4-Pyridylthio)acetamido)cephalosporanic acid sodium salt, Cefadyl (TN), Antibiotic BL-P 1322, BL-P 1322, DSSTox_CID_25574, DSSTox_RID_80971, DSSTox_GSID_45574, EINECS 246-194-2, ANTIBIOTIC BL-P1322, Cefapirina sodica, NSC 179171, (7R,7aR)-3-(acetyloxymethyl)-6-oxo-7-(2-(4-pyridylthio)acetylamino)-2H,7H-azet idino[2,1-b]1,3-thiazine-4-carboxylic acid, sodium salt, 3-[(Acetyloxy)methyl]-8-oxo-7-{(4-pyridinylthio)acetyl]amino}-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid monosodium salt, Sodium (6R-trans)-3-(acetoxymethyl)-8-oxo-7-((4-pyridylthio)acetamido)-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylate, 356C603, Cephapirin sodium [USAN:USP], Prestwick_27, NCGC00017093-01, Monosodium (6R,7R)-3-(hydroxymethyl)-8-oxo-7-(2-(4-pyridylthio)acetamido)-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylate acetate (ester), CAS-24356-60-3, Cefapirin sodium (JAN), Cephapirin sodium (USP), Cephapirin sodium, >=96%, SCHEMBL64430, SPECTRUM1500167, CHEMBL1201043, DTXSID7045574, HMS500C04, HMS1570L03, HMS1920K13, HMS2091A16, 21593-23-7 (Parent), 5-Thia-1-azabicyclo(4,2,0)oct-2-ene-2-carboxylic acid, 3-(hydroxymethyl)-8-oxo-7-(2-(4-pyridylthio)acetamido)-, acetate (ester), monosodium salt, 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 3-((acetyloxy)methyl)-8-oxo-7-(((4-pyridylthio)acetyl)amino)-, monosodium salt, (6R-trans)-, Tox21_110772, CCG-38912, Cefapirin sodium, analytical standard, AKOS024282660, AKOS032953845, Tox21_110772_1, API0000458, NCGC00093735-01, NCGC00162116-04, ST057376, EU-0100279, FT-0603005, C 8270, C08101, D00908, Cefapirin sodium, European Pharmacopoeia (EP) Reference Standard, Cephapirin sodium, United States Pharmacopeia (USP) Reference Standard, (6R,7R)-3-[(Acetyloxy)methyl]-8-oxo-7-[[(4-pyridinylthio)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid sodium, (6R-trans)-3-((acetyloxy)methyl)-8-oxo-7-(((4-pyridylthio)acetyl)amino)-5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid monosodium salt, monosodium (6R,7R)-3-(hydroxymethyl)-8-oxo-7-(2-(4-pyridylthio)acetamido)-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylate acetate, Sodium (6R,7R)-3-(acetyloxymethyl)-8-oxo-7-[(2-pyridin-4-ylsulfanylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate, sodium (6R,7R)-3-[(acetyloxy)methyl]-8-oxo-7-{[(pyridin-4-ylsulfanyl)acetyl]amino}-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate, sodium;(6R,7R)-3-(acetyloxymethyl)-8-oxo-7-[(2-pyridin-4-ylsulfanylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate


ID: 2321

chemical graph of compound 2321



InChIKey: VGEREEWJJVICBM-UHFFFAOYSA-N
SMILES: C1=CC(=CC=C1CCC(=O)C2=C(C=C(C=C2O)O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 4788
synonyms found at PubChem are:
phloretin, 60-82-2, 3-(4-Hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)propan-1-one, Dihydronaringenin, Phloretol, 3-(4-Hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)-1-propanone, NSC 407292, UNII-S5J5OE47MK, 1-Propanone, 3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)-, CCRIS 7459, beta-(p-Hydroxyphenyl)phloropropiophenone, 2',4',6'-Trihydroxy-3-(p-hydroxyphenyl)propiophenone, EINECS 200-488-7, NSC407292, S5J5OE47MK, beta-(p-Hydroxyphenyl)-2,4,6-trihydroxypropiophenone, CHEMBL45068, 2',4',6'-Trihydroxy-3-(4-Hydroxyphenyl)propiophenone, CHEBI:17276, VGEREEWJJVICBM-UHFFFAOYSA-N, IN1154, beta-(4-Hydroxyphenyl)-2,4,6-trihydroxypropiophenone, Propiophenone, 2',4',6'-trihydroxy-3-(p-hydroxyphenyl)-, .beta.-(p-Hydroxyphenyl)phloropropiophenone, Q-100701, 2&prime;,4&prime;,6&prime;-Trihydroxy-3-p-hydroxyphenylpropiophenone, SMR000326783, SR-01000076081, 2uxi, b-(p-hydroxyphenyl)phloropropiophenone, Spectrum_001295, 4,2',4',6'-Tetrahydroxydihydrochalcone, Phloretin, >=99%, ACMC-209mmd, SpecPlus_000333, AC1L1IYH, Spectrum2_000681, Spectrum3_001036, Spectrum4_001172, Spectrum5_001698, Lopac-P-7912, DSSTox_CID_2393, D0HD2G, AC1Q5D4U, cid_4788, DSSTox_RID_76569, DSSTox_GSID_22393, Lopac0_001012, Oprea1_824722, REGID_for_CID_4788, SCHEMBL38131, BSPBio_002851, KBioGR_001803, KBioSS_001775, SPECTRUM300554, MLS000728507, MLS000859922, MLS006012024, BIDD:ER0174, DivK1c_006429, SPBio_000801, GTPL4285, DTXSID6022393, BCBcMAP01_000040, BDBM23446, CTK3J2061, KBio1_001373, KBio2_001775, KBio2_004343, KBio2_006911, KBio3_002071, ZINC47553, MolPort-002-497-754, HMS2224N17, HMS3263K05, HMS3332J03, HMS3656I07, ACN-S003569, BCP28296, HY-N0142, KS-00000C3P, TNP00255, Tox21_202854, Tox21_501012, ANW-33587, BBL027375, CCG-38573, CP0082, KM0437, LMPK12120525, MFCD00002288, O1P165, s2342, SBB066137, STL372996, AKOS015856338, AC-7995, ACN-035397, AN-8416, CS-1477, DB07810, LP01012, MCULE-3672992389, NSC-407292, RTR-031371, SDCCGMLS-0066637.P001, TRA0006136, CAS-60-82-2, Phloretin, analytical reference material, SMP1_000238, NCGC00015840-01, NCGC00015840-02, NCGC00015840-03, NCGC00015840-04, NCGC00015840-05, NCGC00015840-06, NCGC00015840-07, NCGC00015840-08, NCGC00015840-09, NCGC00094304-01, NCGC00094304-02, NCGC00094304-03, NCGC00094304-04, NCGC00260400-01, NCGC00261697-01, 2',4,4',6'-Tetrahydroxydihydrochalcone, AK162403, AS-14100, CC-33738, CJ-00285, SC-18405, ST057164, SY017103, ZB001420, 2',4,4',6'-Tetrahydroxy-Dihydrochalcone, AB0016775, AX8147786, DB-053714, LS-187222, LS-188085, TR-031371, EU-0101012, FT-0603256, N1316, P1966, ST24041477, C00774, P 7912, C-17278, 2',6'-Trihydroxy-3-(p-hydroxyphenyl)propiophenone, I06-0546, SR-01000076081-1, SR-01000076081-7, SR-01000076081-8, .beta.-(p-Hydroxyphenyl)-2,6-trihydroxypropiophenone, BRD-K15563106-001-02-4, BRD-K15563106-001-10-7, Propiophenone,4',6'-trihydroxy-3-(p-hydroxyphenyl)-, .beta.-(p-Hydroxyphenyl)-2,4,6-trihydroxypropiophenone, 2',4',6'-Trihydroxy-3-(4-hydroxyphenyl)-propiophenone, 1-(2,4,6-trihydroxyphenyl)-3-(4-hydroxyphenyl)-1-propanone, 3-(4-Hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)-1-propanon, 3-[4-Hydroxyphenyl]-1-[2,4,6- trihydroxyphenyl]-1-propanone, 3-(4-Hydroxy-phenyl)-1-(2,4,6-trihydroxy-phenyl)-propan-1-one, Propiophenone, 2',4',6'-trihydroxy-3-(p-hydroxyphenyl)- (8CI), G50, InChI=1/C15H14O5/c16-10-4-1-9(2-5-10)3-6-12(18)15-13(19)7-11(17)8-14(15)20/h1-2,4-5,7-8,16-17,19-20H,3,6H


ID: 2322

chemical graph of compound 2322



InChIKey: VGFORKADSOHYJT-XFAJBIDRSA-N
SMILES: C1CN2[C@@H]([C@H]([C@@H]([C@H]2[C@H]1O)O)O)CO.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 24721273
synonyms found at PubChem are:
Australine, AUSTRALINE HYDROCHLORIDE, Australine HCl, (+)-Australine hydrochloride, CHEMBL2163789, CCG-208157, W-201675


ID: 2323

chemical graph of compound 2323



InChIKey: VGKDLMBJGBXTGI-SJCJKPOMSA-N
SMILES: CN[C@H]1CC[C@H](C2=CC=CC=C12)C3=CC(=C(C=C3)Cl)Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 68617
synonyms found at PubChem are:
sertraline, 79617-96-2, (1S,4S)-4-(3,4-dichlorophenyl)-N-methyl-1,2,3,4-tetrahydronaphthalen-1-amine, Sertralina, Sertralinum, (+)-Sertraline, Lustral, Zoloft, Sertralinum [Latin], Sertralina [Spanish], Apo-Sertraline, Sertraline [INN:BAN], Cp 51974, UNII-QUC7NX6WMB, Sertraline (INN), sertraline (Zoloft), (1S-cis)-1,2,3,4-Tetrahydro-4-(3,4-dichlorophenyl)-N-methyl-1-naphthalenamine, Sertraline [Zoloft], cis-(+)-sertraline, HSDB 7037, (1S,4S)-sertraline, QUC7NX6WMB, CHEMBL809, BRN 5753709, CHEBI:9123, VGKDLMBJGBXTGI-SJCJKPOMSA-N, Zoloft (TN), TBA-2010_Sertraline_1, C17H17Cl2N, (1S,4S)-4-(3,4-dichlorophenyl)-N-methyl-tetralin-1-amine, MLS001401398, 1-Naphthalenamine, 1,2,3,4-tetrahydro-4-(3,4-dichlorophenyl)-N-methyl-, (1S-cis)-, 1-Naphthalenamine, 4-(3,4-dichlorophenyl)-1,2,3,4-tetrahydro-N-methyl-, (1S,4S)-, SMR000596516, SRE, NCGC00092386-03, SMR000466298, CP-519741, Lustral (TN), PubChem5865, AC1Q3XJU, (1S,4S)-4-(3,4-dichlorophenyl)-N-methyl-1,2,3,4-tetrahydronaphthalen-1-amine;hydrochloride, 79617-95-1, Prestwick3_001014, Spectrum2_000493, Spectrum3_001079, Spectrum4_001232, D0K0TC, AC1Q3O5N, BIDD:PXR0193, SCHEMBL28701, BSPBio_001167, BSPBio_002698, KBioGR_001724, cid_63009, MLS001195647, MLS002222308, BIDD:GT0768, REGID_for_CID_68617, SPBio_000385, AC1L2A41, BPBio1_001285, GTPL4798, DTXSID6023577, BDBM79021, CTK8B7684, KBio3_001918, cp-51974, HMS2098K09, HMS2231I09, HMS3715K09, 79559-97-0 (Hydrochloride), ZINC1853550, ANW-58187, BDBM50028094, NCGC00092386, API0004164, CCG-221014, DB01104, MCULE-4360779618, 1-Naphthalenamine,1,2,3,4-tetrahydro-4-(3,4-dichlorophenyl)-N-methyl-, (1S-cis)-, NCGC00092386-04, NCGC00092386-05, NCGC00092386-06, NCGC00092386-07, NCGC00092386-08, NCGC00092386-09, NCGC00092386-10, AC-15639, AJ-32109, AN-36575, BC209359, CC-34407, LS-94179, SC-16114, SBI-0206734.P001, AB1004870, AX8034967, TR-025284, AB00514002, FT-0081122, FT-0630872, C-4401, C07246, D02360, EN300-150167, 4-(3,4-Dichlorophenyl)-1,2,3,4-Tetrahydro-, AB00514002_17, AB00514002_18, 617S962, A839725, C-19042, SR-01000759296, SR-01000759296-5, BRD-K82036761-003-02-1, BRD-K82036761-003-07-0, BRD-K82036761-003-20-3, [(1S,4S)-4-(3,4-dichlorophenyl)tetralin-1-yl]-methyl-amine;hydrochloride, syn-4-(3,4-dichlorophenyl)-N-methyl-1,2,3,4-tetrahydronaphthalen-1-amine, (1S-cis)-4-(3,4-Dichlorophenyl)-1,2,3,4-tetrahydro-N-methyl-1-naphthalenamine, (1S-cis)-4-(3,4-dichlorophenyl)-1,2,3,4-tetrahydro-N-methyl-naphthalenamine, (1S-cis)-4-(3,4-Dichlorophenyl)-1,2,3,4-tetrahydro-N-methyl-1-naphthalenamine; (+)-Sertraline; Sertraline, Zoloft, Lustral, Daxid, Altruline, Besitran, Deprax, Elrval, Emergen, Gladem, Implicane, Sedoran, Sealdin, SerivoLowfin, Stimuloton, Tresleen, Sertralin Bluefish


ID: 2324

chemical graph of compound 2324



InChIKey: VGLGVJVUHYTIIU-UHFFFAOYSA-N
SMILES: C=CCSCC1NC2=CC(=C(C=C2S(=O)(=O)N1)S(=O)(=O)N)Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 2122
synonyms found at PubChem are:
althiazide, Altizide, 5588-16-9, Altizida, Althizide, Altizid, UNII-D9KLS88BLV, UNII-JI3ZO158IN, Althiazide [USAN], D9KLS88BLV, JI3ZO158IN, 6-CHLORO-3,4-DIHYDRO-3-[(2-PROPENYLTHIO)METHYL]-2H-1,2,4-BENZOTHIADIAZINE-7-SULFONAMIDE 1,1-DIOXIDE, Altizide (INN), Altizide [INN], Althiazide (USAN), NCGC00094855-01, P-1779, DSSTox_CID_25857, DSSTox_RID_81178, DSSTox_GSID_45857, Altizidum, 2H-1,2,4-Benzothiadiazine-7-sulfonamide,6-chloro-3,4-dihydro-3-[(2-propen-1-ylthio)methyl]-, 1,1-dioxide, 3-((Allylthio)methyl)-6-chloro-3,4-dihydro-2H-1,2,4-benzothiadiazine-7-sulfonamide 1,1-dioxide, 3-((Allylthio)methyl)-6-chloro-3,4-dihydro-2H-benzo[e][1,2,4]thiadiazine-7-sulfonamide 1,1-dioxide, 3-[(Allylthio)methyl]-6-chloro-3,4-dihydro-2H-1,2,4-benzothiadiazine-7-sulfonamide 1,1-Dioxide, (+)-Altizide, (-)-Altizide, Altizide, (+)-, Altizide, (-)-, Altizidum [INN-Latin], SR-05000001753, Altizida [INN-Spanish], racemic althiazide, Prestwick_43, CAS-5588-16-9, EINECS 226-994-8, CB 8093, Spectrum_001104, SpecPlus_000833, AC1L1CYU, Prestwick0_000721, Prestwick1_000721, Prestwick2_000721, Prestwick3_000721, Spectrum2_001367, Spectrum3_000902, Spectrum4_000999, Spectrum5_001725, P 1779, AC1Q6TQ5, BSPBio_000642, KBioGR_001437, KBioSS_001584, MLS002153973, DivK1c_001031, DivK1c_006929, SCHEMBL124525, SPECTRUM1500804, SPBio_001294, SPBio_002581, BPBio1_000708, CHEMBL599870, DTXSID3045857, CHEBI:91768, CTK5A4322, HMS503O03, KBio1_001031, KBio1_001873, KBio2_001584, KBio2_004152, KBio2_006720, KBio3_001844, NINDS_001031, HMS1570A04, HMS1921I12, HMS2092K18, HMS2097A04, HMS2233O21, HMS3373K04, HMS3714A04, Pharmakon1600-01500804, Tox21_111347, CCG-38982, NSC757786, AKOS027381757, Tox21_111347_1, AN-6778, API0007933, NSC-757786, 3-Allylthiomethyl-6-chlor-3,4-dihydro-2H-1,2,4-benzothiadiazin-7-sulfonamid 1,1-dioxid, IDI1_001031, SMP1_000012, NCGC00094855-02, NCGC00094855-03, NCGC00094855-06, 133562-97-7, 133585-76-9, 2H-1,2,4-Benzothiadiazine-7-sulfonamide, 6-chloro-3,4-dihydro-3-((2-propen-1-ylthio)methyl)-, 1,1-dioxide, (+)-, 2H-1,2,4-Benzothiadiazine-7-sulfonamide, 6-chloro-3,4-dihydro-3-((2-propen-1-ylthio)methyl)-, 1,1-dioxide, (-)-, 2H-1,2,4-Benzothiadiazine-7-sulfonamide, 6-chloro-3,4-dihydro-3-((2-propenylthio)methyl)-, 1,1-dioxide, 3-[(allylsulfanyl)methyl]-6-chloro-3,4-dihydro-2h-1,2,4-benzothiadiazine-7-sulfonamide 1,1-dioxide, CC-24032, SC-97384, SMR001233310, SBI-0052594.P002, KB-199317, AB00053099, FT-0635778, D02838, AB00053099_08, C-25724, SR-05000001753-1, SR-05000001753-3, BRD-A56675431-001-04-0, BRD-A56675431-001-07-3, Altizide, European Pharmacopoeia (EP) Reference Standard, 6-chloro-1,1-dioxo-3-(prop-2-enylsulfanylmethyl)-3,4-dihydro-2H-1, 6-Chloro-3,4-dihydro-3-((2-propenylthio)methyl)-2H-1,2,4-benzothiadiazine-7-sulfonamide, 3-(allylsulfanylmethyl)-6-chloro-1,1-dioxo-3,4-dihydro-2H-1$l^{6},2,4-benzothiadiazine-7-sulfonamide, 6-chloro-1,1-dioxo-3-(prop-2-enylsulfanylmethyl)-3,4-dihydro-2H-1?^{6},2,4-benzothiadiazine-7-sulfonamide, 6-chloro-1,1-dioxo-3-[(prop-2-enylthio)methyl]-3,4-dihydro-2H-1$l;{6},2,4-benzothiadiazine-7-sulfonamide, 6-Chloro-3,4-dihydro-3-[(2-propen-1-ylthio)methyl]-2H-1,2,4-benzothiadiazine-7-sulfonamide 1,1-Dioxide


ID: 2325

chemical graph of compound 2325



InChIKey: VGZSUPCWNCWDAN-UHFFFAOYSA-N
SMILES: CC(=O)C1=CC=C(C=C1)S(=O)(=O)NC(=O)NC2CCCCC2

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 1989
synonyms found at PubChem are:
acetohexamide, 968-81-0, Dymelor, Acetohexamid, Gamadiabet, Dimelor, Hypoglicil, Metaglucina, Tsiklamid, Dimelin, Minoral, Ordimel, Acetohexamida, Acetohexamidum, N-(p-Acetylphenylsulfonyl)-N'-cyclohexylurea, Acetohexamidum [INN-Latin], Acetohexamida [INN-Spanish], 1-((p-Acetylphenyl)sulfonyl)-3-cyclohexylurea, ord imel, CCRIS 4, NCI-C03247, UNII-QGC8W08I6I, 1-(4-acetylphenyl)sulfonyl-3-cyclohexylurea, 1-(p-Acetylbenzenesulfonyl)-3-cyclohexylurea, Dymelor (TN), U-14812, dimelin (antidiabetic), HSDB 3280, 4-Acetyl-N-((cyclohexylamino)carbonyl)benzenesulfonamide, 4-Acetyl-N-[(cyclohexylamino)carbonyl]benzenesulfonamide, Benzenesulfonamide, 4-acetyl-N-[(cyclohexylamino)carbonyl]-, Acetohexamide [USAN:INN:BAN:JAN], EINECS 213-530-4, U 14812, BRN 2225115, QGC8W08I6I, Benzenesulfonamide, 4-acetyl-N-((cyclohexylamino)carbonyl)-, 3-(4-acetylbenzenesulfonyl)-1-cyclohexylurea, C15H20N2O4S, CHEBI:28052, N-(p-Acetylbenzenesulfonyl)-N'-cyclohexylurea, 4-Acetyl-N-[(cyclohexylamino)-carbonyl]benzenesulfonamide, DSSTox_CID_7, NCGC00015014-05, CAS-968-81-0, 3-cyclohexyl-1-(p-acetylphenylsulfonyl)urea, A-178, 1-[(p-Acetylphenyl)sulfonyl]-3-cyclohexylurea, DSSTox_RID_75319, 4-acetyl-N-(cyclohexylcarbamoyl)benzenesulfonamide, DSSTox_GSID_20007, Urea, 1-((p-acetylphenyl)sulfonyl)-3-cyclohexyl-, Urea, 1-[(p-acetylphenyl)sulfonyl]-3-cyclohexyl-, 4-acetyl-N-((cyclohexylamino)carbonyl)benzenesulf onamide, SR-01000075539, Prestwick_3, Acetohexamide [USAN), Acetohexamide [USAN:USP:INN:BAN:JAN], Lopac-A-178, AC1L1COE, Acetohexamide Lilly Brand, Prestwick0_000055, Prestwick1_000055, Prestwick2_000055, Prestwick3_000055, Acetohexamide Salvat Brand, D07WFK, CHEMBL1589, Lilly Brand of Acetohexamide, Lopac0_000088, SCHEMBL37620, BSPBio_000209, MLS002154186, Salvat Brand of Acetohexamide, SPBio_002130, BPBio1_000231, GTPL6793, DTXSID7020007, CTK8F7520, Acetohexamide (JP15/USP/INN), Acetohexamide (JP17/USP/INN), Acetohexamide, analytical standard, MolPort-003-666-680, VGZSUPCWNCWDAN-UHFFFAOYSA-N, HMS1568K11, HMS2093H21, HMS2095K11, HMS2236M07, HMS3260A18, HMS3372B02, HMS3712K11, Pharmakon1600-01505425, HY-B0881, KS-00001F9N, Tox21_110067, Tox21_202022, Tox21_302735, Tox21_500088, MFCD00072156, NSC759128, ZINC18067894, AKOS015916290, Tox21_110067_1, API0002381, CCG-204183, DB00414, LP00088, LS-2019, MCULE-3744173137, NSC-759128, VZ31185, NCGC00015014-01, NCGC00015014-02, NCGC00015014-03, NCGC00015014-04, NCGC00015014-06, NCGC00015014-07, NCGC00015014-08, NCGC00015014-11, NCGC00016555-01, NCGC00091230-01, NCGC00091230-02, NCGC00091230-03, NCGC00091230-04, NCGC00256467-01, NCGC00259571-01, NCGC00260773-01, CC-23668, SC-70790, SMR001233477, SBI-0050076.P002, EU-0100088, FT-0661053, 1-(4-acetylbenzenesulfonyl)-3-cyclohexylurea, 1-(4-acetylphenyl)sulfonyl-3-cyclohexyl-urea, 1-cyclohexyl-3-(4-ethanoylphenyl)sulfonyl-urea, C06806, D00219, 1-[(4-acetylbenzene)sulfonyl]-3-cyclohexylurea, A845651, C-19808, SR-01000075539-1, SR-01000075539-3, SR-01000075539-6, 4-acetyl-N-(cyclohexylcarbamoyl)benzene-1-sulfonamide, BRD-K52960356-001-03-1, BRD-K52960356-001-06-4, I14-51513, Z1558572527, 4-Acetyl-N-[(cyclohexylamino)- carbonyl]benzenesulfonamide, 1-Acetyl-4-(([(cyclohexylamino)carbonyl]amino)sulfonyl)benzene #, Acetohexamide, United States Pharmacopeia (USP) Reference Standard, 1-[(4-acetylbenzene)sulfonyl]-3-cyclohexylurea 4-acetyl-N-(cyclohexylcarbamoyl)benzenesulfonamide, 8054-32-8


ID: 2326

chemical graph of compound 2326



InChIKey: VHKXXVVRRDYCIK-CWCPJSEDSA-N
SMILES: CC[C@H]([C@H]1[C@H](C[C@@H]([C@@H](O1)[C@@H](C)[C@@H]([C@H](C)C(=O)[C@H](CC)[C@@H]2[C@H](C[C@H]([C@]3(O2)C=C[C@H]([C@@]4(O3)CC[C@@](O4)(C)[C@H]5CC[C@@]([C@@H](O5)C)(CC)O)O)C)C)O)C)C)C(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 65452
synonyms found at PubChem are:
narasin, Narasin A, Monteban, Compound 79891, Antibiotic C 7819B, Antibiotic A 28086A, Narasine [INN-French], Narasinum [INN-Latin], Narasino [INN-Spanish], UNII-DZY9VU539P, C 7819B, A 28086A, Antibiotic A-28086 factor A, 4-Methylsalinomycin, BRN 1678311, DZY9VU539P, Narasine, Narasino, Narasinum, AI3-29798, Lilly 79891, Salinomycin, 4-methyl-, (4S), 55134-13-9, Narasin [USAN:BAN:INN], Narasul, alpha-Ethyl-6-(5-(2-(5-ethyltetrahydro-5-hydroxy-6-methyl-2H-pyran-2-yl)-15-hydroxy-2,10,12-trimethyl-1,6,8-trioxadispiro(4.1.5.3)pentadec-13-en-9-yl)-2-hydroxy-1,3-dimethyl-4-oxoheptyl)tetrahydro-3,5-dimethyl-2H-pyran-2-acetic acid, Monteban (TN), Narasin (USP/INN), 2H-Pyran-2-acetic acid, alpha-ethyl-6-(5-(2-(5-ethyltetrahydro-5-hydroxy-6-methyl-2H-pyran-2-yl)-15-hydroxy-2,10,12-trimethyl-1,6,8-trioxadispiro(4.1.5.3)pentadec-13-en-9-yl)-2-hydroxy-1,3-dimethyl-4-oxoheptyl)tetrahydro-3,5-dimethyl-, (4S)-4-Methylsalinomycin, Narasin [USAN:USP:INN:BAN], NCGC00167550-01, C43H72O11, DSSTox_CID_26707, DSSTox_RID_81840, DSSTox_GSID_46707, SCHEMBL123401, AC1L23A4, CHEMBL2104423, DTXSID2046707, (4''S'')-4-methyl-salinomycin, Tox21_112545, ZINC85540282, CAS-55134-13-9, LS-144430, D05122, (2R)-2-[(2R,3S,5S,6R)-6-[(2S,3S,4S,6R)-6-[(3S,5S,7R,9S,10S,12R,15R)-3-[(2R,5R,6S)-5-ethyl-5-hydroxy-6-methyloxan-2-yl]-15-hydroxy-3,10,12-trimethyl-4,6,8-trioxadispiro[4.1.5^{7}.3^{5}]pentadec-13-en-9-yl]-3-hydroxy-4-methyl-5-oxooctan-2-yl]-3,5-dimethyloxan-2-yl]butanoic acid


ID: 2327

chemical graph of compound 2327



InChIKey: VHKZGNPOHPFPER-ONNFQVAWSA-N
SMILES: CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)/C=C/C#N

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5353432
synonyms found at PubChem are:
bay 11-7085, 196309-76-9, (E)-3-(4-tert-butylphenylsulfonyl)acrylonitrile, (E)-3-((4-(tert-Butyl)phenyl)sulfonyl)acrylonitrile, BAY 11-7083, (E)-3-(4-t-Butylphenylsulfonyl)-2-propenenitrile, (E)-3-(4-tert-butylphenyl)sulfonylprop-2-enenitrile, (E)3-[(4-t-Butylphenyl)sulfonyl]-2-propenenitrile, J-501930, 2-Propenenitrile, 3-[[4-(1,1-dimethylethyl)phenyl]sulfonyl]-, (2E)-, SR-01000075721, Lopac0_000183, BAY-117085, AC1NS47A, SCHEMBL157756, SCHEMBL157757, bay11-7085, CHEMBL270299, AOB6820, QCR-159, CHEBI:107653, MolPort-003-940-485, VHKZGNPOHPFPER-ONNFQVAWSA-N, HMS3260F07, HMS3268A22, 336608-38-9, BCP07274, ZINC2386759, Tox21_500183, BS0037, FD5033, MFCD01862602, s7352, AKOS016014648, CCG-204278, CS-6316, DS-6861, LP00183, RL02471, BAY-11-7085, NCGC00025271-02, NCGC00025271-03, NCGC00025271-04, NCGC00025271-05, NCGC00025271-06, NCGC00260868-01, 4CA-0255, AJ-35378, BC233971, HY-10257, KB-02478, AB0048075, AX8252178, RT-011420, EU-0100183, Y1192, B 5681, Bay 11-7085, >=98% (HPLC), solid, A813845, (E)-3-(4-tert-Butyl-benzenesulfonyl)-acrylonitrile, CU-00000000043-1, SR-01000075721-1, SR-01000075721-3, (E)-3-(4-tert-butylphenyl)sulfonyl-2-propenenitrile, BRD-K48684885-001-01-8, (2E)-3-[[4-(1,1-Dimethylethyl)phenyl]sulfonyl]-2-propenenitrile


ID: 2328

chemical graph of compound 2328



InChIKey: VHNLJRRECIZZPX-UHFFFAOYSA-N
SMILES: CC1=CC(=C(C(=C1C(=O)O)O)C)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 736228
synonyms found at PubChem are:
2,4-dihydroxy-3,6-dimethylbenzoic acid, 4707-46-4, 3-METHYLORSELLINIC ACID, 2,4-dihydroxy-3,6-dimethyl benzoic acid, KBio1_001999, AC1LEHNC, PubChem15389, Spectrum_000611, SpecPlus_000959, Spectrum2_000413, Spectrum3_000186, Spectrum4_001506, Spectrum5_000271, AC1Q5TG9, BSPBio_001711, KBioGR_002171, KBioSS_001091, SPECTRUM200640, DivK1c_007055, SCHEMBL963740, SPBio_000366, CHEMBL3039269, CTK4I9718, KBio2_001091, KBio2_003659, KBio2_006227, KBio3_001211, DTXSID20352972, MolPort-001-739-446, ZINC156441, ANW-54436, BBL018820, CCG-38679, SBB064864, STK018710, AKOS005378395, ACM4707464, FCH1116348, MCULE-4748833139, SDCCGMLS-0066387.P001, 3,6-Dimethyl-2,4-dihydroxybenzoic acid, NCGC00095485-01, NCGC00095485-02, AJ-13809, AX8066917, DB-070773, KB-164779, TC-143181, 3,6-dimethyl-2,4-bis(oxidanyl)benzoic acid, FT-0614761, ST50408245, T7873, 707D464, A827148, SR-05000002416, 2,4-Dihydroxy-3,6-dimethylbenzoic acid, AldrichCPR, I01-6129, SR-05000002416-1


ID: 2329

chemical graph of compound 2329



InChIKey: VHOGYURTWQBHIL-UHFFFAOYSA-N
SMILES: CC1=C(C=NO1)C(=O)NC2=CC=C(C=C2)C(F)(F)F

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3899
synonyms found at PubChem are:
leflunomide, 75706-12-6, Arava, Leflunomidum, lefunamide, Leflunomida, HWA 486, Leflunomidum [INN-Latin], HWA-486, 5-methyl-N-[4-(trifluoromethyl)phenyl]-1,2-oxazole-4-carboxamide, Leflunomida [INN-Spanish], SU 101 (pharmaceutical), Arava (TN), Leflunomid, Repso, Lefunomide [Inn-Spanish], Leflunomide [USAN:INN], SU101, 5-Methylisoxazole-4-carboxylic acid (4-trifluoromethyl)anilide, UNII-G162GK9U4W, SU-101, 5-Methyl-N-(4-(trifluoromethyl)phenyl)-4-isoxazolecarboxamide, 5-methyl-N-(4-(trifluoromethyl)phenyl)isoxazole-4-carboxamide, 5-methyl-N-[4-(trifluoromethyl)phenyl]isoxazole-4-carboxamide, 4-Isoxazolecarboxamide, 5-methyl-N-[4-(trifluoromethyl)phenyl]-, alpha,alpha,alpha-Trifluoro-5-methyl-4-isoxazolecarboxy-p-toluidide, HSDB 7289, CHEMBL960, RS-34821, Leflunomide (JAN/USAN/INN), MLS000069648, CHEBI:6402, G162GK9U4W, N-(4'-Trifluoromethylphenyl)-5-methylisoxazole-4-carboxamide, 5-Methylisoxazole-4-(4-trifluoromethylcarboxanilide), SU 101, N-(4-trifluoromethyphenyl)-5-methylisoxazole-4-carboxamide, NCGC00015610-02, SMR000058209, 5-methyl-N-[4-(trifluoromethyl)phenyl]-4-isoxazolecarboxamide, 4-Isoxazolecarboxamide, 5-methyl-N-(4-(trifluoromethyl)phenyl)-, CAS-75706-12-6, DSSTox_CID_3201, L 5025, DSSTox_RID_76923, DSSTox_GSID_23201, 5-Methylisoxazole-4-(4-trifluoromethyl)carboxanilide, 4-Isoxazolecarboxamide, 5-methyl-N-(4-(trifluoromethyl)phenyl, 4-isoxazolecarboxamide,5-methyl-N-(4-(trifluoromethyl)phenyl), leflunomide medac, SR-01000000191, avara, lefumide, Lefunomide, Arabloc, Prestwick_87, Arava, Leflunomide, Leflunomide [USAN:USP:INN:BAN], SULOL, Spectrum_000322, AC1L1GYK, AC1Q2EVA, Opera_ID_1709, Prestwick0_000772, Prestwick1_000772, Prestwick2_000772, Prestwick3_000772, Spectrum5_000850, Lopac-L-5025, D08ROP, SCHEMBL5057, Aventis Brand of Leflunomide, Hoechst Brand of Leflunomide, BIDD:PXR0189, Lopac0_000649, BSPBio_000844, KBioSS_000802, Leflunomide, Immunosuppressant, MLS001076267, DivK1c_000916, SPECTRUM1503927, SPBio_002783, BPBio1_000930, GTPL6825, ISO054, ZINC4840, DTXSID9023201, CTK8G0535, HMS502N18, KBio1_000916, KBio2_000802, KBio2_003370, KBio2_005938, KS-00000KQI, AOB5964, MolPort-002-345-613, NINDS_000916, VHOGYURTWQBHIL-UHFFFAOYSA-N, 5-methyl-n-(4-(trifluoromethyl)phenyl)-4-isoxazolecarboxamid, HMS1570K06, HMS1922M06, HMS2090O12, HMS2097K06, HMS2235C07, HMS3262A19, HMS3268D12, HMS3371F21, HMS3654F07, HMS3714K06, Pharmakon1600-01503927, ALBB-019233, Aventis Pharma Brand of Leflunomide, BCP22241, EBD46417, HY-B0083, Tox21_110182, Tox21_301873, Tox21_500649, ABP001076, Aventis Behring Brand of Leflunomide, BDBM50054601, DL-433, MFCD00867593, NSC677411, NSC759864, s1247, STL426823, AKOS000265193, Tox21_110182_1, AC-6796, AN-9632, BCP9000846, CCG-204736, CS-1781, DB01097, KS-1076, LP00649, MCULE-9490869974, NSC-677411, NSC-759864, RP29613, IDI1_000916, NCGC00015610-01, NCGC00015610-03, NCGC00015610-04, NCGC00015610-05, NCGC00015610-06, NCGC00015610-07, NCGC00015610-08, NCGC00015610-09, NCGC00015610-10, NCGC00015610-11, NCGC00015610-12, NCGC00015610-13, NCGC00015610-14, NCGC00015610-17, NCGC00015610-18, NCGC00022625-03, NCGC00022625-04, NCGC00022625-05, NCGC00022625-06, NCGC00022625-07, NCGC00022625-08, NCGC00255370-01, NCGC00261334-01, AJ-08231, BC204155, H527, LS-86580, SC-46541, ST079287, ZB000596, AB0007396, TL8005179, A9622, AB00052389, EU-0100649, FT-0621959, L0250, R3926, ST24047486, C07905, D00749, MLS-0003109.0001, AB00052389-17, AB00052389-18, AB00052389_19, AB00052389_21, 706L126, AP-501/42475599, A77 1486, I06-2131, Q-201289, SR-01000000191-2, SR-01000000191-4, SR-01000000191-7, BRD-K78692225-001-03-9, BRD-K78692225-001-11-2, 5-methyl-4-(4-trifluoromethyl-phenyl)aminocarbonylisoxazole, 5-methyl-4-(4-trifluoromethylphenyl)aminocarbonylisoxazole, 5-METHYLISOXAZOLE-4-(4-TRIFLUOROMETHYLCARBOXANILID, Leflunomide, European Pharmacopoeia (EP) Reference Standard, N-(4-trifluoromethylphenyl)-5-methylisoxazole-4-carboxamide, 5-methyl-N-(4-(trifluoromethyl)phenyl)isoxazole-4-carboxamide;, 5-methylisoxazole-4-carboxylic acid (4-trifluoromethyl)-anilide, N-(4-trifluoromethylphenyl)-5-methylisoxa-zole-4-carboxamide, (5-methylisoxazol-4-yl)-N-[4-(trifluoromethyl)phenyl]carboxamide, Isoxazole-4-carboxamide, 5-methyl-N-[4-(trifluoromethyl)phenyl]-, Leflunomide, United States Pharmacopeia (USP) Reference Standard, Leflunomide, Pharmaceutical Secondary Standard; Certified Reference Material, Leflunomide for peak identification, European Pharmacopoeia (EP) Reference Standard, 210165-51-8


ID: 2330

chemical graph of compound 2330



InChIKey: VHRSUDSXCMQTMA-PJHHCJLFSA-N
SMILES: C[C@H]1C[C@H]2[C@@H]3CC[C@@]([C@]3(C[C@@H]([C@@H]2[C@@]4(C1=CC(=O)C=C4)C)O)C)(C(=O)CO)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6741
synonyms found at PubChem are:
methylprednisolone, Medrol, 83-43-2, Medrone, Urbason, Methylprednisolon, 6alpha-Methylprednisolone, Metilbetasone, Medrate, Metilprednisolone, Dopomedrol, Promacortine, Besonia, Medesone, Mesopren, Metastab, Metrisone, Moderin, Noretona, Solomet, Urbasone, Wyacort, Esametone, Firmacort, Methyleneprednisolone, Metrocort, Metysolon, Reactenol, Sieropresol, Suprametil, Medixon, Nirypan, Lemod, Artisone-wyeth, Medrol dosepak, Metilprednisolona, Medrol adt pak, Methylprednisolonum, Predni N Tablinen, Medlone 21, Metilprednisolone [DCIT], 1-Dehydro-6alpha-methylhydrocortisone, Summicort;, delta(1)-6alpha-Methylhydrocortisone, Prednol- L, Methylprednisolonum [INN-Latin], Metilprednisolona [INN-Spanish], 6-alpha-Methylprednisolone, Prednisolone, methyl-, Depo-Medrol (acetate), NSC-19987, Prednisolone, 6alpha-methyl-, UNII-X4W7ZR7023, CHEBI:6888, 11beta,17,21-Trihydroxy-6alpha-methylpregna-1,4-diene-3,20-dione, 6alpha-Methyl-11beta,17alpha,21-triol-1,4-pregnadiene-3,20-dione, HSDB 3127, EINECS 201-476-4, U 7532, Methylprednisolone, 6-alpha, BRN 2340300, 11beta,17alpha,21-Trihydroxy-6alpha-methyl-1,4-pregnadiene-3,20-dione, (6alpha,11beta)-11,17,21-Trihydroxy-6-methylpregna-1,4-diene-3,20-dione, 6alpha-Methylprednisolone base, delta(sup 1)-6-alpha-Methylhydrocortisone, MLS000028541, (6S,8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-17-(2-hydroxyacetyl)-6,10,13-trimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-one, X4W7ZR7023, MEPRDL, Pregna-1,4-diene-3,20-dione, 11,17,21-trihydroxy-6-methyl-, (6alpha,11beta)-, (6S,8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-17-(2-hydroxyacetyl)-6,10,13-trimethyl-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-3-one, SMR000058330, 11-beta,17,21-Trihydroxy-6-alpha-methylpregna-1,4-diene-3,20-dione, 6alpha-Methyl-11beta,17alpha,21-trihydroxy-1,4-pregnadiene-3,20-dione, DSSTox_CID_3300, Pregna-1,4-diene-3,20-dione, 11beta,17,21-trihydroxy-6alpha-methyl-, DSSTox_RID_76965, DSSTox_GSID_23300, Metipred, Pregna-1,4-diene-3,20-dione, 11,17,21-trihydroxy-6-methyl-, (6a,11b)-, Pregna-1,4-diene-3,20-dione, 6-alpha-methyl-11-beta-17,21-trihydroxy-, CAS-83-43-2, MLS002638721, Prednisolone, 6.alpha.-methyl-, medralone, Summicort, methylprenisolone, .DELTA.1-6.alpha.-Methylhydrocortisone, NCGC00016330-01, Prestwick_622, Medrol (TN), Methylprednisolone [USP:INN:BAN:JAN], Methylprednisolone [USAN:INN:BAN:JAN], Opera_ID_1576, Prestwick0_000279, Prestwick1_000279, Prestwick2_000279, Prestwick3_000279, 6alpha-methyl prednisolone, Methylprednisolone & Salts, CHEMBL650, D08PIQ, Medrol;Solu-Medrol;Medrone, EC 201-476-4, 6.alpha.-Methylprednisolone, AC1L1N7A, SCHEMBL5084, BSPBio_000158, 4-08-00-03498 (Beilstein Handbook Reference), MLS001148159, MLS002207191, SPBio_002377, BPBio1_000174, GTPL7088, DTXSID7023300, MolPort-002-528-554, VHRSUDSXCMQTMA-PJHHCJLFSA-N, HMS1568H20, HMS2090B13, HMS2095H20, HMS2230D16, HMS3259J04, HMS3712H20, 6alpha-Methylprednisolone, >=98%, HY-B0260, NSC19987, ZINC3875560, Tox21_110376, Tox21_302018, BDBM50103616, LMST02030178, Methylprednisolone (JP17/USP/INN), MFCD00010591, s1733, AKOS015969744, Tox21_110376_1, ACN-037579, CCG-220279, CS-2246, DB00959, KS-1273, NC00691, NCGC00022735-03, NCGC00022735-06, NCGC00255269-01, AK163190, AN-15368, CPD000058330, H972, NCI60_001657, SAM002589984, SC-15861, AB2000257, LS-118498, M1665, ST24048101, 2639-EP2277861A1, 2639-EP2286811A1, 2639-EP2292595A1, 2639-EP2295409A1, 2639-EP2298778A1, 2639-EP2305660A1, 2639-EP2308562A2, 2639-EP2314590A1, 2639-EP2371811A2, D00407, 010M591, 124684-EP2295426A1, 124684-EP2295427A1, C-21225, SR-01000003089, Q-201395, SR-01000003089-2, BRD-K35240538-001-03-1, BRD-K35240538-001-11-4, BRD-K35240538-001-26-2, 6-alpha-Methylprednisolone 100 microg/mL in Acetonitrile, 6alpha-Methylprednisolone, VETRANAL(TM), analytical standard, 11?,17?,21-Trihydroxy-6?-methyl-1,4-pregnadiene-3,20-dione, 11beta,17,21-trihydroxy-6alpha-methyl-1,4-pregnadiene-3,20-dione, Methylprednisolone, European Pharmacopoeia (EP) Reference Standard, Pregna-1,20-dione, 11.beta.,17,21-trihydroxy-6.alpha.-methyl-, Pregna-1,20-dione, 6.alpha.-methyl-11.beta.-17,21-trihydroxy-, (6?,11?)-11,17,21-Trihydroxy-6-methylpregna-1,4-diene-3,20-dione, (6a,11b)-11,17,21-Trihydroxy-6-methylpregna-1,4-diene-3,20-dione, 11beta,17alpha,21-Trihydroxy-6alpha-methylpregna-1,4-diene-3,20-dione, Methylprednisolone, United States Pharmacopeia (USP) Reference Standard, Methylprednisolone for system suitability A, EuropePharmacopoeia (EP) Reference Standard, Methylprednisolone for system suitability, European Pharmacopoeia (EP) Reference Standard, Methylprednisolone, Pharmaceutical Secondary Standard; Certified Reference Material, Pregna-1,20-dione, 11,17,21-trihydroxy-6-methyl-, (6.alpha.,11.beta.)-, Pregna-1,4-diene-3,20-dione, 11beta,17,21-trihydroxy-6alpha-methyl- (8CI), 121673-01-6, 570-35-4


ID: 2331

chemical graph of compound 2331



InChIKey: VHVOLFRBFDOUSH-NSCUHMNNSA-N
SMILES: C/C=C/C1=CC2=C(C=C1)OCO2

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 637796
synonyms found at PubChem are:
ISOSAFROLE, Izosafrol, beta-Isosafrole, Isosafrol, 120-58-1, (E)-Isosafrole, RCRA waste number U141, Isosafrole (TGMX), 5-(1-Propenyl)-1,3-benzodioxole, 4-Propenyl-1,2-methylenedioxybenzene, 1,3-Benzodioxole, 5-(1-propenyl)-, 4-Propenylcatechol methylene ether, 5-Prop-1-enyl-1,3-benzodioxole, NSC 4884, 6-(1-Propenyl)-1,3-benzodioxole, Benzene, 1,2-(methylenedioxy)-4-propenyl-, UNII-94BY31ALL6, 1,2-Methylenedioxy-4-propenylbenzene, 1,3-Benzodioxole, 5-(1-propenyl)-, (E)-, CCRIS 353, 3,4-(Methylenedioxy)-1-propenylbenzene, 4043-71-4, Benzene, 1,2-(methylenedioxy)-4-propenyl-, (E)-, HSDB 2862, trans-1,2-(Methylenedioxy)-4-propenylbenzene, EINECS 204-410-2, RCRA waste no. U141, 3,4-Methylenedioxy-1-propenyl benzene, BRN 0082640, 5-[(E)-prop-1-enyl]-1,3-benzodioxole, AI3-02068, MLS001055464, 94BY31ALL6, CHEBI:6054, 5-[(1E)-prop-1-en-1-yl]-1,3-benzodioxole, SMR001227197, 5-[(E)-prop-1-enyl]benzo[1,3]dioxole, 1,3-Benzodioxole, 5-(1-propen-1-yl)-, 1,2-(Methylenedioxy)-4-propenylbenzene, VHVOLFRBFDOUSH-UHFFFAOYSA-N, trans-Isosafrole, .beta.-Isosafrole, AC1LCUZN, AC1Q6ZWX, Spectrum5_000388, BSPBio_002813, SPECTRUM300533, 5-19-01-00552 (Beilstein Handbook Reference), SCHEMBL266169, CHEMBL487603, cid_637796, BDBM74206, MolPort-001-788-009, VHVOLFRBFDOUSH-NSCUHMNNSA-N, HMS1373B16, ZINC389532, Isosafrol, mixture of cis and trans, BBL027540, CCG-38570, SBB012358, STK801280, AKOS001684145, LS-7468, SDCCGMLS-0066561.P001, NCGC00090700-01, NCGC00090700-02, NCGC00090700-03, NCGC00090700-04, NCGC00090700-05, NCGC00090700-06, AN-22829, LS-30877, ST069347, ZB011749, BB 0261403, (E)-5-(prop-1-enyl)benzo[d][1,3]dioxole, 5-[(1E)-1-Propenyl]-1,3-benzodioxole #, 1,3-Benzodioxole, 5-(1E)-1-propen-1-yl-, C10472, SR-05000002391, 5-[(1E)-prop-1-en-1-yl]-2H-1,3-benzodioxole, SR-05000002391-1, BRD-K44005821-001-07-4, I14-55521, F0000-0010, UNII-W6337429LF component VHVOLFRBFDOUSH-NSCUHMNNSA-N, 5-(1-propenyl)-1,3-benzodioxole3,4-methylenedioxyphenyl-1-propene, InChI=1/C10H10O2/c1-2-3-8-4-5-9-10(6-8)12-7-11-9/h2-6H,7H2,1H3/b3-2, 191281-03-5


ID: 2332

chemical graph of compound 2332



InChIKey: VIDRYROWYFWGSY-UHFFFAOYSA-N
SMILES: CC(C)NCC(C1=CC=C(C=C1)NS(=O)(=O)C)O.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 66245
synonyms found at PubChem are:
Sotalol hydrochloride, 959-24-0, Sotalol HCL, Betapace, Betapace AF, Sotalex, Sotacor, Berlex, Mead johnson 1999, Sorine, Sotalol (hydrochloride), Sotalol.HCl, Betapace (TN), (+/-)-Sotalol hydrochloride, Sotalol (Betapace), Sotylize, MJ 1999, Isopropylaminohydroxyethylmethanesulfonanilide hydrochloride, EINECS 213-496-0, N-Isopropyl-beta-(4-methanesulfonamidophenyl)ethanolamine hydrochloride, 4'-(1-Hydroxy-2-(isopropylamino)ethyl)methanesulfonanilide monohydrochloride, Sotalol Monohydrochloride, CHEBI:9207, 4-(2-Isopropylamino-1-hydroxyaethyl)methanesulfonailid hydrochlorid, 4'-(1-Hydroxy-2-isopropylaminoethyl)methanesulphonanilide hydrochloride, N-[4-[1-Hydroxy-2-(isopropylamino)ethyl]phenyl]methanesulfonamide hydrochloride, NCGC00094337-02, CPD000326828, DSSTox_CID_1278, 4-(2-Isopropylamino-1-hydroxyaethyl)methanesulfonailid hydrochlorid [German], DSSTox_RID_76054, N-(4-{1-hydroxy-2-[(1-methylethyl)amino]ethyl}phenyl)methanesulfonamide hydrochloride, N-{4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl}methanesulfonamide hydrochloride, C12H21ClN2O3S, DSSTox_GSID_21278, Q-201730, Methanesulfonamide, N-(4-(1-hydroxy-2-((1-methylethyl)amino)ethyl)phenyl)-, monohydrochloride, Methanesulfonanilide, 4'-(1-hydroxy-2-(isopropylamino)ethyl)-, monohydrochloride, N-(2-hydroxy-2-{4-[(methylsulfonyl)amino]phenyl}ethyl)propan-2-aminium chloride, N-(4-(1-hydroxy-2-(isopropylamino)ethyl)phenyl)methanesulfonamide hydrochloride, N-[4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide hydrochloride, SMR000326828, (+)-Sotalol hydrochloride, SR-01000076116, Sotalol hydrochloride [USAN], 4'-[1-Hydroxy-2-(isopropylamino)ethyl]methanesulfonanilide monohydrochloride, meadjohnson1999, N-(4-[1-Hydroxy-2-(isopropylamino)ethyl]phenyl)methanesulfonamide hydrochloride, N-[4-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide;hydrochloride, N-[4-[1-Hydroxy-2-[(1-methylethyl)amino]ethyl]phenyl]methanesulfonamide hydrochloride, N-{4-[1-hydroxy-2-(isopropylamino)ethyl]phenyl}methanesulfonamide hydrochloride, Sotalol, HCl, Sotalol hydrochloride [USAN:USP], Berlex Laboratories, Sorine (TN), MJ 1999 hydrochloride, (y)-Sotalol hydrochloride, CAS-959-24-0, (?)-Sotalol hydrochloride, CHEMBL1700, C12H20N2O3S.HCl, MLS000758296, MLS000859969, MLS001401380, MLS002222318, SCHEMBL118761, AC1L24Y9, AC1Q394B, DTXSID8021278, CTK8G3175, 3930-20-9 (Parent), Sotalol hydrochloride (JAN/USP), MolPort-003-959-478, VIDRYROWYFWGSY-UHFFFAOYSA-N, HMS1571A13, Pharmakon1600-01506043, BCP02975, HY-B0437, Tox21_111267, Tox21_200127, Tox21_501055, BG0406, KM3383, MFCD00242937, NSC337251, NSC760358, s2509, 1265321-86-5 (free base), AKOS015888287, AC-3541, API0006283, CCG-100907, CCG-213603, CS-2543, LP01055, LS-7704, NC00157, NSC-337251, NSC-760358, WLN: WS1&MR DYQ1MY1&1 &GH, KS-000011O8, NCGC00094337-01, NCGC00094337-03, NCGC00257681-01, NCGC00261740-01, AN-12879, AN-19653, AS-13017, BC209131, SAM001246725, SAM001246990, SC-13317, BCP0726000245, AB0012836, AB2000612, AX8089585, EU-0101055, FT-0603531, ST24049297, ( inverted question mark)-Sotalol hydrochloride, D01026, J10044, S 0278, Betapace AF;Berlex Laboratories;Sotalex;Betapace, (+/-)-Sotalol hydrochloride, analytical standard, 959S240, A845501, I01-1040, SR-01000076116-2, SR-01000076116-3, SR-01000076116-8, (+/-)-Sotalol hydrochloride, >=98% (TLC), powder, isopropylaminohydroxyethylmethanesulfonanilidehydrochloride, Sotalol Hydrochloride 1.0 mg/ml in Methanol (as free base), [(Isopropylamino)hydroxyethyl]methanesulfonanilide hydrochloride, 4-(2-isopropylamino-1-hydroxyaethyl)methanesulfonailidhydrochlorid, 4'-[1-Hydroxy-2-(isopropylamino)ethyl]methanesulfonanilide hydrochloride, 4'-[2-(Isopropylamino)-1-hydroxyethyl]methanesulfonanilide hydrochloride, 4'-[2-(Isopropylamino)-1-hydroxyethyl]methanesulfonanilide monohydrochloride, 4-[2-(Isopropylamine)-1-hydroxyethyl]methanesulfonanilide hydrochloride, N-Isopropyl-.beta.-(4-methanesulfonamidophenyl)ethanolamine hydrochloride, n-isopropyl-beta-(4-methanesulfonamidophenyl)ethanolaminehydrochloride, p-[1-Hydroxy-2-(isopropylamino)ethyl]methanesulfonanilide hydrochloride, Sotalol hydrochloride, United States Pharmacopeia (USP) Reference Standard, N-(4-{1-hydroxy-2-[(propan-2-yl)amino]ethyl}phenyl)methanesulfonamide hydrochloride, N-[4-[1-oxidanyl-2-(propan-2-ylamino)ethyl]phenyl]methanesulfonamide hydrochloride, 4 inverted exclamation mark -(1-hydroxy-2-(isopropylamino)ethyl)-methanesulfonanilidmonohydrochlorid, 4 inverted exclamation mark -(1-hydroxy-2-(isopropylamino)ethyl)methanesulfonanilidemonohydrochloride, MolPort-005-979-609, MCULE-8589076631, AKOS026749905


ID: 2333

chemical graph of compound 2333



InChIKey: VIKNJXKGJWUCNN-XGXHKTLJSA-N
SMILES: C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=CC(=O)CC[C@H]34

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6230
synonyms found at PubChem are:
norethindrone, Norethisterone, 68-22-4, Norethisteron, Micronor, 19-Norethisterone, Norcolut, Noriday, Norlutin, Primolut-N, Norethynodrone, Conludag, Micronovum, Norluten, Camila, Utovlan, Mini-pill, Mini-Pe, Noresthisterone, Norethisteronum, Noretisterona, Conludaf, Micronett, Minovlar, Noralutin, Norethyndron, Norgestin, Norluton, Proluteasi, Anovule, Gestest, Norfor, Utovlar, Norpregneninlone, 19-Nor-ethindrone, Norpregneninolone, Nor-QD, Ethinylnortestosterone, Anovulatorio, Ciclovulan, Norethadrone, Norethynodron, Estrinor, Gencept, Microneth, Norethin, Synphase, Triella, Genora, Milli, Nelova, Nodiol, Orlest, Noraethisteronum, Norpregneninotone, Ethynylnortestosterone, Norcept-E, 17alpha-Ethynyl-19-nortestosterone, 19-Nor-17alpha-ethynyltestosterone, Synphasic 28, Brevinor 21, Brevinor 28, Trinovum 21, Brevicon, Conceplan, Noriday 28, Errin, Ethynylmortestosterone, Jenest-28, 17alpha-Ethinyl-19-nortestosterone, Brevinor-1 21, Brevinor-1 28, Tri-Norinyl, Anhydrohydroxynorprogesterone, Ovysmen 1 35, Noretisterone [DCIT], Ortho-Novum 1 35, Ortho-Novum 1 50, Nor-Q.D., Ortho-Novum 7 7 7, Ovysmen 0.5 35, Ortho 1 35, 19-Norethinyltestosterone, Ortho 7 7 7, Noretisterone, Ethinyl-19-nortestosterone, Modicon, Norcolute, Normapause, Menzol, Ovcon, Norethin 1/35 E, Norethin 1/50 M, Ortho-novum, Norethisteronum [INN-Latin], Noretisterona [INN-Spanish], Primolut N, 19-Norethindrone, 19-Nor-17-ethinyltestosterone, Nora-BE, Norethisterone [Progestins], 17alpha-Ethynyl-4-estren-17-ol-3-one, 17-alpha-Ethynyl-19-nortestosterone, 19-Nor-17-alpha-ethynyltestosterone, Norethindrone [USAN], 17alpha-Ethinylestra-4-en-17beta-ol-3-one, Norethindirone, Activella, Brevinor, Demulen, Loestrin, Norcept, Jenest, 17-Ethinyl-19-nortestosterone, 17beta-Hydroxy-19-norpregn-4-en-20-yn-3-one, 19-Nor-17alpha-ethynyl-17beta-hydroxy-4-androsten-3-one, 17-alpha-Ethynyl-4-estren-17-ol-3-one, 19-Nor-17alpa-ethynyltestosterone, 17alpha-Ethynyl-17-hydroxy-4-estren-3-one, Micronor (TN), CCRIS 484, norethisterone (norethindrone), Primolut-N (TN), UNII-T18F433X4S, Camila (TN), SC 4640, N.E.E., 19-nor-17alpha-Ethynylandrosten-17beta-ol-3-one, Norethindrone (USP), Norethindrone [USP], Nor-Q.D, 19-Nor-17-ethinyl testosterone, HSDB 3370, 17-ethynyl-17beta-hydroxyestr-4-en-3-one, 17-Hydroxy-19-nor-17alpha-pregn-4-en-20-yn-3-one, 17alpha-Ethynyl-19-norandrost-4-en-17beta-ol-3-one, 19-Nortestosterone, 17-ethynyl-, 4-Estren-17alpha-ethynyl-17beta-ol-3-one, 17-alpha-Ethynyl-17-hydroxy-4-estren-3-one, 17alpha-Ethynyl-17beta-hydroxy-19-norandrost-4-en-3-one, NSC-9564, 19-Nor-ethinyl--4,5-testosterone, EINECS 200-681-6, 17-beta-Hydroxy-19-norpregn-4-en-20-yn-3-one, Norethindrone Norethisterone, BRN 1915671, CHEMBL1162, 19-Nor-17-alpha-ethynylandrosten-17-beta-ol-3-one, 17-alpha-Ethynyl-19-norandrost-4-en-17-beta-ol-3-one, 17-Hydroxy-19-nor-17-alpha-pregn-4-en-20-yn-3-one, Norethindrone (Norethisterone), AI3-26422, (17-alpha)-17-Hydroxy-19-norpregn-4-en-20-yn-3-one, CHEBI:7627, 19-Nor-17-alpha-ethynyl-17-beta-hydroxy-4-androsten-3-one, 19-Norpregn-4-en-20-yn-3-one, 17-hydroxy-, (17alpha)-, 17-alpha-Ethinylestra-4-en-17-beta-ol-3-one, Estr-4-en-3-one, 17alpha-ethynyl-17-hydroxy-, T18F433X4S, 17alpha-Ethynyl-19-nor-4-androsten-17beta-ol-3-one, (8R,9S,10R,13S,14S,17R)-17-ethynyl-17-hydroxy-13-methyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one, 17-alpha-19-Norpregn-4-en-20-yn-3-one, 17-hydroxy-, 17alpha-Ethinyl-17beta-hydroxy-delta(sup:4)-estren-3-one, 19-Nor-17alpha-pregn-4-en-20-yn-3-one, 17-hydroxy-, 17-alpha-Ethinyl-17-beta-hydroxy-delta(sup:4)-estren-3-one, 17-alpha-Ethynyl-17-beta-hydroxy-19-norandrost-4-en-3-one, DSSTox_CID_3380, DSSTox_RID_77005, 17alpha-hydroxy-19-norpregn-4-en-20-yn-3-one, DSSTox_GSID_23380, 17-Ethynyl-17-hydroxyestr-4-en-3-one, 19-Nor-17-alpha-pregn-4-en-20-yn-3-one, 17-hydroxy-, component of Noriday, (8R,9S,10R,13S,14S,17R)-17-ethynyl-17-hydroxy-13-methyl-1,2,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-3H-cyclopenta[a]phenanthren-3-one, SMR000499579, 17.alpha.-Ethinyl-19-nortestosterone, 17.alpha.-Ethynyl-19-nortestosterone, 19-Nor-17.alpha.-ethynyltestosterone, CAS-68-22-4, NCGC00094738-01, CPD000499579, ENT, NET, Prestwick_646, 17.alpha.-Ethynyl-4-estren-17-ol-3-one, Norethisterone [INN], Norethisterone (JP15), Norethisterone (JP17), Prestwick0_000253, Prestwick1_000253, Prestwick2_000253, Prestwick3_000253, D0GL7U, 19-Norpregn-4-en-20-yn-3-one,17-hydroxy-, (17a)-, EC 200-681-6, AC1L1M2R, 17alpha-Ethynyl-17 beta-hydroxy-19-nor-4-androsten-3-one, N.E.E, SCHEMBL23390, BSPBio_000066, MLS001076679, MLS001163874, ARONIS24281, Norethisterone / norethindrone, SPBio_002285, BPBio1_000074, GTPL2880, 17-Ethynyl-19-Nortestosterone, DTXSID9023380, 17-Ethinyl-19-nor-testosterone, BBC/437, MolPort-002-507-131, VIKNJXKGJWUCNN-XGXHKTLJSA-N, 19-Nor-ethinyl-4,5-testosterone, HMS1568D08, HMS2090D21, HMS2095D08, HMS2231E18, HMS3259C16, HMS3712D08, BCP28306, HY-B0554, 17alpha-pregn-4-en-20-yn-3-one, Tox21_111322, Tox21_302427, 19-Norethindrone, >=98%, powder, AN-829, BDBM50148732, LMST02030097, MFCD00067596, s4040, ZINC85205451, AKOS005267172, Tox21_111322_1, CCG-220253, CS-2664, DB00717, MCULE-9156628994, NC00576, RP17635, KS-000048I5, NCGC00179669-01, NCGC00179669-02, NCGC00179669-04, NCGC00255187-01, AC-11100, CJ-22223, LS-97425, SC-16223, 17alpha-Ethynyl-17-hydroxyest-4-en-3-one, 17alpha-Ethynyl-3-oxo-4-estren-17beta-ol, N0449, 17alpha-ethynyl-17-hydroxy-Estr-4-en-3-one, C05028, D00182, 17alpha-Ethynyl-17beta-hydroxyestr-4-en-3-one, 17beta-Hydroxy-17alpha-ethynylestr-4-en-3-one, 067N596, 17-alpha-Ethynyl-17-beta-hydroxy-4-estren-3-one, SR-01000765382, 17alpha-Ethinyl-17alpha-Ethinyl-19-nortestosterone, SR-01000765382-3, W-104686, 13-methyl-17alpha-ethynyl-17-hydroxygon-4-en-3-one, 17-Hydroxy-17-alpha-19-norpregn-4-en-20-yn-3-one, 17-Hydroxy-19-nor-17alpha-4-pregnen-20-yn-3-one, 17-hydroxy-19-nor-17alpha-pregn-4-en-20yn-3-one, 19-Nor-17alpha-ethynyl-4-androsten-17beta-ol-3-one, 19-Norethindrone, VETRANAL(TM), analytical standard, BRD-K92073408-001-03-3, BRD-K92073408-001-16-5, (17alpha)-17-hydroxy-19-norpregn-4-en-20-yn-3-one, 17-Hydroxy-(17alpha)-19-Norpregn-4-en-20-yn-3-one, 17-Ethynyl-17-hydroxyestr-4-en-3-one (ACD/Name 4.0), 17alpha-Ethynyl-17beta-hydroxy-19-nor-4-androsten-3-one, Norethisterone, European Pharmacopoeia (EP) Reference Standard, (17alpha)-17-ethynyl-17-hydroxyestra-4,8(14),9-trien-3-one, 19-Nor-17alpha-pregn-4-en-20-yn-3-one, 17-hydroxy- (8CI), Norethindrone, United States Pharmacopeia (USP) Reference Standard, Norethisterone for system suitability, European Pharmacopoeia (EP) Reference Standard, Norethindrone (Norethisterone), Pharmaceutical Secondary Standard; Certified Reference Material


ID: 2334

chemical graph of compound 2334



InChIKey: VILIWRRWAWKXRW-UHFFFAOYSA-N
SMILES: COC1=CC(=CC(=C1OC)OC)C(=O)OCCCN2CCCN(CC2)CCCOC(=O)C3=CC(=C(C(=C3)OC)OC)OC.Cl.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 29976
synonyms found at PubChem are:
dilazep hydrochloride, Labitan, ASTA C, CCRIS 3782, EINECS 243-548-8, Dilazep HCl, K-285, UNII-LV48LW10EO, Comelian, LV48LW10EO, N,N'-Bis(3-(3,4,5-trimethoxybenzoyloxy)propyl)homopiperazine dihydrochloride, 1,4-Bis(3-(3,4,5-trimethoxybenzoyloxy)-propyl)perhydro-1,4-diazepine dihydrochloride, N,N'-(Bis-omega-hydroxypropyl)homopiperazine 3,4,5-trimethoxybenzoate dihydrochloride, Tetrahydro-1H-1,4-diazepine-1,4(5H)-dipropanol bis(3,4,5-trimethoxybenzoate) dihydrochloride, (Tetrahydro-1H-1,4-diazepine-1,4(5H)-diyl)di(propane-1,3-diyl) bis(3,4,5-trimethoxybenzoate) dihydrochloride, Benzoic acid, 3,4,5-trimethoxy-, diester with tetrahydro-1H-1,4-diazepine-1,4(5H)dipropanol, dihydrochloride, AS 05, AC1L1IJT, 3-[4-[3-(3,4,5-trimethoxybenzoyl)oxypropyl]-1,4-diazepane-1,4-diium-1-yl]propyl 3,4,5-trimethoxybenzoate dichloride, Dilazep dihydrochloride [JAN], C31H44N2O10.2HCl, HMS3261I19, Tox21_500369, CCG-221673, LP00369, NCGC00093803-01, NCGC00261054-01, LS-38452, EU-0100369, D 5294, Benzoic acid, 3,4,5-trimethoxy-, diester with tetrahydro-1H-1,4-diazepine-1,4(5H)dipropanol,dihydrochloride, Dilazep dihydrochloride, Cormelian, 20153-98-4, ASTA C 4898, Prestwick_175, SR-01000075817, 3-[4-[3-(3,4,5-trimethoxybenzoyl)oxypropyl]-1,4-diazepan-1-yl]propyl 3,4,5-trimethoxybenzoate, SureCN349239, AC1O4WG9, SCHEMBL349239, Dilazep dihydrochloride, powder, CHEMBL1603820, CHEBI:31493, MolPort-003-941-096, HMS1568P13, MFCD00133267, AKOS024458358, CCG-213812, B6316, C12954, SR-01000075817-1, SR-01000075817-6, W-110510, 1,4-bis[3-(3,4,5-Trimethoxybenzoyloxy)propyl]homopiperazine dihydrochloride, 3-[4-[3-(3,4,5-trimethoxybenzoyl)oxypropyl]-1,4-diazepan-1-yl]propyl 3,4,5-trimethoxybenzoate dihydrochloride, N,N inverted exclamation marka-bis(3-[3,4,5-Trimethoxybenzoyloxy]propyl)homopiperazine dihydrochloride


ID: 2335

chemical graph of compound 2335



InChIKey: VIPXLQMQEIDXMH-SFHVURJKSA-N
SMILES: CC(C)([C@@H]1CC2=C(O1)C=C3C(=C2)C=CC(=O)O3)OC(=O)C4=CC=CC=C4

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 1042895
synonyms found at PubChem are:
FELAMIDIN, SPBio_000682, Spectrum_001520, SpecPlus_000944, AC1LKG6B, Spectrum2_000731, Spectrum3_001644, Spectrum4_001691, Spectrum5_000362, BSPBio_003367, KBioGR_001982, KBioSS_002000, DivK1c_007040, CHEMBL3039023, SCHEMBL12062114, CHEBI:92642, KBio1_001984, KBio2_002000, KBio2_004568, KBio2_007136, KBio3_002587, MolPort-002-321-252, ZINC715918, CCG-40139, SDCCGMLS-0066833.P001, AB00053141-02, BRD-K36638198-001-02-8, 2-[(2S)-7-oxo-2,3-dihydrofuro[3,2-g]chromen-2-yl]propan-2-yl benzoate, (R)-2-(7-oxo-3,7-dihydro-2H-furo[3,2-g]chromen-2-yl)propan-2-yl benzoate, 1-METHYL-1-(7-OXO-2,3-DIHYDRO-7H-FURO(3,2-G)CHROMEN-2-YL)ETHYL BENZOATE, 1-methyl-1-[(2S)-7-oxo-2,3-dihydro-7H-furo[3,2-g]chromen-2-yl]ethyl benzoate


ID: 2336

chemical graph of compound 2336



InChIKey: VJECBOKJABCYMF-UHFFFAOYSA-N
SMILES: COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)C4COC5=CC=CC=C5O4)N)OC.CS(=O)(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 62978
synonyms found at PubChem are:
Doxazosin mesylate, 77883-43-3, Cardura, Carduran, Cardular, Cardura XL, Cardenalin, Dedralen, Diblocin, Doxazomerck, Progandol, Tensiobas, Doxazosin AZU, Prostadilat, Alfadil, Cardoral, Cardoxan, Doksura, Doxaben, Doxolbran, Kaltensif, Normathen, Supressin, Tonocardin, Benur, Cardular Uro, Diblocin Uro, Doxazosinmesylate, Cardular PP, Diblocin PP, Doxazosin (mesylate), Doxazosin mesilate, HSDB 7082, Doxazosin mesylate [USAN], MLS000028455, UK 33,274-27, SMR000058441, Cardura (TN), Doxazosin mesylate (USAN), DSSTox_CID_25598, DSSTox_RID_80991, DSSTox_GSID_45598, (4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl)(2,3-dihydrobenzo[b][1,4]dioxin-2-yl)methanone methanesulfonate, 1-(4-Amino-6,7-dimethoxy-2-quinazolinyl)-4-(1,4-benzodioxan-2-ylcarbonyl)piperazine monomethanesulfonate, 2-[4-(2,3-dihydro-1,4-benzodioxin-2-ylcarbonyl)piperazin-1-yl]-6,7-dimethoxyquinazolin-4-amine; methanesulfonic acid, 2-[4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)piperazin-1-yl]-6,7-dimethoxyquinazolin-4-amine; methanesulfonic acid, C24H29N5O8S, Doxazocine, Duracin, Dosin, Carduran Neo, CHEBI:4709, 1-(4-Amino-6,7-dimethoxy-2-quinazolinyl)-4-[4-(1,4-benzodioxan-2-yl)carpiperazin-1-yl)]-6,7-dimethoxyquinazoline mesylate, Piperazine, 1-(4-amino-6,7-dimethoxy-2-quinazolinyl)-4-((2,3-dihydro-1,4-benzodioxin-2-yl)carbonyl)-, monomethanesulfonate, SR-01000003045, UK-3327427, Doxazosin mesylate [USAN:USP], C23H25N5O5.CH4O3S, NCGC00017136-01, [4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone;methanesulfonic acid, CAS-77883-43-3, Prestwick_1026, PubChem2385, doxazosin mesylate salt, Doxazosin Mesylate,(S), AC1Q4GSV, Opera_ID_1881, AC1L1Y5G, AC1Q4GT3, Cardura;Carduran;Cardura XL, Doxazosin mesilate (JP17), SCHEMBL42621, MLS000120399, MLS001148153, MLS002222292, MLS006011977, CHEMBL1200561, DTXSID5045598, CTK7B4527, HY-B0098A, MolPort-003-983-427, VJECBOKJABCYMF-UHFFFAOYSA-N, HMS1570L17, HMS2093J14, HMS2097L17, HMS2230L18, HMS3261O10, HMS3372C03, HMS3654J15, HMS3714L17, Pharmakon1600-01505976, 74191-85-8 (Parent), BCP12163, Tox21_110796, Tox21_500474, ANW-42738, MFCD00216023, NSC759284, RW2756, s1324, AKOS015895371, piperazin-1-yl)(2,3-dihydrobenzo[b], Tox21_110796_1, AC-6848, AN-9627, CCG-213583, CS-1830, KS-1052, LP00474, NE52844, NSC-759284, NCGC00016146-02, NCGC00018158-09, NCGC00093884-01, NCGC00261159-01, CPD000058441, SAM002589903, AB0008587, AB2000045, LS-110229, TL8005338, [1,4]dioxin-2-yl)methanone methanesulfonate, D4126, Doxazosin mesylate, >=97% (HPLC), powder, EU-0100474, FT-0625592, EN300-53021, UK-33274-27, 91D858, D 9815, D00608, J10294, UK-33,274-27, I06-0611, SR-01000003045-2, SR-01000003045-4, SR-01000003045-8, Z1259084903, Doxazosin mesilate, European Pharmacopoeia (EP) Reference Standard, Doxazosin mesylate, United States Pharmacopeia (USP) Reference Standard, [4-(4-amino-6,7-dimethoxy-quinazolin-2-yl)piperazin-1-yl]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone; methanesulfonic acid, [4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(2,3-dihydro-1,4-benzodioxin-2-yl)methanone; methanesulfonic acid, [4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone; methanesulfonic acid, [4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(2,3-dihydro-1,4-benzodioxin-3-yl)methanonemethanesulfonic acid, 1-(4-AMINO-6,7-DIMETHOXY-2-QUINAZOLINYL)-4-(1,4-BENZODIOXAN-2-YLCARBONYL) PIPERAZINE METHANESULFONATE, 1-(4-amino-6,7-dimethoxy-2-quinazolinyl)-4-(1,4-benzoldioxan-2-ylcarbonyl)piperazine methanesulfonate, 1-(4-Amino-6,7-dimethoxy-2-quinazolinyl)-4-[(1,4-benzodioxan-2-yl)carbonyl]piperazine Methanesulfonate, 2-[4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)piperazin-1-yl]-6,7-dimethoxyquinazolin-4-amine mesylate, 4-Amino-2-[4-(1,4-benzodioxan-2-carbonyl)piperazin-1-yl]-6,7-dimethoxyquinazoline methanesulfonate, 2-[4-(2,3-dihydro-1,4-benzodioxin-2-ylcarbonyl)piperazin-1-yl]-6,7-dimethoxyquinazolin-4-amine methanesulfonate


ID: 2337

chemical graph of compound 2337



InChIKey: VJILEYKNALCDDV-OIISXLGYSA-N
SMILES: C[C@]12CCC[C@]([C@@H]1CCC3=C2C=C(C=C3)O)(C)C(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 93017
synonyms found at PubChem are:
Podocarpic acid, 5947-49-9, 12-hydroxypodocarpa-8,11,13-trien-16-oic acid, UNII-7K80G5Z96Y, (1S,4AS,10aR)-1,2,3,4,4a,9,10,10a-octahydro-6-hydroxy-1,4a-dimethylphenanthrene-1-carboxylic acid, EINECS 227-706-3, NSC 231784, CHEBI:8277, CHEMBL421115, 7K80G5Z96Y, (1S,4aS,10aR)-6-hydroxy-1,4a-dimethyl-1,2,3,4,4a,9,10,10a-octahydrophenanthrene-1-carboxylic acid, (1S,4aS,10aR)-6-hydroxy-1,4a-dimethyl-1,2,3,4,9,10,10a,4a-octahydrophenanthren ecarboxylic acid, Podocaric Acid, podo-carpic acid, Podocarpic acid, 98%, AC1L3PBM, AC1Q5QHJ, TimTec1_001673, SCHEMBL160062, MEGxp0_001903, ACon0_000057, ACon1_002112, CTK1G9846, HMS1538M01, 1-Phenanthrenecarboxylicacid, 1,2,3,4,4a,9,10,10a-octahydro-6-hydroxy-1,4a-dimethyl-, (1S,4aS,10aR)-, HY-N2318, ZINC3947415, 6406AF, BDBM50167696, MFCD00074825, AKOS015893995, API0003883, CCG-208490, CS-6114, LMPR0104120002, NCGC00142360-01, NCGC00142360-02, NCGC00142360-03, 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,9,10,10a-octahydro-6-hydroxy-1,4a-dimethyl-, (1S-(1alpha,4aalpha,10abeta))-, ST019369, LS-102623, C09171, I04-8352, BRD-K22269939-001-01-4, BRD-K22269939-001-02-2, Podocarpa-8,11,13-trien-16-oic acid, 12-hydroxy- (VAN), Podocarpa-8,11,13-trien-16-oic acid, 12-hydroxy- (VAN) (8CI), (1S,4aS,10aR)-6-hydroxy-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid, 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,9,10,10a-octahydro-6-hydroxy-1,4a-dimethyl-, (1S-(1alpha,4aalpha,10abeta))- (9CI)


ID: 2338

chemical graph of compound 2338



InChIKey: VJJPUSNTGOMMGY-MRVIYFEKSA-N
SMILES: C[C@@H]1OC[C@@H]2[C@@H](O1)[C@@H]([C@H]([C@@H](O2)O[C@H]3[C@H]4COC(=O)[C@@H]4[C@@H](C5=CC6=C(C=C35)OCO6)C7=CC(=C(C(=C7)OC)O)OC)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 36462
synonyms found at PubChem are:
etoposide, 33419-42-0, VePesid, Toposar, trans-Etoposide, Lastet, (-)-Etoposide, VP-16, Zuyeyidal, Etoposidum, Etoposido, Vepesid J, Eposin, Etoposidum [INN-Latin], Eposide, Etosid, Etoposide (VP16), VP 16-213, VP-16-213, Etoposido [INN-Spanish], VP 16 (pharmaceutical), Etopophos (phosphate salt), VP 16, Epipodophyllotoxin VP-16213, Vepeside, Etopol, 4-Demethylepipodophyllotoxin beta-D-ethylideneglucoside, VP 16213, UNII-6PLQ3CP4P3, NK 171, NSC 141540, CCRIS 2392, HSDB 6517, Etoposide [USAN:INN:BAN:JAN], 4'-Demethylepipodophyllotoxin 9-(4,6-O-ethylidene-beta-D-glucopyranoside), VePESID (TN), 4'-Demethylepipodophyllotoxin 9-(4,6-O-(R)-ethylidene-beta-D-glucopyranoside), EINECS 251-509-1, NSC-141540, Demethylepipodophyllotoxin-beta-D-ethylideneglucoside, 6PLQ3CP4P3, CHEMBL44657, CHEBI:4911, Demethyl-epiodophyllotoxin ethylidene glucoside, 4'-O-Demethyl-1-O-(4,6-O-ethylidene-beta-D-glucopyranosyl)epipodophyllotoxin, Epipodophyllotoxin, 4'-demethyl-, 9-(4,6-O-ethylidene-beta-D-glucopyranoside), CPD000112002, EPEG, Epipodophyllotoxin-beta-D-ethyliden-glucoside, 4'-demethyl-, [1,3]benzodioxol-8-one, 9-((4,6-O-Ethylidene-beta-D-glucopyranosyl)oxy)-5,8,8a,9-tetrahydro-5-(4-hydroxy-3,5-dimethoxyphenyl)-furo(3',4':6,7)naphtho(2,3-d)-1,3-dioxol-6(5aH)-one, (5R-(5alpha,5abeta,8aalpha,9beta(R*)))-, 9-((4,6-O-Ethylidine-beta-D-glucopyranosyl)oxy)-5,8,8a,9-tetrahydro-5-(4- hydroxy-3,4-dimethyloxyphenyl)furo (3',4'':6,7) naptho-(2,3-d)-1,3-dioxol-6 (5aH)-one, C29H32O13, NSC141540, Epipodophyllotoxin, 4'-demethyl-, 4,6-O-ethylidene-beta-D-glucopyranoside, 4'-Demethyl-epipodophyllotoxin 9-[4,6-O-(R)-ethylidene-beta-D-glucopyranoside, Epipodophyllotoxin, 4'-demethyl-, 4,6-O-ethylidene-beta-D-glucopyranoside (8CI), Etoposide (VP-16), (5S,5aR,8aR,9R)-5-[[(2R,4aR,6R,7R,8R,8aS)-7,8-dihydroxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]-9-(4-hydroxy-3,5-dimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[6,5-f][1,3]benzodioxol-8-one, (5S,5aR,8aR,9R)-9-(4-hydroxy-3,5-dimethoxyphenyl)-8-oxo-5,5a,6,8,8a,9-hexahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-5-yl 4,6-O-[(1R)-ethylidene]-beta-D-glucopyranoside, 9-((4,6-O-Ethylidine-beta-D-glucopyranosyl)oxy)-5,8,8a,9-tetrahydro-5-(4-hydroxy-3,4-dimethyloxyphenyl)furo(3',4'':6,7)naptho-(2,3-d)-1,3-dioxol-6(5aH)-one, Furo(3',4':6,7)naphtho(2,3-d)-1,3-dioxol-6(5aH)-one, 9-((4,6-O-(1R)-ethylidene-beta-D-glucopyranosyl)oxy)-5,8,8a,9-tetrahydro-5-(4-hydroxy-3,5-dimethoxyphenyl)-, (5R,5aR,8aR,9S)-, Furo(3',4':6,7)naphtho(2,3-d)-1,3-dioxol-6(5aH)-one-, 9-((4,6-O-ethylidene-beta-D-glucopyranosyl)oxy)5,8,8a,9-tetrahydro-5-(4-hydroxy-3,5-dimethoxyphenyl), (5R-(5alpha,5abeta,8aalpha,9beta(R*)))-, SMR000112002, 4'-Demethylepipodophyllotoxin ethylidene-.beta.-D-glucoside, fytosid, Epipodophyllotoxin, 4'-demethyl-, 4,6-O-ethylidene-.beta.-D-glucopyranoside, Etopophos (TN), Etoposide,(S), (5S,5aR,8aR,9R)-5-[[(2R,4aR,6R,7R,8R,8aS)-7,8-dihydroxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]-9-(4-hydroxy-3,5-dimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f], EVP, Furo[3',4':6,7]naphtho[2,3-d]-1,3-dioxol-6(5aH)-one, 9-[[4,6-O-(1R)-ethylidene-.beta.-D-glucopyranosyl]oxy]-5,8,8a,9-tetrahydro-5-(4-hydroxy-3,5-dimethoxyphenyl)-, (5R,5aR,8aR,9S)-, Eposin (TN), E0675, Etoposide [USAN:USP:INN:BAN:JAN], Prestwick3_000396, D09NIB, D0B7EB, 4-Demethylepipodophyllotoxin-.beta.-D-ethylideneglucoside, Demethyl Epipodophyllotoxin Ethylidine Glucoside, AC1L1VT3, SCHEMBL4259, BSPBio_000611, Furo(3',4':6,7)naphtho(2,3-d)-1,3-dioxol-6(5aH)-one, 9-((4,6-O-ethylidene-beta-D-glucopyranosyl)oxy)-5,8,8a,9-tetrahydro-5-(4-hydroxy-3,5-dimethoxyphenyl)-, (5R-(5alpha,5abeta,8aalpha,9beta(R*)))-, MLS000049957, MLS001074951, MLS001424283, MLS002153463, MLS002207239, MLS002222184, [1,3]dioxol-6(5aH)-one, Etoposide (JP15/USP/INN), Etoposide (JP17/USP/INN), BPBio1_000673, GTPL6815, MES-012, Epipodophyllotoxin, 4'-demethyl-, 9-(4,6-O-ethylidene-.beta.-D-glucopyranoside), MolPort-006-069-121, VJJPUSNTGOMMGY-MRVIYFEKSA-N, HMS2052N05, HMS2089F14, HMS2096O13, HMS2232L03, HMS3713O13, VP-16 (TN), EX-A1207, ZINC3938684, BDBM50127140, MFCD00869325, s1225, AKOS007930275, AB07572, BCP9000669, CCG-101165, CS-1774, DB00773, EBD2157958, Etoposide, synthetic, >=98%, powder, LS-1214, NC00415, ETOPOSIDE 4'-DIHYDROGENPHOSPHATE, NCGC00179504-02, AS-35312, CC-28332, HY-13629, SAM001246880, SBI-0051910.P002, KB-308978, AB00438905, ST24047199, Demethyl EpipodophyllotoxinEthylidine Glucoside, Eposin, Vepesid, VP-16, Toposar, Etoposide, A-8109, C01576, D00125, 13165-EP2269989A1, 13165-EP2270008A1, 13165-EP2270014A1, 13165-EP2270018A1, 13165-EP2272827A1, 13165-EP2272832A1, 13165-EP2275413A1, 13165-EP2275420A1, 13165-EP2277565A2, 13165-EP2277566A2, 13165-EP2277567A1, 13165-EP2277568A2, 13165-EP2277569A2, 13165-EP2277570A2, 13165-EP2277865A1, 13165-EP2277876A1, 13165-EP2280012A2, 13165-EP2281815A1, 13165-EP2287156A1, 13165-EP2289892A1, 13165-EP2292280A1, 13165-EP2292614A1, 13165-EP2292615A1, 13165-EP2292617A1, 13165-EP2295055A2, 13165-EP2295416A2, 13165-EP2295426A1, 13165-EP2295427A1, 13165-EP2298305A1, 13165-EP2298746A1, 13165-EP2298748A2, 13165-EP2298764A1, 13165-EP2298765A1, 13165-EP2298768A1, 13165-EP2298772A1, 13165-EP2298778A1, 13165-EP2298780A1, 13165-EP2301928A1, 13165-EP2301933A1, 13165-EP2305640A2, 13165-EP2305642A2, 13165-EP2305671A1, 13165-EP2305679A1, 13165-EP2305689A1, 13165-EP2308812A2, 13165-EP2308833A2, 13165-EP2308839A1, 13165-EP2308855A1, 13165-EP2308861A1, 13165-EP2311453A1, 13165-EP2311807A1, 13165-EP2311808A1, 13165-EP2311825A1, 13165-EP2311827A1, 13165-EP2311829A1, 13165-EP2311840A1, 13165-EP2311842A2, 13165-EP2314574A1, 13165-EP2316832A1, 13165-EP2316833A1, 13165-EP2316834A1, 13165-EP2374454A1, AB00438905-17, AB00438905-18, AB00438905_19, 419E420, C-23291, SR-01000763196, SR-01000763196-3, BRD-K37798499-001-02-5, BRD-K37798499-001-05-8, BRD-K37798499-001-10-8, BRD-K37798499-001-14-0, BRD-K37798499-001-27-2, DEMETHY-EPIPODOPHYLLOTOXIN, ETHYLIDENE GLUCOSIDE, Etoposide, European Pharmacopoeia (EP) Reference Standard, Etoposide, United States Pharmacopeia (USP) Reference Standard, 4''-Demethylepipodophyllotoxin 9-(4,6-O-(R)-ethylidene-beta-D-glucopyranoside), 4-DESMETHYLEPIPODOPHYLLOTOXIN 9-(4,6-O-ETHYLIDENE)-BETA-D-GLUCOPYRANOSIDE, Etoposide for system suitability, European Pharmacopoeia (EP) Reference Standard, (10r,11r,15r,16s)-16-([(2r,4ar,7r,8r,8as)-7,8-dihydroxy-2-methyl-hexahydro-2h-pyrano[3,2-d][1,3]diox, (10R,11R,15R,16S)-16-([(2R,4AR,7R,8R,8AS)-7,8-DIHYDROXY-2-METHYL-HEXAHYDRO-2H-PYRANO[3,2-D][1,3]DIOXIN-6-YL]OXY)-10-(4-HYDROXY-3,5-DIMETHOXYPHENYL)-4,6,13-TRIOXATETRACYCLO[7.7.0.0(3,7).0(11,15)]HEXA, (10R,11R,15R,16S)-16-{[(2R,4aR,6R,7R,8R,8aS)-7,8-dihydroxy-2-methyl-hexahydro-2H-pyrano[3,2-d][1,3]dioxin-6-yl]oxy}-10-(4-hydroxy-3,5-dimethoxyphenyl)-4,6,13-trioxatetracyclo[7.7.0.0;{3,7}.0;{11,15}]hexadeca-1(9),2,7-trien-12-one, (5R,5aR,8aR,9S)-9-(((2R,4aR,6R,7R,8R,8aS)-7,8-dihydroxy-2-methylhexahydropyrano[3,2-d][1,3]dioxin-6-yl)oxy)-5-(4-hydroxy-3,5-dimethoxyphenyl)-5,5a,8a,9-tetrahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-6(8H)-one, (5R,5aR,8aR,9S)-9-(((2R,4aR,6R,7R,8R,8aS)-7,8-dihydroxy-2-methylhexahydropyrano[3,2-d][1,3]dioxin-6-yl)oxy)-5-(4-hydroxy-3,5-dimethoxyphenyl)-5,8,8a,9-tetrahydrofuro[3',4':6,7]naphtho[2,3-d], (5S,5aR,8aR,9R)-5-[[(2R,4aR,6R,7R,8R,8aS)-7,8-dihydroxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]-9-(4-hydroxy-3,5-dimethoxy-phenyl)-5a,6,8a,9-tetrahydro-5H-isobenzofuro[5,6-f][1,3]benzodioxol-8-one, (5S,5aR,8aR,9R)-9-(4-hydroxy-3,5-dimethoxyphenyl)-8-oxo-5,5a,6,8,8a,9-hexahydrofuro[3'',4'':6,7]naphtho[2,3-d][1,3]dioxol-5-yl 4,6-O-[(1R)-ethylidene]-beta-D-glucopyranoside, [5R-[5?,5a?,8a?,9?(R*)]]-9-[(4,6-?-Ethylidene-?-D-glucopyranosyl)oxy]-5,8,8a,9-tetrahydro-5-(4-hydroxy-3,5-dimethoxyphenyl)furo[3',4':6,7]naphtho[2,3-d]-1,3-dioxol-6-(5aH)-one, 121471-01-0, 136598-18-0, 201594-04-9, 35317-32-9, 51854-34-3, 76576-58-4, 9-((4,6-O-Ethylidine-beta-D-glucopyranosyl)oxy)-5,8,8a,9-tetrahydro-5-(4-hydroxy-3,4-dimethyloxyphenyl)furo(3'',4'''':6,7)naptho-(2,3-d)-1,3-dioxol-6(5aH)-one


ID: 2339

chemical graph of compound 2339



InChIKey: VJLLNFDLMWPNBN-UHFFFAOYSA-N
SMILES: CCOC(=O)C1=C(C(=C(C=C1C)O)C)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3084545
synonyms found at PubChem are:
Ethyl 2,4-dihydroxy-3,6-dimethylbenzoate, 31581-32-5, METHYLORSELLINIC ACID, ETHYL ESTER, KBio1_001277, EINECS 250-716-4, Spectrum_000280, SpecPlus_000237, AC1MJ2RA, Spectrum2_000173, Spectrum3_000239, Spectrum4_001534, Spectrum5_000068, BSPBio_001917, KBioGR_001968, KBioSS_000760, SPECTRUM210072, DivK1c_006333, SPBio_000065, SCHEMBL4117805, CHEMBL2362814, KBio2_000760, KBio2_003328, KBio2_005896, KBio3_001417, DTXSID10185473, CHEBI:114177, VJLLNFDLMWPNBN-UHFFFAOYSA-N, CCG-40005, AKOS022650056, SDCCGMLS-0066395.P001, NCGC00095793-01, NCGC00095793-02, 2,4-Dihydroxy-3,6-dimethylbenzoic acid ethyl ester, BRD-K68438316-001-02-1, Benzoic acid, 2,4-dihydroxy-3,6-dimethyl-, ethyl ester


ID: 2340

chemical graph of compound 2340



InChIKey: VKDGNNYJFSHYKD-UHFFFAOYSA-N
SMILES: C(CC(C(F)F)(C(=O)O)N)CN.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 57004
synonyms found at PubChem are:
EFLORNITHINE HYDROCHLORIDE, 68278-23-9, Eflornithine HCl, DFMO HCl, Eflornithine (hydrochloride), DL-alpha-Difluoromethylornithine hydrochloride, dfmo, 2,5-diamino-2-(difluoromethyl)pentanoic acid hydrochloride, Vaniqa, CCRIS 5805, EINECS 269-532-0, 2-(Difluoromethyl)-DL-ornithine monohydrochloride, DFMO HCl;Eflornithine HCl, MLS000069341, 2-(Difluoromethyl)-DL-ornithine hydrochloride, D,L-alpha-Difluoromethylornithine hydrochloride, H--Difluoro-Me-DL-Orn-OH HCl H, DL-Ornithine, 2-(difluoromethyl)-, monohydrochloride, NCGC00093850-01, SMR000058442, DFMO hydrochloride, Eflornithine hydrochloride anhydrous, 2-(Difluoromethyl)-DL-ornithine HCl, .alpha.-DFMO HCl, DSSTox_CID_25765, DSSTox_RID_81107, DSSTox_GSID_45765, Ornithine, 2-(difluoromethyl)-, monohydrochloride, 70050-56-5, Eflornithine HCl H;DFMO HCl H;-Difluoromethylornithine HCl H, DL-Ornithine, monohydrochloride, CAS-96020-91-6, 2,5-bis(azanyl)-2-[bis(fluoranyl)methyl]pentanoic acid hydrochloride, DL-alpha-Difluoromethylornithine hydrochloride hydrate, DMFO Hydrochloride, NSC 270295, NSC 337250, Opera_ID_46, Eflornithine Hydrocloride, C6H13ClF2N2O2, MLS001332583, AC1L1M41, CHEMBL536971, SCHEMBL3022583, DTXSID4045765, CTK8F9319, HY-B0744A, KS-00002WVD, AOB5501, MolPort-003-940-991, BCP11748, DL-alpha-Difluoromethylornithine HCl, Tox21_111224, Tox21_500429, ABP001097, AC-388, KM1188, NSC270295, AKOS015895186, Tox21_111224_1, API0002527, CCG-221733, CS-2984, KS-1261, LP00429, NSC-270295, NCGC00015316-05, NCGC00261114-01, AN-15865, AN-37832, BC207801, LS-98405, DL-|A-Difluoromethylornithine hydrochloride, AB0012930, DL- -Difluoromethylornithine hydrochloride, E0947, EU-0100429, FT-0082608, FT-0630774, DL-2-(Difluoromethyl)-ornithine hydrochloride, 278E239, A836071, A836749, C-11969, SR-01000076229, DL--Difluoromethylornithine Hydrochloride Monohydrate, I06-0316, SR-01000076229-1, 2,5-diamino-2-(difluoromethyl)pentanoic acid,hydrochloride


ID: 2341

chemical graph of compound 2341



InChIKey: VKFAUCPBMAGVRG-UHFFFAOYSA-N
SMILES: CC(C)(C)C(=O)OC1=C(C=C(C=C1)C(CNC)O)OC(=O)C(C)(C)C.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 71486
synonyms found at PubChem are:
Dipivefrin hydrochloride, Dipivefrin HCL, Dipivefrine hydrochloride, 64019-93-8, AKPro, Dipivalyl epinephrine hydrochloride, EINECS 264-609-5, CHEBI:4647, (+-)-3,4-Dihydroxy-alpha-((methylamino)methyl)benzyl alcohol 3,4-dipivalate hydrochloride, (1)-4-(1-Hydroxy-2-(methylamino)ethyl)-1,2-phenylene dipivalate hydrochloride, [2-(2,2-dimethylpropanoyloxy)-4-[1-hydroxy-2-(methylamino)ethyl]phenyl] 2,2-dimethylpropanoate hydrochloride, Propanoic acid, 2,2-dimethyl-, 4-(1-hydroxy-2-(methylamino)ethyl)-1,2-phenylene ester, hydrochloride, (+-)-, dipivefrine HCl, Dipivefrin hydrochloride [USP:JAN], Propine (TN), Dipivefrin hydrochloride [USAN:JAN], NCGC00016906-01, AC1L2G8U, AC1Q60VF, CAS-64019-93-8, C19H30ClNO5, DSSTox_CID_25494, DSSTox_RID_80914, C19H29NO5.HCl, DSSTox_GSID_45494, SCHEMBL41350, MLS002153922, CHEMBL1200833, DTXSID2045494, MolPort-001-540-620, VKFAUCPBMAGVRG-UHFFFAOYSA-N, HMS1569P06, BCP13649, Dipivefrin hydrochloride (JAN/USP), Tox21_110675, API0006667, CCG-220632, AN-38853, SMR001233266, LS-121420, V0312, D01017, 019D938, SR-01000838856, SR-01000838856-2, 1-(3',4'-dipivaloyloxyphenyl)-2-methylamino-1-ethanol hydrochloride, 2-{3,4-bis[(2,2-dimethylpropanoyl)oxy]phenyl}-2-hydroxy-N-methylethanaminium chloride, 2-[(2,2-dimethylpropanoyl)oxy]-4-[1-hydroxy-2-(methylamino)ethyl]phenyl 2,2-dimethylpropanoate hydrochloride, 4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diyl bis(2,2-dimethylpropanoate) hydrochloride, Propanoic acid, 2,2-dimethyl-, 4-(1-hydroxy-2-(methylamino)ethyl)-1,2-phenylene ester,hydrochloride, (+-)-, AKOS026749790


ID: 2342

chemical graph of compound 2342



InChIKey: VKFPRGQZWKTEON-UHFFFAOYSA-N
SMILES: COC1=C(C=CC(=C1)C(CN)O)O.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 102542
synonyms found at PubChem are:
Normetanephrine hydrochloride, 1011-74-1, DL-Normetanephrine hydrochloride, (+/-)-normetanephrine hydrochloride, 4-(2-amino-1-hydroxyethyl)-2-methoxyphenol hydrochloride, 4-(2-amino-1-hydroxyethyl)-2-methoxyphenol hydrochloride(1:1), DL-alpha-(Aminomethyl)-4-hydroxy-3-methoxybenzenemethanol hydrochloride, 13015-71-9, SMR000326765, Normetanephrine HCl, EINECS 213-787-2, Normetanephrine-d3 HCl, AC1L2T0U, AC1Q3F7F, MLS001332505, MLS001332506, MLS002153459, SCHEMBL1168235, CHEMBL1520394, rac Normetanephrine Hydrochloride, rac-Normetanephrine Hydrochloride, CTK8D5098, (y)-Normetanephrine hydrochloride, (?)-Normetanephrine hydrochloride, M-O-METHYLNORADRENALINE HCI, Tox21_500858, MFCD00012882, (1)-alpha-(Aminomethyl)-4-hydroxy-3-methoxybenzyl alcohol hydrochloride, AKOS015913238, CCG-222162, LP00858, MCULE-8609251362, Normetanephrine hydrochloride, (+/-)-, NCGC00094183-01, NCGC00261543-01, DL-Normetanephrine hydrochloride, >=98%, ACM1085333976, EU-0100858, FT-0673106, ST50319982, N 7127, SR-01000075278, J-000333, SR-01000075278-1, 4-(2-amino-1-hydroxyethyl)-2-methoxyphenol, chloride, I14-45364, ( inverted question mark)-Normetanephrine hydrochloride, DL -alpha-[Aminomethyl]-4-hydroxy-3-methoxybenzenemethanol, alpha-(Aminomethyl)-4-hydroxy-3-methoxy-benzyl alcohol hydrochloride, alpha-(Aminomethyl)-4-hydroxy-3-methoxybenzenemethanol hydrochloride, DL-|A-(Aminomethyl)-4-hydroxy-3-methoxybenzenemethanol hydrochloride, Benzenemethanol, alpha-(aminomethyl)-4-hydroxy-3-methoxy-, hydrochloride, SCHEMBL15421560


ID: 2343

chemical graph of compound 2343



InChIKey: VKGQPUZNCZPZKI-UHFFFAOYSA-N
SMILES: C(=NN)(N)N.C(=NN)(N)N.OS(=O)(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 2734952
synonyms found at PubChem are:
Aminoguanidine hemisulfate, Hydrazinecarboximidamide, sulfate (2:1), UNII-R13YB310MU, Aminoguanidine hemisulfate salt, R13YB310MU, AI3-52283, DSSTox_CID_26016, DSSTox_RID_81291, DSSTox_GSID_46016, W-100028, CAS-996-19-0, AC1MC2AZ, EU-0100050, KSC487Q9R, Guanylhydrazine hemisulfate salt, CHEMBL1567020, DTXSID0046016, (1/4)xesseA degrees eAoEaNI, CTK3I7898, Aminoguanidine sulphate monohydrate, MolPort-001-684-055, bis(aminoguanidine); sulfuric acid, HMS3260I21, Hydrazinecarboximidamide hemisulfate, KS-00000Y5D, Tox21_111552, Tox21_500050, MFCD00035665, AKOS015902640, Tox21_111552_1, CCG-204146, LP00050, MCULE-4551185793, RTC-063967, Aminoguanidine hemisulfate salt, >=98%, NCGC00015082-09, NCGC00093564-01, NCGC00260735-01, TC-063967, A0309, ST51037147, A 7009, I14-20071, F0001-2343, 146396-79-4, aminoguanidine hemisulphate, Bis(Aminoguanidinium) Sulfate, bis-(aminoguanidinium)-sulphate, VKGQPUZNCZPZKI-UHFFFAOYSA-N, Bis(1-aminoguanidinium) sulphate, ACMC-20altd, SCHEMBL728583, CTK0H8951, CTK8G5222, AKOS015901150, TL806394, TC-167944, I14-14878, SCHEMBL9703212


ID: 2344

chemical graph of compound 2344



InChIKey: VKHAHZOOUSRJNA-GCNJZUOMSA-N
SMILES: CC#C[C@@]1(CC[C@@H]2[C@@]1(C[C@@H](C3=C4CCC(=O)C=C4CC[C@@H]23)C5=CC=C(C=C5)N(C)C)C)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 55245
synonyms found at PubChem are:
mifepristone, 84371-65-3, Mifeprex, Mifegyne, RU-486, Mifepriston, Corlux, Mifepristona, Mifepristonum, Korlym, Mifepristonum [Latin], RU486, Mifepristona [Spanish], RU 486, RU-38486, RU 38486, UNII-320T6RNW1F, Mifepristone [USAN:INN:BAN], HSDB 6841, R 38486, BRN 5779404, RU 486-6, MLS000069785, 320T6RNW1F, VGX-410C, CHEBI:50692, VGX-410, NCGC00025179-05, SMR000058481, DSSTox_CID_3322, 11beta-(4-(Dimethylamino)phenyl)-17beta-hydroxy-17-(1-propynyl)estra-4,9-dien-3-on, 17-beta-Hydroxy-11-beta-(4-dimethylaminophenyl-1)-17-alpha-(prop-1-ynyl)oestra-4,9-dien-3-one, DSSTox_RID_76976, DSSTox_GSID_23322, (8S,11R,13S,14S,17S)-11-(4-(dimethylamino)phenyl)-17-hydroxy-13-methyl-17-(prop-1-yn-1-yl)-1,2,6,7,8,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-3-one, (8S,11R,13S,14S,17S)-11-(4-dimethylaminophenyl)-17-hydroxy-13-methyl-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one, (8S,11R,13S,14S,17S)-11-[4-(dimethylamino)phenyl]-17-hydroxy-13-methyl-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one, 11beta-(4-(Dimethylamino)phenyl)-17-hydroxy-21-methyl-19-nor-17alpha-pregna-4,9-dien-20-m-3-on, 11beta-(4-(N,N-Dimethylamino)phenyl)-17alpha-(prop-1-ynyl)-delta4,9-estradiene-17beta-ol-3-one, 11beta-(p-(Dimethylamino)phenyl)-17beta-hydroxy-17-(1-propynyl)estra-4,9-dien-3-one, ZK-98296, (10S,11S,14S,15S,17R)-17-[4-(dimethylamino)phenyl]-14-hydroxy-15-methyl-14-(prop-1-yn-1-yl)tetracyclo[8.7.0.0;{2,7}.0;{11,15}]heptadeca-1,6-dien-5-one, (11beta,17beta)-11-(4-(Dimethylamino)phenyl)-17-hydroxy-17-(1-propynyl)-estra-4,9-dien-3-one, (11beta,17beta)-11-(4-(Dimethylamino)phenyl)-17-hydroxy-17-(1-propynyl)estra-4,9-dien-3-one, 11-(4-DIMETHYLAMINO-PHENYL)-17-HYDROXY-13-METHYL-17-PROP-1-YNYL-1,2,6,7,8,11,12,13,14,15,16,17-DODEC AHYDRO-CYCLOPENTA[A]PHENANTHREN-3-ONE, 83203-42-3, Estra-4,9-dien-3-one, 11-(4-(dimethylamino)phenyl)-17-hydroxy-17-(1-propynyl)-, (11-beta,17-beta)-, RU486 (tetramethyl-rhodamine conjugated), SR-01000076011, C29H35NO2, mifestone, Pictovir, CCRIS 9332, 1nhz, Mifeprex (TN), Pictovir (TM), (11beta,17beta)-11-[4-(dimethylamino)phenyl]-17-hydroxy-17-prop-1-yn-1-ylestra-4,9-dien-3-one, CPD000058481, Prestwick_570, CAS-84371-65-3, Korlym (TN), ZK98296, Mifepristone(Mifeprex), 2w8y, Mifepristone (Mifeprex), Mifepristone(Mifeprex)/, Opera_ID_562, Mifepristone, >=98%, AC1L1IOO, Prestwick0_000299, Prestwick1_000299, Prestwick2_000299, Prestwick3_000299, Spectrum5_002045, R38486, BIDD:PXR0123, Lopac0_000801, R-38486, SCHEMBL16087, BSPBio_000238, MLS001074115, MLS001424271, (non-labelled)Mifepristone-d3, ARONIS27015, SPBio_002457, RU-486, MIFEPRISTONE, BPBio1_000262, GTPL2805, Mifepristone (JAN/USAN/INN), CHEMBL1276308, DTXSID5023322, BDBM18627, CTK8B2959, AOB6893, MolPort-003-849-222, VKHAHZOOUSRJNA-GCNJZUOMSA-N, HMS1568L20, HMS2052L05, HMS2090L22, HMS2095L20, HMS2230P21, HMS3262B03, HMS3649J08, HMS3712L20, ACT02598, BCP02145, ZINC3831128, Tox21_110952, Tox21_301841, Tox21_500801, ABP000437, ANW-41472, HSCI1_000369, MFCD00867226, s2606, VX-410, AKOS015895416, Tox21_110952_1, API0003390, CCG-101164, CI-1073, CS-1435, DB00834, LP00801, NC00414, RL05189, Mifepristone 1.0 mg/ml in Acetonitrile, NCGC00025179-06, NCGC00025179-07, NCGC00025179-08, NCGC00025179-09, NCGC00025179-12, NCGC00025179-13, NCGC00179632-01, NCGC00255152-01, NCGC00261486-01, (11beta,17beta)-11-(4-(Dimethylamino)-phenyl)-17-hydroxy-17-(1-propynyl)estra-4,9-dien-3-one, AJ-45776, AN-10301, AS-13938, Estra-4,9-dien-3-one, 11-(4-(dimethylamino)phenyl)-17-hydroxy-17-(1-propynyl)-, (11beta,17beta)-, HY-13683, LS-64723, SC-16222, AB2000695, TL8005515, TR-026092, EU-0100801, FT-0082666, FT-0602519, C07652, D00585, M 8046, RU-486;RU-38486;Mifegyne;Mifeprex;Mifeprex, W-5163, 29523-EP2272827A1, 29523-EP2275420A1, 29523-EP2295055A2, 29523-EP2295416A2, 29523-EP2298748A2, 29523-EP2298764A1, 29523-EP2298765A1, 29523-EP2305642A2, 29523-EP2308880A1, 29523-EP2311453A1, 29523-EP2311808A1, 29523-EP2311829A1, 29523-EP2311842A2, 75603-EP2269977A2, 75603-EP2308880A1, 371M653, A840767, SR-01000721888, Q-201405, SR-01000076011-1, SR-01000076011-3, SR-01000076011-5, SR-01000076011-9, SR-01000721888-4, BRD-K37270826-001-04-5, BRD-K37270826-001-31-8, Mifepristone, United States Pharmacopeia (USP) Reference Standard, (11?,17?)-11-[4-(Dimethylamino)phenyl]-17-hydroxy-17-(1-propynyl)-estra-4,9-dien-3-one, 11.beta.-[4-(Dimethylamino)phenyl]-17.beta.-hydroxy-17-(1-propynyl)estra-4,9-dien-3-one, 11|A-(4-Dimethyl-amino)-phenyl-17|A-hydroxy-17-(1-propynyl)-estra-4,9-dien-3-one, 11|A-[4(dimethylamino)phenyl]-17|A-hydroxy-17|A-(1-propynyl)-estra-4,9-diene-3-one, 11b-(p-(dimethylamino)phenyl)-17b-hydroxy-17-(1-propynyl)estra-4,9-dien-3-one, 11beta-(4-Dimethyl-amino)-phenyl-17beta-hydroxy-17-(1-propynyl)-estra-4,9-dien-3-one, (8S,11R,13S,14S,17S)-11-[4-(dimethylamino)phenyl]-13-methyl-17-oxidanyl-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one, 122742-25-0, Estra-4,9-dien-3-one, 11-[4-(dimethylamino)phenyl]-17-hydroxy-17-(1-propynyl)-, (11b,17b)-


ID: 2345

chemical graph of compound 2345



InChIKey: VKJGBAJNNALVAV-UHFFFAOYSA-M
SMILES: COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC5=C(C=C4CC3)OCO5)OC.[Cl-]

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 12456
synonyms found at PubChem are:
berberine chloride, Berberine hydrochloride, 633-65-8, Natural Yellow 18, Benzodioxide, Berberinium chloride, Berberine HCl, Berberine (chloride), UNII-UOT4O1BYV8, Berberine chloride [JAN], Berberin hydrochloride, EINECS 211-195-9, UOT4O1BYV8, NSC 163088, AI3-61834, MLS002702530, CHEBI:31271, NSC163088, NSC-163088, DSSTox_CID_4602, Berberinehydrochloride, 9,10-dimethoxy-5,6-dihydro-[1,3]dioxolo[4,5-g]isoquinolino[3,2-a]isoquinolin-7-ium chloride, Benzo(g)-1,3-benzodioxolo(5,6-a)quinolizinium, 5,6-dihydro-9,10-dimethoxy-, chloride, DSSTox_RID_77465, DSSTox_GSID_24602, Q-100261, Q-100731, C.I. 75160, Berberinium chloride hydrate, Berbinium, 7,8,13,13a-tetradehydro-9,10-dimethoxy-2,3-(methylenedioxy)-, chloride, CHEMBL12089, 5,6-Dihydro-9,10-dimethoxybenzo(g)-1,3-benzodioxolo(5,6-a)quinolizinium chloride hydrate, GNF-PF-4545, SMR001233240, NSC646666, SR-01000711827, NCGC00016526-02, NCGC00016526-07, CAS-633-65-8, Berberine chloride, primary pharmaceutical reference standard, C20H18NO4.Cl, CCRIS 8656, Prestwick_91, Benzo(g)-1,3-benzodioxolo(5,6-a)quinolizinium, 5,6-dihydro-9,10-dimethoxy-, chloride (1:1), Benzo[g]-1,3-benzodioxolo[5,6-a]quinolizinium, 5,6-dihydro-9,10-dimethoxy-, chloride (1:1), Barberry Root Extract, NSC 646666, dimethoxy[?] chloride, 5,6-Dihydro-9,10-dimethoxybenzo[g]-1,3-benzodioxolo[5,6-a]quinolizinium chloride, AC1L1ZMX, Berberine chloride (TN), 9,10-dimethoxy-5,6-dihydro-2H-1,3-dioxolano[4,5-g]isoquinolino[3,2-a]isoquinol ine, chloride, Berberine Hydrochloride,(S), MLS002153890, SCHEMBL153906, SPECTRUM1500811, Berberine Hydrochloride Hydrate, DTXSID8024602, HMS500N07, KS-00000JKS, MolPort-001-742-620, VKJGBAJNNALVAV-UHFFFAOYSA-M, HMS1569F14, HMS1921I18, HMS2096F14, HMS2210A06, HMS2235H16, HMS3336C05, HMS3373L14, HMS3655F20, Pharmakon1600-01500811, Tox21_110474, Tox21_200348, AC-118, AN-948, CB0176, CCG-39622, MFCD00011939, NSC757795, s2271, SBB057562, AKOS007930622, Tox21_110474_1, API0001672, CS-3214, KS-5294, LS-1524, MCULE-7356741555, NSC-646666, NSC-757795, NCGC00091896-01, NCGC00094858-01, NCGC00094858-02, NCGC00257902-01, AK323614, BC201607, HY-18258, SC-18366, AB1009372, B0450, FT-0622874, N1699, ST50308453, C12679, C-58382, Berberine chloride hydrate, technical, >=90% (AT), SR-01000711827-4, SR-01000711827-6, BERBERINE CHLORIDE (BERBARINE(2086-73-1)), Z2768724441, Berberine chloride, European Pharmacopoeia (EP) Reference Standard, Benzo[g]-1,6-a]quinolizinium, 5,6-dihydro-9,10-dimethoxy-, chloride, Berberine chloride, United States Pharmacopeia (USP) Reference Standard, Berberine Chloride, Pharmaceutical Secondary Standard; Certified Reference Material, Berbinium,8,13,13a-tetradehydro-9.10-dimethoxy-2,3-(methylene dioxy)-, chloride, 1082532-96-4, 16,17-dimethoxy-5,7-dioxa-13$l^{5}-azapentacyclo[11.8.0.0^{2,10}.0^{4,8}.0^{15,20}]henicosa-1(21),2(10),3,8,13,15,17,19-octaen-13-ylium chloride, 16,17-dimethoxy-5,7-dioxa-13lambda5-azapentacyclo[11.8.0.0^{2,10}.0^{4,8}.0^{15,20}]henicosa-1(21),2(10),3,8,13,15(20),16,18-octaen-13-ylium chloride, ILTRWWGSIZFEIW-UHFFFAOYSA-N, Berbinium, 7,8,13,13a-tetradehydro-9.10-dimethoxy-2,3-(methylene dioxy)-, chloride


ID: 2346

chemical graph of compound 2346



InChIKey: VKPVZFOUXUQJMW-FHSNZYRGSA-N
SMILES: CC(=O)N[C@H]1CCC2=CC(=C(C(=C2C3=C1[C@H]4[C@@H]3C=C(C4=O)OC)OC)OC)OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 244898
synonyms found at PubChem are:
Lumicolchicine, 6901-13-9, gamma-Lumicolchicine, beta-Lumicolchicine, Lumicolchicine gamma, (-)-beta-Lumicolchicine, NSC56233, 6901-14-0, NSC 56233, NSC 221661, .beta.-Lumicolchicine, Prestwick_307, (-)-|A-Lumicolchicine, AC1L6EPV, Prestwick3_000453, AC1Q6N2T, BSPBio_000526, MLS002153821, BPBio1_000580, CHEMBL527025, SCHEMBL13673747, CHEBI:93737, HMS2096K08, HMS2231J20, BCP22727, ZINC1756103, NSC-56233, AKOS032947213, VZ20243, NCGC00179531-01, AC-30175, CJ-29678, n-[(7s,7br,10as)-1,2,3,9-tetramethoxy-8-oxo-5,6,7,7b,8,10a-hexahydrobenzo[a]cyclopenta[3,4]cyclobuta[1,2-c][7]annulen-7-yl]acetamide, SMR001233190, BRD-K99411983-001-02-3, Acetamide,N-[(7S,7bS,10aR)-5,6,7,7b,8,10a-hexahydro-1,2,3,9-tetramethoxy-8-oxobenzo[a]cyclopenta[3,4]cyclobuta[1,2-c]cyclohepten-7-yl]-, N-[(7S,7bR,10aS)-1,2,3,9-Tetramethoxy-8-oxo-5,6,7,7b,8,10a-hexahydrobenzo-[a]cyclopenta[3,4]cyclobuta[1,2-c]cyclohepten-7-yl]acetamide, N-[(7S,7bR,10aS)-1,2,3,9-Tetramethoxy-8-oxo-5,6,7,7b,8,10a-hexahydrobenzo[a]cyclopenta[3,4]cyclobuta[1,2-c]cyclohepten-7-yl]acetamide (beta-Lumicolchicine), N-[(7S,7bR,10aS)-5,6,7,7b,8,10a-Hexahydro-1,2,3,9-tetramethoxy-8-oxobenzo[a]cyclopenta[3,4]cyclobuta[1,2-c]cyclohepten-7-yl]acetamide


ID: 2347

chemical graph of compound 2347



InChIKey: VKYKSIONXSXAKP-UHFFFAOYSA-N
SMILES: C1N2CN3CN1CN(C2)C3

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 4101
synonyms found at PubChem are:
methenamine, Hexamethylenetetramine, 100-97-0, Hexamine, Urotropine, Hexamethylenamine, 1,3,5,7-Tetraazaadamantane, Aminoform, Methenamin, Urotropin, Hexamethylenetetraamine, Formamine, HMTA, Uritone, Hexamethylene tetramine, Aminoformaldehyde, methenaminum, Ammonioformaldehyde, Ammoform, Antihydral, Cystamin, Cystogen, Duirexol, Hexaform, Hexaloids, Hexaminum, Metenamina, Metramine, Resotropin, Uratrine, Urodeine, Xametrin, Formin, Heterin, Hexasan, Uramin, Hexamethylentetramin, Preparation AF, Hexamethyleneamine, Hexilmethylenamine, Hexa-Flo-Pulver, Ekagom H, Aceto HMT, Herax UTS, Hexamethylentetraminum, Formin (heterocycle), Nocceler H, Sanceler H, Hexamine (heterocycle), Vulkacit H 30, Hexamethylentetramine, Hexasan (VAN), S 4 (heterocycle), 1,3,5,7-Tetraazatricyclo[3.3.1.13,7]decane, Hexamethylenetetraminum, Uro-phosphate, Esametilentetramina, 1,3,5,7-tetraazatricyclo[3.3.1.1~3,7~]decane, Caswell No. 482, Metenamine, Methamin, Vesaloin, Hexa (vulcanization accelerator), Hexamine Silver, Methenamine [USAN:INN], Metenamina [INN-Spanish], Methenaminum [INN-Latin], UNII-J50OIX95QV, Methenamine Silver, Silver Methenamine, Hexamine (JAN), Hexamine (TN), Esametilentetramina [Italian], Hexamethylentetramin [German], CCRIS 2297, HSDB 563, HMT, Hexamethylenetetramine (aliphatic), Methenamine (USP/INN), EINECS 202-905-8, NSC 26346, UN1328, EPA Pesticide Chemical Code 045501, NSC 403347, J50OIX95QV, 1,3,5,7-Tetraazatricyclo (3.3.1.1(3,7))decane, 1,3,5,7-Tetraazatricyclo(3.3.1.1(sup 37))decane, AI3-09611, Hexamethylenetetramine solutions, CHEBI:6824, H.M.T., C6H12N4, HEXAMETHYLENETETRAMINE, ACS, VKYKSIONXSXAKP-UHFFFAOYSA-N, Formin (the heterocyclic compound), 1,3,5,7-Tetraazatricyclo(3.3.1.13,7)decane, NSC26346, 1,3,5,7-Tetraazatricyclo[3.3.1.13,7 ]decane, 1,3,5,7-Tetraazatricyclo(3.3.1.1(sup 3,7))decane, NCGC00094719-04, E239, DSSTox_CID_692, Hexamethylenetetramine-palladium chloride adduct, DSSTox_RID_75739, 1,3,5,7-tetraazatricyclo[3.3.1.1?,?]decane, DSSTox_GSID_20692, Hexamethylenetetramine [UN1328] [Flammable solid], 1,3,5,7-Tetraazatricyclo[3.3.1.1(3,7)]decane, 1,3,5,7-tetraazatricyclo[3.3.1.1^{3,7}]decane, Sanceler HT, Heksa K, Hexamine Superfine, Nocceler H-PO, Sanceler HT-PO, Hexa B, 1,3,5,7-Tetraazatricyclo(3.3.1.13,7)decane hydroiodide, CAS-100-97-0, SMR000857139, Cohedur H 30, hexamethylene-tetramine, NSC403347, Rhenogran HEXA 80, Thixon 715B, 1,3,5,7-Tetraazotricyclo[3.3.1.13,7]decane, SR-05000002024, Methenamine [USP:INN], 1,3,5,7-tetraazatricyclo[3.3.1.1<3,7>]decane, 1,3,5,7-Tetraazatricyclo[3.3.1.1(sup 3,7)]decane, Hexamethylamine, Naphthamine, Vesalvine, Urisol, Carin, EL 10 (corrosion inhibitor), EL 10, Prestwick_79, Vulkacit H30, Grasselerator 102, Cystex (Salt/Mix), 67931-01-5, hexam-ethylenetetraamine, hexamethylene tetraamine, PubChem20918, Spectrum_000991, ACMC-20ahs9, AC1L1HEY, AC1Q1ICZ, Spectrum2_000827, Spectrum3_001730, Spectrum4_000872, Spectrum5_001603, Methenamine (Mandelamine), Formaldehyde-ammonia 6:4, [16]-Adamazane, INN, component of Uro-Phosphate, Uro-phosphate (Salt/Mix), 1,5,7-Tetraazaadamantane, D02LJR, EC 202-905-8, Hexamethylentetramin(german), Hexamethylenetetramine, 8CI, 1,3,5,7-Tetraaza-tricyclo3.3.1.13,7decane, SCHEMBL33785, BSPBio_003380, Hexamethylenetetramine, tech., KBioGR_001563, KBioSS_001471, KSC925A7R, MLS001332361, MLS001332362, MLS002207085, DivK1c_000322, SPECTRUM1500394, SPBio_000753, Hexamethylenetetramine, BioXtra, CHEMBL1201270, DTXSID6020692, CTK8C5078, HMS501A04, KBio1_000322, KBio2_001471, KBio2_004039, KBio2_006607, KBio3_002600, KS-00000URE, MolPort-001-759-937, NINDS_000322, HMS1920L13, HMS2091D08, HMS2233B09, HMS3371O15, HMS3652A05, HMS3715D17, Pharmakon1600-01500394, HY-B0514, STR00289, Tox21_113455, Tox21_201606, Tox21_300502, ANW-73975, CCG-40289, Hexamethylenetetramine, 99% 250g, Hexamethylenetetramine, LR, >=99%, LS-313, NSC-26346, NSC757101, s3139, SBB008794, STL197471, ZINC86040406, AKOS000120003, Tox21_113455_1, CS-2724, DB06799, MCULE-8414341610, NE10461, NSC-757101, RP20622, IDI1_000322, NCGC00094719-01, NCGC00094719-02, NCGC00094719-03, NCGC00094719-05, NCGC00094719-06, NCGC00094719-08, NCGC00254463-01, NCGC00259155-01, AJ-72646, BC222881, H722, SC-19168, SBI-0051439.P003, AB1002098, TC-162720, Hexamethylenetetramine, ReagentPlus(R), 99%, ST50823696, 1,5,7-Tetraazatricyclo[3.3.1.13,7]decane, 3070-EP2269990A1, 3070-EP2295550A2, 3070-EP2298734A2, 3070-EP2371811A2, 3070-EP2377849A2, D00393, Hexamethylenetetramine, ACS reagent, >=99.0%, 1,3,5,7-tetraazaadamantane, Formin, Aminoform, 22128-EP2272817A1, 22128-EP2275404A1, 22128-EP2280000A1, 22128-EP2305652A2, 22128-EP2308848A1, 22128-EP2314593A1, 34431-EP2301536A1, 34431-EP2301538A1, 34431-EP2311455A1, 34543-EP2301536A1, 34543-EP2301538A1, 34543-EP2311455A1, AB00052038_08, AB00052038_09, 1,3,5,7-tetraaza-tricyclo[3.3.1.13,7]decane, 1,3,5,7-tetraazatricyclo-[3.3.1.13,7]decane, 1,3,5,7-tetraazatricyclo[3,3,1,13,7]decane, 1,3,5,7-tetraazatricyclo[3.3.1.1(3),]decane, 1,5:3,7-Dimethano-1,3,5,7-tetraazacyclooctane, AE-641/00560026, WLN: T66 B6 A B-C 1B I BN DN FN HNTJ, 1,3,5,7-Tetraazatricyclo[3.3.1~13,7~]decane, Hexamethylenetetramine [UN1328] [Flammable solid], Hexamethylenetetramine, analytical reference material, Hexamethylenetetramine, p.a., ACS reagent, 99.0%, Hexamethylenetetramine, SAJ first grade, >=98.5%, I14-7469, J-000293, J-521456, SR-05000002024-1, SR-05000002024-3, 1,3,5,7-tetraaza-tricyclo[3.3.1.1*3,7*]decane, 1,3,5,7-Tetraazatricyclo-[3.3.1.1(3,7)]decane, 1,3,5,7-tetraazatricyclo[3.3.1.1;{3,7}]decane, BRD-K30114692-001-10-0, Hexamethylenetetramine, JIS special grade, >=99.0%, F2173-0429, Z362014242, Methenamine, European Pharmacopoeia (EP) Reference Standard, Methenamine, United States Pharmacopeia (USP) Reference Standard, InChI=1/C6H12N4/c1-7-2-9-4-8(1)5-10(3-7)6-9/h1-6H, 1,3,5,7-Tetraazatricyclo[3.3.1.13,7]decane; Hexamine; Methenamine; Urotropine, Hexamethylenetetramine, anhydrous, free-flowing, Redi-Dri(TM), ACS reagent, >=99.0%, 11103-67-6, 1556839-80-5, 15978-33-3, 56549-34-9, 74734-16-0, 91773-48-7, Hexamethylenetetramine, meets analytical specification of Ph.??Eur., BP, 99-100.5% (calc. to the dried substance), Hexamethylenetetramine, puriss. p.a., Reag. Ph. Eur., >=99.5% (calc. to the dried substance)


ID: 2348

chemical graph of compound 2348



InChIKey: VLPIATFUUWWMKC-UHFFFAOYSA-N
SMILES: CC1=C(C(=CC=C1)C)OCC(C)N

biological descriptors:

CFTR relevance: weak CFTR corrector

Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown

reference list:

"DY Thomas" "KA Teske" "R Robert" "JW Hanrahan" "Y Luo" "GW Carlile" "D Zhang"


CID is 4178
synonyms found at PubChem are:
Mexiletine, 31828-71-4, 1-(2,6-dimethylphenoxy)propan-2-amine, Mexiletina, Mexitil, Mexiletinum, Mexilitine, Mexiletinum [INN-Latin], Mexiletina [INN-Spanish], Mexiletene, Mexityl, Mexiletine [INN:BAN], 2-Propanamine, 1-(2,6-dimethylphenoxy)-, Mexiletine HCL, 1-Methyl-2-(2,6-xylyloxy)ethylamine, Mexiletine (INN), 1-(2,6-Dimethylphenoxy)-2-propanamine, ETHYLAMINE, 1-METHYL-2-(2,6-XYLYLOXY)-, 2-(2-aminopropoxy)-1,3-dimethylbenzene, KOE-1173, EINECS 250-825-7, KO1173, CHEMBL558, KO-1173, BRN 2092205, CHEBI:6916, 1-(2',6'-Dimethylphenoxy)-2-aminopropane, VLPIATFUUWWMKC-UHFFFAOYSA-N, 1-methyl-2-(2,6-xylyloxy)ethanamine, 1-(2,6-Dimethylphenoxy)-2-aminopropane, 1-(2,6-Dimethylphenoxy)-2-amino propane, Mexitil (TN), (+-)-1-(2,6-dimethylphenoxy)propan-2-amine, (2RS)-1-(2,6-dimethylphenoxy)-2-aminopropane, 180966-61-4, 2-(2-Aminopropoxy)-1,3-DiMethyl-Benzene Hydrochloride, 1-(2,6-Xylyloxy)-2-aminopropane, 1-(2',6'-dimethyl-phenoxy)-2-amino-propane, NCGC00015659-06, dl-mexiletine, mexiletin HCl, (RS)-Mexiletine, Mexitil (Salt/Mix), (+/-)-Mexiletine, mexiletin hydrochloride, Spectrum_001602, Prestwick0_000241, Prestwick1_000241, Prestwick2_000241, Prestwick3_000241, Spectrum3_000727, Spectrum4_000795, Spectrum5_001279, D0X0RI, AC1L1HL7, AC1Q2BC5, AC1Q2BC6, Lopac0_000784, SCHEMBL16081, BSPBio_000022, BSPBio_002254, KBioGR_001270, KBioSS_002082, DivK1c_000834, SPBio_002241, BPBio1_000026, GTPL2629, DTXSID8048446, 5370-01-4 (hydrochloride), CTK4D7767, KBio1_000834, KBio2_002082, KBio2_004650, KBio2_007218, KBio3_001474, MolPort-001-790-944, NINDS_000834, Mexiletine hydrochloride (Salt/Mix), BDBM50117271, SBB070242, AKOS015890265, CCG-204869, DB00379, MCULE-1930292316, NE17727, 1-(2,6-dimethylphenoxy)prop-2-ylamine, IDI1_000834, NCGC00015659-02, NCGC00015659-03, NCGC00015659-04, NCGC00015659-05, NCGC00015659-07, NCGC00015659-08, NCGC00015659-09, NCGC00015659-10, NCGC00015659-11, NCGC00162253-01, NCGC00162253-02, 1-(2,6-dimethylphenoxy)-2-propanolamine, 2-Amino-1-(2,6-dimethylphenoxy)propane, 2-Propanamine,1-(2,4-dimethylphenoxy)-, AN-12179, BC205702, KB-55046, LS-68257, O654, SC-50523, SBI-0050762.P003, 2-(2,6-dimethylphenoxy)-1-methylethylamine, AB00053683, FT-0605484, FT-0658952, 2-(2,6-dimethylphenoxy)-1-methyl-ethylamine, EN300-54300, 2-(2,6-Dimethyl-phenoxy)-1-methyl-ethylamine, C07220, D08215, AB00053683_10, AB00053683_11, 828M714, I01-6374, W-106874, BRD-A64092382-003-04-3, BRD-A64092382-003-09-2, Z818727398, 2-(2,6-Dimethyl-phenoxy)-1-methyl-ethylamine(Mexiletine)


ID: 2349

chemical graph of compound 2349



InChIKey: VLSDXINSOMDCBK-BQYQJAHWSA-N
SMILES: CN(C)C(=O)/N=N/C(=O)N(C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5353800
synonyms found at PubChem are:
DIAMIDE, N,N,N',N'-Tetramethylazodicarboxamide, TMAD, 10465-78-8, 1,1'-Azobis(N,N-dimethylformamide), Tetramethyldiazenedicarboxamide, Diazenedicarboxamide, tetramethyl-, N,N,N',N'-Tetramethylazoformamide, Diazenedicarboxylic acid bis(N,N-dimethylamide), N,N,N',N'-Tetramethylazobisformamide, Tetramethylazodicarboxamide, Azodicarboxylic acid bis-dimethylamide, 3-(N,N-Dimethylcarbamoylimido)-1,1-dimethylurea, NSC 143013, UNII-86EQC90W32, N1,N1,N2,N2-Tetramethyldiazene-1,2-dicarboxamide, N,N,N',N'-Tetramethylazodicarboxamide(TMAD), EINECS 233-951-7, N,N,N',N'-tetramethyldiazene-1,2-dicarboxamide, A 19315, BRN 1910409, Formamide, 1,1'-azobis(N,N-dimethyl-, AI3-61614, CHEBI:48963, 86EQC90W32, NSC143013, Azodicarboxylic acid bis(dimethylamide), (E)-1-[(dimethylcarbamoyl)imino]-3,3-dimethylurea, CHEBI:48958, VLSDXINSOMDCBK-BQYQJAHWSA-N, N,N',N'-Tetramethylazodicarboxamide, 1,N-dimethylformamide), AC1Q5JWB, AC1NS4L8, SCHEMBL39340, CHEMBL1255835, N,N',N'-Tetramethylazoformamide, MolPort-003-939-540, MolPort-028-748-549, HMS3261O15, N,N',N'-Tetramethylazobisformamide, ACN-S004394, EBD53505, Formamide,1'-azobis[N,N-dimethyl-, Tox21_500397, 1040AA, AKOS006230755, CCG-204490, CS-W019102, GS-5526, NSC-143013, RTR-032400, 1,1'-Azobis (N,N-dimethyl formamide), NCGC00093824-01, NCGC00093824-02, NCGC00093824-03, NCGC00261082-01, BC650432, BP-10037, Diazenedicarboxamide, tetramethyl- (9CI), KB-49706, LS-69428, SC-24561, SY001003, (E)-1,1'-azobis(N,N-dimethylformamide), AB0069798, AB1003934, RT-015659, ST2413605, TR-032400, 4CH-016712, EU-0100397, FT-0083671, D 3648, K-0427, Azodicarboxylic acid bis(dimethylamide); diamide, (3E)-3-(dimethylcarbamoylimino)-1,1-dimethylurea, 465D788, C-31377, N,N,N&prime;,N&prime;-Tetramethylazobisformamide, SR-01000075812, (3E)-3-(dimethylcarbamoylimino)-1,1-dimethyl-urea, Diazine dicarboxylic acid bis-(N,N-dimethylamide)], J-001215, S05-0173, SR-01000075812-1, (1E)-1-(dimethyl-carbamoylimino)-3,3-dimethyl-urea, (E)-N,N,N',N'-tetramethyldiazene-1,2-dicarboxamide, (3E)-3-(Dimethylcarbamoylimino)-1,1-dimethyl-urea, 97%, 1,1 inverted exclamation marka-Azobis(N,N-dimethylformamide), 1,1'-Azobis(N,N-dimethylformamide);N,N,N',N'-Tetramethylazodicarboxamide, N,N,N inverted exclamation marka,N inverted exclamation marka-Tetramethylazodicarboxamide, N,N,N&prime;,N&prime;-Tetramethylazoformamide 1,1'-Azobis(N,N-dimethylformamide), 1,1 inverted exclamation marka-Azobis(N,N-dimethylformamide); Azodicarboxylic acid bis(dimethylamide); Diazinedicarboxylic acid


ID: 2350

chemical graph of compound 2350



InChIKey: VLSMHEGGTFMBBZ-OOZYFLPDSA-N
SMILES: CC(=C)[C@H]1CN[C@@H]([C@H]1CC(=O)O)C(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 10255
synonyms found at PubChem are:
kainic acid, Kainate, Digenic acid, 487-79-6, Helminal, Digenin, L-alpha-Kainic acid, alpha-Kainic acid, Digensaeure, Kainsaeure, Acidum kainicum, Acide kainique, Acido kainico, Kainic acid [INN:JAN], UNII-SIV03811UC, alpha- Kainic acid, Acide kainique [INN-French], Acido kainico [INN-Spanish], Acidum kainicum [INN-Latin], C10H15NO4, NSC 136038, BRN 0086660, CHEMBL275040, SIV03811UC, CHEBI:31746, VLSMHEGGTFMBBZ-OOZYFLPDSA-N, 3-Pyrrolidineacetic acid, 2-carboxy-4-isopropenyl-, NSC136038, 2-Carboxy-4-(1-methylethenyl)-3-pyrrolidineacetic Acid, NCGC00024504-05, (3S,4R)-3-(carboxymethyl)-4-(prop-1-en-2-yl)-L-proline, Kainic acid hydrate, 3-Pyrrolidineacetic acid, 2-carboxy-4-(1-methylethenyl)-, (2S,3S,4S)-, (2S-(2alpha,3beta,4beta))-2-carboxy-4-(1-methylethenyl)-3-pyrrolidineacetic acid, 3-Pyrrolidineacetic acid, 2-carboxy-4-(1-methylethenyl)-, (2S-(2alpha,3beta,4beta))-, DSSTox_CID_20526, DSSTox_RID_79503, 2-Carboxy-4-isopropenyl-3-pyrrolidineacetic acid, DSSTox_GSID_40526, (3S,4S)-3-(carboxymethyl)-4-prop-1-en-2-yl-L-proline, 2S-CARBOXY-4S-(1-METHYLETHENYL)-3S-PYRROLDINEACETIC ACID, 2-Carboxy-3-carboxymethyl-4-isopropenylpyrrolidine, (2S,3S,4S)-3-(Carboxymethyl)-4-(prop-1-en-2-yl)pyrrolidine-2-carboxylic acid, CAS-487-79-6, SR-01000075454, 3-(Carboxymethyl)-4-isopropenylproline, 1p1n, AC1L1UTB, Biomol-NT_000217, UPCMLD-DP146, OPIKA-1(TM), Lopac0_000656, SCHEMBL15777, (-)-A-KAINIC ACID, 4-22-00-01523 (Beilstein Handbook Reference), MLS001074661, BPBio1_001306, (-)-(.alpha.)-Kainic Acid, (-)-ALPHA-KAINIC ACID, 3-Pyrrolidineaceticacid, 2-carboxy-4-(1-methylethenyl)-, (2S,3S,4S)-, DTXSID7040526, UPCMLD-DP146:001, UPCMLD-DP146:002, CTK1D6000, MolPort-001-729-040, HMS2233K05, HMS3262C13, HMS3266C11, BCP11426, HY-N2309, ZINC3995575, Tox21_110905, Tox21_500656, BDBM50002369, BN0281, AKOS024456995, Tox21_110905_1, API0003067, CCG-204742, LP00656, MB00564, NSC-136038, NCGC00024504-02, NCGC00024504-03, NCGC00024504-04, NCGC00024504-06, NCGC00024504-07, NCGC00024504-08, NCGC00024504-09, NCGC00261341-01, SC-19815, SMR000471885, LS-137114, B6226, CS-0020451, EU-0100656, C12819, K 0250, SR-01000597728, 2-Carboxy-3-carboxymethyl-4-isopropenyl-pyrrolidine, SR-01000075454-1, SR-01000075454-5, SR-01000075454-6, SR-01000075454-7, SR-01000597728-1, rel-(3R,4R)-3-(carboxymethyl)-4-isopropenyl-D-proline, (2-CARBOXY-3-CARBOXYMETHYL-4-ISOPROPENYLPYRROLIDINE), (2S,3S,4S)-Carboxy-4-(1-methylethenyl)-3-pyrrolidineacetic acid, L-proline, 3-(carboxymethyl)-4-(1-methylethenyl)-, (3S,4S)-, (2S,3S,4S)-rel-2-Carboxy-4-(1-methylethenyl)-3-pyrrolidineacetic Acid, ([rel-(2|A,3|A,4|A)]-2-Caroxy-4-(1-methylethenyl)-3-pyrrolidineacetic Acid, (2S,3S,4S)-3-(carboxymethyl)-4-prop-1-en-2-ylpyrrolidine-2-carboxylic acid, [2S-(2A,3B,4B)]-2-CARBOXY-4-(1-METHYLETHENYL)-3-PYRROLIDINEACETIC ACID, 3-Pyrrolidineacetic acid, 2-carboxy-4-(1-methylethenyl)-, (2S-(2-alpha,3-beta,4-beta))-, 3-Pyrrolidineacetic acid, 2-carboxy-4-(1-methylethenyl)-, (2S-(2-alpha,3-beta,4-beta))- (9CI), 4071-38-9, 46398-96-3, InChI=1/C10H15NO4/c1-5(2)7-4-11-9(10(14)15)6(7)3-8(12)13/h6-7,9,11H,1,3-4H2,2H3,(H,12,13)(H,14,15)/t6-,7+,9-/m0/s


ID: 2351

chemical graph of compound 2351



InChIKey: VLXYTKMPCOQKEM-ZEYGOCRCSA-N
SMILES: C1CN2CC3=CCO[C@H]4CC(=O)N5[C@H]6[C@H]4[C@H]3C[C@H]2[C@@]61C7=CC=CC=C75.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 16219987
synonyms found at PubChem are:
Strychnine hydrochloride, 1421-86-9, STRYCHNINE HCl, Strychnine, monohydrochloride, UNII-9651U398A9, Strychnidin-10-one, monohydrochloride, CHEBI:90699, 9651U398A9, EINECS 215-826-9, PubChem8018, C21H22N2O2.HCl, SCHEMBL184168, Strychnine Hydrochloride Hydrate, CHEMBL2165710, strychnidin-10-one hydrochloride, DTXSID10274154, 10-oxostrychnidin-19-ium chloride, 6610AF, MFCD00058174, AKOS022180451, CCG-208325, S0257, Strychnidin-10-one, monohydrochloride (9CI), C-46118


ID: 2352

chemical graph of compound 2352



InChIKey: VLYWMPOKSSWJAL-UHFFFAOYSA-N
SMILES: COC1=NN=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)N

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5330
synonyms found at PubChem are:
sulfamethoxypyridazine, 80-35-3, Sulphamethoxypyridazine, Sulfapyridazine, Sulfalex, Midicel, Sulfametoxipiridazine, Spofadazine, Sulfdurazin, Longin, 3-Sulfa-6-methoxypyridazine, Depovernil, Lederkyn, Lisulfen, Petrisul, Piridolo, Quinoseptyl, Retasulfin, Sulfametoxipiridazina, Sulfozona, Sultirene, Altezol, Davosin, Lentac, Medicel, Midikel, Myasul, Opinsul, Paramid, Retamid, Slosul, Vinces, Durox, Kinex, Kynex, Smop, Solfametossipiridazina, Paramid Supra, 3-Methoxy-6-sulfanylamidopyridazine, 3-Sulfanilamide-6-methoxypyridazine, 3-Sulfanilamido-6-methoxypyridazine, 6-Methoxy-3-sulfanilamidopyridazine, 6-Sulfanilamido-3-methoxypyridazine, Sulfamethoxypyridazinum, Sulfamethoxipyridazinum, 3-(p-Aminobenzenesulfamido)-6-methoxypyridazine, 4-amino-N-(6-methoxypyridazin-3-yl)benzenesulfonamide, 3-p-Aminobenzenesulphonamido-6-methoxypyridazine, sulfamethoxipyridazine, Benzenesulfonamide, 4-amino-N-(6-methoxy-3-pyridazinyl)-, 6-Methoxy-3-pyridazinylsulfanilamide, UNII-T034E4NS2Z, 4-Amino-N-(6-methoxy-3-pyridazinyl)-benzenesulfonamide, Solfametossipiridazina [DCIT], RP 7522, CL 13494, CHEBI:102516, Sulfamethoxypyridazinum [INN-Latin], Sulfametoxipiridazina [INN-Spanish], EINECS 201-272-5, 3-(4-Aminobenzenesulfonamido)-6-methoxypyridazine, BRN 0277076, Sulfamethoxypyridazine [INN], 4-amino-N-(6-methoxy-3-pyridazinyl)benzenesulfonamide, MLS000069641, N1-(6-Methoxy-3-pyridazinyl)sulfanilamide, T034E4NS2Z, N(1)-(6-Methoxy-3-pyridazinyl)sulfanilamide, N(sup 1)-(6-Methoxy-3-pyridazinyl)sulfanilamide, 4-Amino-N-(6-methoxy-3-pyridazinyl)benzolsulfonamid, NCGC00016324-01, SMR000018386, DSSTox_CID_3611, DSSTox_RID_77108, DSSTox_GSID_23611, Sulfamethoxypyridazine (INN), W-104237, Sulfanilamide, N(sup 1)-(6-methoxy-3-pyridazinyl)-, 4-Amino-N-(6-methoxy-pyridazin-3-yl)-benzenesulfonamide, benzenesulfonamide,4-amino-n-(6-methoxy-3-pyridazinyl)-, CAS-80-35-3, SR-01000000179, sulfapiridazin, Retasulphine, Kineks, Lederkyn (TN), Prestwick_118, PubChem8598, Sulfamethoxypyridazine [USP:INN:BAN], Spectrum_001151, Opera_ID_698, Prestwick0_000724, Prestwick1_000724, Prestwick2_000724, Prestwick3_000724, Pyridazine, sulfamethoxy-, Spectrum2_001429, Spectrum3_001462, Spectrum4_000430, Spectrum5_001187, Epitope ID:122239, Sulphamethazine Sodium Salt, AC1Q4DH0, Oprea1_275757, SCHEMBL93617, BSPBio_000648, BSPBio_002983, KBioGR_000760, KBioSS_001631, 5-25-12-00424 (Beilstein Handbook Reference), MLS000100719, MLS001148433, DivK1c_000239, SPECTRUM1501156, SPBio_001538, SPBio_002587, AC1L1K45, BPBio1_000714, CHEMBL268869, DTXSID5023611, HMS500L21, KBio1_000239, KBio2_001631, KBio2_004199, KBio2_006767, KBio3_002483, ZINC49141, MolPort-000-697-322, NINDS_000239, VLYWMPOKSSWJAL-UHFFFAOYSA-N, HMS1570A10, HMS1921L17, HMS2092J05, HMS2097A10, HMS2234F17, HMS3652H21, HMS3714A10, Pharmakon1600-01501156, 3-Methoxy-6-sulfanilamidopyridazine, HY-B1387, Tox21_110373, AN-684, CCG-38976, NSC757875, s4250, AKOS000605846, Tox21_110373_1, API0004274, CS-4821, MCULE-1902045342, NSC-757875, SDCCGMLS-0003277.P003, IDI1_000239, NCGC00016324-02, NCGC00016324-03, NCGC00016324-04, NCGC00016324-05, NCGC00016324-06, NCGC00016324-09, NCGC00022232-03, NCGC00022232-04, AC-12005, BAS 00226406, H467, N-(6-Methoxy-3-pyridazinyl)sulfanilamide, SC-06824, ST007537, SBI-0051666.P002, Sulfamethoxypyridazine, analytical standard, KB-271163, LS-147808, AB00052228, FT-0653623, S0591, D02439, Sulfanilamide, N1-(6-methoxy-3-pyridazinyl)-, AB00052228_12, A839894, C-44344, SR-01000000179-3, SR-01000000179-4, Sulfamethoxypyridazine 100 microg/mL in Acetonitrile, BRD-K00938507-001-05-3, BRD-K00938507-001-13-7, [(4-aminophenyl)sulfonyl](6-methoxypyridazin-3-yl)amine, 4-azanyl-N-(6-methoxypyridazin-3-yl)benzenesulfonamide, F0391-0002, 4-amino-N-(6-methoxypyridazin-3-yl)benzene-1-sulfonamide, 4-amino-N-[6-(methyloxy)pyridazin-3-yl]benzenesulfonamide, Sulfamethoxypyridazine, VETRANAL(TM), analytical standard, 4-Amino-N-(6-methoxy-3-pyridazinyl)-benzenesulfonamide (9CI), Sulfamethoxypyridazine, European Pharmacopoeia (EP) Reference Standard


ID: 2353

chemical graph of compound 2353



InChIKey: VMAQYKGITHDWKL-REOHCLBHSA-N
SMILES: C[C@H]1C(=O)NC(=O)N1

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6419931
synonyms found at PubChem are:
(S)-5-METHYLHYDANTOIN, Methylhydantoin-5-(L), 40856-73-3, (l)-5-methylhydantoin, Prestwick_215, AC1O4WGH, Prestwick0_000860, Prestwick1_000860, Prestwick2_000860, Prestwick3_000860, Prestwick3_000864, (5S)-5-Methylhydantoin, L-5-METHYLHYDANTOIN, BSPBio_000879, BSPBio_000907, SPBio_002800, BPBio1_000967, BPBio1_000999, SCHEMBL8110002, CHEBI:94659, DTXSID70423560, VMAQYKGITHDWKL-REOHCLBHSA-N, HMS1570L21, HMS2097L21, HMS2097N09, HMS3714L21, ZINC1701819, FCH951677, (S)-5-methylimidazolidine-2,4-dione, CCG-220860, L16M035, (5S)-5-methylimidazolidine-2,4-dione, ACM40856733, NCGC00179379-01, NCGC00179379-02, CJ-28736, FT-0671818, BRD-K56033645-001-01-8


ID: 2354

chemical graph of compound 2354



InChIKey: VMAQYKGITHDWKL-UWTATZPHSA-N
SMILES: C[C@@H]1C(=O)NC(=O)N1

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 1615267
synonyms found at PubChem are:
55147-68-7, Methylhydantoin-5-(D), (R)-5-METHYLHYDANTOIN, (D)-5-Methylhydantoin, (5R)-5-methylimidazolidine-2,4-dione, 5(R)-Methylimidazolidine-2,4-dione, 2,4-Imidazolidinedione,5-methyl-, (5R)-, SR-01000872638, Prestwick_214, Prestwick0_000864, Prestwick1_000864, Prestwick2_000864, (5R)-5-Methylhydantoin, AC1LUR21, (R)-(+)-5-Methylhydantoin, SPBio_002828, SCHEMBL6100849, CHEMBL1394088, CHEBI:95229, CTK5A3111, DTXSID90364603, VMAQYKGITHDWKL-UWTATZPHSA-N, HMS1570N09, HMS3714N09, ZINC1845971, 2120AH, (R)-5-Methyl-2,4-imidazolidinedione, (R)-5-methylimidazolidine-2,4-dione, AKOS006272225, CCG-220864, (5R)-5-Methyl-2,4-imidazolidinedione, NCGC00016847-01, NCGC00016847-02, AN-40444, CJ-30192, CAS-40856-73-3, CAS-55147-68-7, FT-0671817, 147M687, SR-01000872638-1, SR-01000872638-2


ID: 2355

chemical graph of compound 2355



InChIKey: VMKWINFBLIASSN-UHFFFAOYSA-N
SMILES: CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)O)NC(=O)C(CCSC)N.CC(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5702202
synonyms found at PubChem are:
METHIONYL-LEUCYLPHENYLALANINE ACETATE, AC1NWAUE, SPECTRUM1502177, CHEMBL1535897, SCHEMBL15201179, HMS502K11, CCG-39567, NCGC00095873-01, acetic acid; 2-[[2-[(2-amino-4-methylsulfanylbutanoyl)amino]-4-methylpentanoyl]amino]-3-phenylpropanoic acid


ID: 2356

chemical graph of compound 2356



InChIKey: VMLDPXIOBIJNAW-UHFFFAOYSA-N
SMILES: CN1CCC2=CC3=C(C(=C2C1)OC)OCO3.Br

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5459345
synonyms found at PubChem are:
NSC99784, Hydrocofarmine, AC1NURG0, 4-methoxy-6-methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolin-6-ium bromide, Hydrocotarnine hydrobromide, 5985-00-2, UNII-XSR2NNV6TM, XSR2NNV6TM, DSSTox_CID_25392, DSSTox_RID_80849, DSSTox_GSID_45392, Prestwick_267, NCGC00016666-01, CAS-5985-00-2, HYDROCOFARMINE HBR, AC1O4WGO, MLS002153904, SCHEMBL4281040, CHEMBL1569495, DTXSID9045392, HMS1569J12, Tox21_110552, CCG-38859, NSC-99784, Tox21_110552_1, 1,3-Dioxolo(4,5-g)isoquinoline, 5,6,7,8-tetrahydro-4-methoxy-6-methyl-, hydrobromide (1:1), 5,6,7,8-Tetrahydro-4-methoxy-6-methyl-1,3-dioxolo(4,5-g)isoquinoline hydrobromide, 8-Methoxy-5,6-methylenedioxy-2-methyl-1,2,3,4-tetrahydroisoquinoline hydrobromide, NCGC00016666-06, SMR001233253, FT-0627128, EN300-191460, SR-01000842151, SR-01000842151-3, 1,5-g]isoquinoline, 5,6,7,8-tetrahydro-4-methoxy-6-methyl-, hydrobromide, 4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinoline hydrobromide


ID: 2357

chemical graph of compound 2357



InChIKey: VNFPBHJOKIVQEB-UHFFFAOYSA-N
SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3Cl)N4C=CN=C4

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 2812
synonyms found at PubChem are:
clotrimazole, 23593-75-1, Lotrimin, Canesten, Mycelex, Mycosporin, Empecid, Clotrimazol, Mykosporin, Gyne lotrimin, Chlotrimazole, Trimysten, 1-(o-Chlorotrityl)imidazole, Mycelex G, Rimazole, Mycelex 7, Tibatin, Mono-baycuten, Lotrimin AF Cream, Mycelex Troches, Gyne-Lotrimin, Lotrimin AF Solution, Mycelex OTC, Canestine, Pedisafe, Veltrim, Gynix, Lotrimin Af, Trivagizole 3, Desamix F, Mycelex-G, Fem Care, Gyne-Lotrimin 3, Mycelex-7, Clotrimazolum, Monobaycuten, (Chlorotrityl)imidazole, Canifug, BAY b 5097, 1-((2-Chlorophenyl)diphenylmethyl)-1H-imidazole, Lotrimax, Lotrimin AF Jock-Itch Cream, Mycelax, Mycofug, Mycelex-7 Combination Pack, BAY 5097, Gyne-Lotrimin Combination Pack, Clotrimaderm, Klotrimazole, 1-(o-Chloro-alpha,alpha-diphenylbenzyl)imidazole, Canestene, Clomatin, Cutistad, Esparol, Kanesten, Stiemazol, Nalbix, Gyne-Lotrimin 3 Combination Pack, FemCare, Lotrimin Lotion, Canesten Cream, Gino-Lotremine, Lotrimin Cream, Mycelex Cream, Myclo Solution, Mycelex Solution, Myclo Cream, Myclo-Gyne, Pan-Fungex, Bay-B 5097, Canesten Solution, Lotrimin Solution, Neo-Zol Cream, Mycelex Twin Pack, Lotrimin (TN), Lotrimin AF Lotion, Mycelex (TN), Clotrimazol [INN-Spanish], Clotrimazolum [INN-Latin], 1-(o-Chlorophenyldiphenylmethyl)imidazole, Myclo Spray Solution, clotrimeizol, (2-Chlorophenyl)diphenyl-1-imidazolylmethane, Cimitidine, Diphenyl(2-chlorophenyl)(1-imidazolyl)methane, Diphenyl-(2-chlorophenyl)-1-imidazolylmethane, 1-(alpha-(2-Chlorophenyl)benzhydryl)imidazole, NSC 257473, Canesten 1-Day Therapy, Canesten 3-Day Therapy, Canesten 6-Day Therapy, FB 5097, 1H-Imidazole, 1-[(2-chlorophenyl)diphenylmethyl]-, Mycelex: MycosporinRimazole, DRG-0072, Bay b 9057, C22H17ClN2, Prestwick_120, B 5097, UNII-G07GZ97H65, Bis-phenyl-(2-chlorophenyl)(1-imidazoyl)methane, CCRIS 6245, Canesten 1-Day Cream Combi-Pak, Methane, bis-phenyl-(2-chlorophenyl)-1-imidazolyl-, HSDB 3266, Canesten Combi-Pak 1-Day Therapy, Canesten Combi-Pak 3-Day Therapy, FB b 5097, Bisphenyl-(2-chlorphenyl)-1-imidazolyl-methan, Clotrimazole [USAN:INN:BAN:JAN], EINECS 245-764-8, Lopac-C-6019, NSC257473, 1-[(2-Chlorophenyl)diphenylmethyl]-1H-imidazole, CHEMBL104, 1-[(2-chlorophenyl)(diphenyl)methyl]-1H-imidazole, 1H-Imidazole, 1-((2-chlorophenyl)diphenylmethyl)-, BRN 0622318, GNF-Pf-3499, MLS000028502, CHEBI:3764, 1-((o-Chloro-phenyl)diphenylmethyl)imidazole, 1-[(2-chlorophenyl)-diphenylmethyl]imidazole, Bis-fenil-(2-clorofenil)-1-imidazolil-metano, 1-[(2-chlorophenyl)-diphenyl-methyl]imidazole, VNFPBHJOKIVQEB-UHFFFAOYSA-N, G07GZ97H65, Bis-fenil-(2-clorofenil)-1-imidazolil-metano [Italian], Bisphenyl-(2-chlorphenyl)-1-imidazolyl-methan [German], NCGC00015251-02, CPD000058306, SMR000058306, CAS-23593-75-1, DSSTox_CID_9871, C 6019, Bis-phenyl-(2-chlorophenyl)-1-imidazoyl)methane, DSSTox_RID_78827, DSSTox_GSID_29871, CLT, Imidazole, 1-(o-chloro-alpha,alpha-diphenylbenzyl)-, 1-(o-Chloro-.alpha.,.alpha.-diphenylbenzyl)imidazole, Jidesheng, SR-01000075771, chlortrimazole, clortrimazole, locasten, Otomax, Gyne-Lotrimin3, Clotrimaderm Cream, Clotrimazole,(S), Candinil (TN), Canesten (TN), Clobrate VT (TN), Cancap-VT (TN), Lotrimin AF, Mycelex, Clotrimazole(Canesten), Candid Vaginal (TN), clotrimazole crystalline, Clotrimazole [USAN:USP:INN:BAN:JAN], Spectrum_001343, Clotrimazole (Canesten), AC1L1EIW, Prestwick0_000267, Prestwick1_000267, Prestwick2_000267, Prestwick3_000267, Spectrum2_000128, Spectrum3_000359, Spectrum4_000295, Spectrum5_000781, Candid - V Gel (TN), Clotrimazole Schering Brand, D09GOS, NCIMech_000609, cid_2812, SCHEMBL3850, 1-(2-chlorotrityl)imidazole, BIDD:PXR0036, Lopac0_000315, BSPBio_000114, BSPBio_002057, KBioGR_000850, KBioSS_001823, 5-23-04-00291 (Beilstein Handbook Reference), MLS000758243, MLS001423972, BIDD:GT0450, DivK1c_000665, SPECTRUM1500200, BAY b5097, BAYb 5097, Schering Brand of Clotrimazole, SPBio_000176, SPBio_002333, Bayer Brand 1 of Clotrimazole, Bayer Brand 2 of Clotrimazole, BPBio1_000126, GTPL2330, component of Otomax (Salt/Mix), DTXSID7029871, Gyne-Lotrimin3 Combination Pack, BDBM31774, Clotrimazole (JP15/USP/INN), Clotrimazole (JP17/USP/INN), HMS502B07, KBio1_000665, KBio2_001823, KBio2_004391, KBio2_006959, KBio3_001277, KS-00000XNX, Imidazole, 1-(o-chloro-.alpha.,.alpha.-diphenylbenzyl)-, component of Lotrimax (Salt/Mix), MolPort-002-557-756, NINDS_000665, HMS1568F16, HMS1920O21, HMS2051E11, HMS2091G10, HMS2095F16, HMS2235E20, HMS3260P12, HMS3369I03, HMS3393E11, HMS3655I09, HMS3712F16, Pharmakon1600-01500200, Imidazole,.alpha.-diphenylbenzyl)-, BAY-5097, BCP02150, ZINC3807804, Tox21_110111, Tox21_300415, Tox21_500315, AC-279, CCG-35563, MFCD00057220, NSC756700, s1606, STK700023, AKOS005607024, Tox21_110111_1, AN-5543, API0002086, CS-1926, DB00257, LP00315, MCULE-6862012558, NC00035, NSC-257473, NSC-756700, IDI1_000665, MRF-0000070, QTL1_000024, NCGC00015251-01, NCGC00015251-03, NCGC00015251-04, NCGC00015251-05, NCGC00015251-06, NCGC00015251-07, NCGC00015251-08, NCGC00015251-09, NCGC00015251-10, NCGC00015251-11, NCGC00015251-13, NCGC00015251-14, NCGC00093761-01, NCGC00093761-02, NCGC00093761-03, NCGC00093761-04, NCGC00093761-05, NCGC00093761-06, NCGC00254538-01, NCGC00261000-01, [(2-chlorophenyl)diphenylmethyl]imidazole, 1-(o-chloro-a,a-diphenylbenzyl)imidazole, AS-13816, BC204099, HY-10882, LS-78271, N713, SAM001247056, SC-17936, 1-(2-Chloro-?,?-diphenylbenzyl)imidazole, SBI-0050303.P004, AB0015989, AB1009401, 1-[(2-Chlorophenyl)diphenylmethyl]imidazole, 455-EP2272972A1, 455-EP2272973A1, 455-EP2275420A1, 455-EP2277872A1, 455-EP2281816A1, 455-EP2292595A1, 455-EP2295055A2, 455-EP2295416A2, 455-EP2298748A2, 455-EP2298764A1, 455-EP2298765A1, 455-EP2305642A2, 455-EP2311453A1, 455-EP2311808A1, 455-EP2311829A1, AB00051951, EU-0100315, FT-0603193, ST50994242, C06922, D00282, J10369, 1-(.alpha.-(2-Chlorophenyl)benzhydryl)imidazole, 1-[(2-chlorophenyl)-di(phenyl)methyl]imidazole, AB00051951-14, AB00051951_15, AB00051951_16, Clotrimazole, VETRANAL(TM), analytical standard, 593C751, A816789, 1H-Imidazole, 1-[(2-chlorophenyl)-diphenylmethyl], I01-3474, SR-01000075771-1, SR-01000075771-6, SR-01000075771-8, W-107394, 1-[(2-Chloro-phenyl)-diphenyl-methyl]-1H-imidazole, BRD-K15916496-001-14-7, SR-01000075771-10, 1-((2-Chlorophenyl)diphenylmethyl)-1H-imidazole (9CI), 3ACDFDF8-38E3-4368-85D0-BDF8AE1E6591, Clotrimazole, European Pharmacopoeia (EP) Reference Standard, Clotrimazole, United States Pharmacopeia (USP) Reference Standard, Clotrimazole for peak identification, European Pharmacopoeia (EP) Reference Standard, Clotrimazole, Pharmaceutical Secondary Standard; Certified Reference Material, 1-(o-Chloro-|A,|A-diphenylbenzyl)imidazole; 1-(o-Chlorotrityl)imidazole; 1-[(2-Chlorophenyl)diphenylmethyl]-1H-imidazole, 117829-71-7


ID: 2358

chemical graph of compound 2358



InChIKey: VNJHUUNVDMYCRH-UHFFFAOYSA-N
SMILES: CS(=O)(=O)O.C1CCN(CC1)CCC(C2=CC=CC=C2)(C3=CC=CC=C3)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 165542
synonyms found at PubChem are:
Pridinol methanesulfonate, 6856-31-1, Pridinol methanesulfonate salt, Loxeen, UNII-AQ4K0AJT6G, Prestwick_138, AQ4K0AJT6G, MLS000069569, Pridinol mesylate, SMR000058822, 511-45-5 (Parent), SR-01000000125, C20H25NO.CH4O3S, 229-953-2{methanesulfonate}, EINECS 229-953-2, Konlax (TN), Opera_ID_274, AC1L4WU0, AC1Q6WE6, MLS001074110, MLS002222172, SCHEMBL195084, SPECTRUM1503077, CHEMBL1528011, REGID_for_CID_165542, HMS502E08, DTXSID40218667, MolPort-003-666-435, VNJHUUNVDMYCRH-UHFFFAOYSA-N, HMS1570O20, HMS1922C17, HMS2097O20, HMS2233N07, HMS3370K22, HMS3714O20, Pharmakon1600-01503077, 2669AH, CCG-39523, NSC758235, AKOS026750021, NSC-758235, NCGC00017067-01, NCGC00017067-02, NCGC00017067-03, NCGC00094998-01, NCGC00094998-02, CAS-6856-31-1, LS-122263, TX-017928, FT-0674030, D02064, C-54941, Pridinol methanesulfonate salt, analytical standard, SR-01000000125-3, SR-01000000125-4, 3-Piperidino-1,1-diphenyl-1-propanol Methanesulfonate, 1,1-diphenyl-3-(piperidin-1-yl)propan-1-ol methanesulfonate, 1,1-diphenyl-3-piperidin-1-ylpropan-1-ol;methanesulfonic acid, 1,1-diphenyl-3-piperidin-1-ylpropan-1-ol; methanesulfonic acid


ID: 2359

chemical graph of compound 2359



InChIKey: VNPLYCKZIUTKJM-UHFFFAOYSA-N
SMILES: CC1=NC=CC2=C1NC3=C2C=CC(=C3)OC.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 22382
synonyms found at PubChem are:
HARMINE, HYDROCHLORIDE, DIHYDRATE, AC1L2KAK, LS-74063, 7-methoxy-1-methyl-9H-pyrido[3,4-b]indol-9-ium chloride, Harmine Hydrochloride, 343-27-1, 7-Methoxy-1-methyl-9H-pyrido[3,4-b]indole hydrochloride, HARMINE HCl, Harmine monohydrochloride, UNII-T89I34ODAA, CCRIS 7889, EINECS 206-443-8, NSC 29844, T89I34ODAA, 7-Methoxy-1-methyl-9H-pyrido(3,4-b)indole hydrochloride, H-1250, Q-100415, MLS002153910, 9H-Pyrido(3,4-b)indole, 7-methoxy-1-methyl-, monohydrochloride (8CI,9CI), SMR001233259, HarmineHydrochloride, Prestwick_254, Harmine-hydrochloride, ACMC-1CNHB, Banisterine Hydrochloride, AC1NSDZ6, 9H-Pyrido(3,4-b)indole, 7-methoxy-1-methyl-, monohydrochloride, HARMINE, HYDROCHLORIDE, SCHEMBL1469013, CHEMBL1593867, DTXSID7052024, CTK1C2681, MolPort-003-941-580, VNPLYCKZIUTKJM-UHFFFAOYSA-N, HMS1569L08, KS-000014NE, NSC29844, ANW-27839, NSC-29844, AKOS015844691, API0002889, CCG-208113, MCULE-1526029133, TRA0043265, VZ32324, Harmine hydrochloride, >=98% (HPLC), NCGC00016435-08, AK111267, LS-74062, 7-methoxy-1-methylbeta-carboline, chloride, AX8014624, DB-048599, KB-249996, TR-014235, 4CH-024474, FT-0626861, N2182, ST24045677, ST50309255, X1159, WLN: T B656 EN HMJ F1 KO1 & GH, A-8022, SR-05000001527-6, 9H-Pyrido[3, 7-methoxy-1-methyl-, monohydrochloride, I14-18832, 7-Methoxy-1-methyl-9H-pyrido (3,4-b) indole hydrochloride, 7-Methoxy-1-methyl-9H-pyrido-[3,4-b]indole hydrochloride


ID: 2360

chemical graph of compound 2360



InChIKey: VNYBTNPBYXSMOO-UHFFFAOYSA-M
SMILES: C[N+]1=CC=CC(=C1)OC(=O)N(C)C.[Br-]

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 7550
synonyms found at PubChem are:
PYRIDOSTIGMINE BROMIDE, Mestinon, 101-26-8, Regonol, Kalimin, Kalymin, Regonal, Mestinon bromide, 3-((Dimethylcarbamoyl)oxy)-1-methylpyridin-1-ium bromide, 3-(Dimethylcarbamoyloxy)-1-methylpyridinium Bromide, Pyridostigmine (bromide), UNII-KVI301NA53, Piridostigmina bromuro [DCIT], CCRIS 6798, HSDB 3924, 3-[(dimethylcarbamoyl)oxy]-1-methylpyridin-1-ium bromide, EINECS 202-929-9, Pyridostigmini bromidum [INN-Latin], Ro 1-5130, Bromure de pyridostigmine [INN-French], Pyridostigmini bromidum, Bromuro de piridostigmina [INN-Spanish], MLS000028385, Bromure de pyridostigmine, Bromuro de piridostigmina, KVI301NA53, Pyridinium, 3-(((dimethylamino)carbonyl)oxy)-1-methyl-, bromide, 3-(Dimethylcarbamyloxy)-1-methylpyridinium bromide, 1-Methyl-3-hydroxypyridinium bromide dimethylcarbamate, NCGC00094324-02, 3-(((Dimethylamino)carbonyl)oxy)-1-methylpyridinium bromide, Pyridinium, 3-hydroxyl-1-methyl-, bromide, dimethylcarbamate, SMR000058605, 3-Hydroxy-1-methylpyridinium bromide dimethylcarbamate (ester), Mestinon (TN), Dimethylcarbamic acid ester of 3-hydroxy-1-methylpyridinium bromide, Pyridinium, 3-[[(dimethylamino)carbonyl]oxy]-1-methyl-, bromide, DSSTox_CID_3540, Carbamic acid, dimethyl-, ester with 3-hydroxy-1-methylpyridinium bromide, 3-Hydroxy-1-methylpyridinium bromide dimethylcarbamate, DSSTox_RID_77069, DSSTox_GSID_23540, 3-Dimethylaminocarbonyloxy-N-methylpyridinium bromide, CHEMBL812, (1-methylpyridin-1-ium-3-yl) N,N-dimethylcarbamate bromide, 3-[[(Dimethylamino)carbonyl]oxy]-1-methylpyridinium bromide, Pyridinium, 3-hydroxy-1-methyl-, bromide, dimethylcarbamate (ester), 3-Dimethylcarbamoyloxy-1-methylpyridinium bromide;3-Dimethylcarbamoyloxy-1-methylpyridinium bromide, CAS-101-26-8, Piridostigmina bromuro, SR-01000003072, pybr, (1-methylpyridin-1-ium-3-yl) N,N-dimethylcarbamate;bromide, 3-{[(dimethylamino)carbonyl]oxy}-1-methylpyridinium bromide, Lefaxin, Mestinon;Regonol, PubChem15395, Opera_ID_420, Pyridostigmine bromide [USP:INN:BAN:JAN], AC1Q1RCO, Pyridostigmine bromide [USAN:INN:BAN:JAN], D09KKU, AC1L1P0M, SCHEMBL41147, KSC492K0L, MLS001074080, SPECTRUM1503240, CHEBI:8666, DTXSID9023540, CTK3J2505, HMS500K09, HY-B0207A, KS-00000YPC, MolPort-003-666-466, Pyridostigmine Bromide (Mestinon), HMS1922M05, HMS2092P14, HMS2234D06, HMS3259M16, HMS3263O11, HMS3369P02, HMS3651G13, Pharmakon1600-01503240, BCP02148, Tox21_111266, Tox21_501035, AN-937, ANW-41310, CCG-40306, LS-329, MFCD00079283, NSC679759, NSC758435, s1608, AKOS015895321, Tox21_111266_1, AC-8143, CS-2148, LP01035, MCULE-9535630272, NC00581, NE58261, NSC-679759, NSC-758435, RTR-000353, NCGC00015862-07, NCGC00094324-01, NCGC00094324-03, NCGC00094324-04, NCGC00261720-01, Pyridostigmine bromide (JP17/USP/INN), AS-13164, CPD000058605, H494, SAM002564227, SC-16827, AB0013077, AB2000158, TR-000353, EU-0101035, FT-0081402, FT-0603307, P1339, ST24041332, ST51015114, D00487, P 9797, 3-(dimethylcarbamyloxy)-1-methylpyridiniumbromide, 1-methyl-3-hydroxypyridiniumbromidedimethylcarbamate, 3-hydroxy-1-methylpyridiniumbromidedimethylcarbamate, I06-0719, Q-201644, SR-01000003072-2, SR-01000003072-4, N,N-DIMETHYLAMINOFORMIC ACID 3-PYRIDINYL ESTER, 3-(Dimethylaminocarbonyloxy)-1-methylpyridinium bromide, Z1541632810, 3-(((dimethylamino)carbonyl)oxy)-1-methyl-pyridiniubromide, 3-hydroxy-1-methylpyridiniumbromidedimethylcarbamate(ester), N,N-dimethyl(1-methyl(3-pyridyloxy))carboxamide, bromide, dimethylcarbamicacidesterof3-hydroxy-1-methylpyridiniumbromide, Pyridostigmine bromide, European Pharmacopoeia (EP) Reference Standard, Pyridostigmine bromide, United States Pharmacopeia (USP) Reference Standard, RGVNPYSNWCWTBT-UHFFFAOYSA-N, Pyridinium, 3-hydroxy-1-methyl-, bromide, dimethylcarbamate


ID: 2361

chemical graph of compound 2361



InChIKey: VOCGSQHKPZSIKB-UHFFFAOYSA-N
SMILES: CC(=CCC1=C(C=C2C(=C1)C(=O)CC(O2)C3=CC=C(C=C3)O)OC)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 122835
synonyms found at PubChem are:
Bavachinin, 7-O-Methylbavachin, Bavachinin A, BRN 3629340, 4'-Hydroxy-7-methoxy-6-(3-methyl-2-butenyl)flavanone, Flavanone, 4'-hydroxy-7-methoxy-6-(3-methyl-2-butenyl)-, 2-(4-hydroxyphenyl)-7-methoxy-6-(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one, 4H-1-Benzopyran-4-one, 2,3-dihydro-2-(4-hydroxyphenyl)-7-methoxy-6-(3-methyl-2-butenyl)-, (S)-, Bavachinin (1), AC1L3VCO, 5-18-04-00132 (Beilstein Handbook Reference), SCHEMBL497829, VOCGSQHKPZSIKB-UHFFFAOYSA-N, BDBM246521, LMPK12140040, LS-39562, FT-0688288, ST50331516, 2-(4-hydroxyphenyl)-7-methoxy-6-(3-methylbut-2-enyl)chroman-4-one, Flavanone, 4'-hydroxy-7-methoxy-6-(3-methyl-2-butenyl)- (8CI), 4H-1-Benzopyran-4-one, 2,3-dihydro-2-(4-hydroxyphenyl)-7-methoxy-6-(3-methyl-2-buten-1-yl)-, (2S)-


ID: 2362

chemical graph of compound 2362



InChIKey: VOROEQBFPPIACJ-UHFFFAOYSA-N
SMILES: C(CC(C(=O)O)N)CP(=O)(O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 1216
synonyms found at PubChem are:
76326-31-3, 5-Phosphononorvaline, DL-AP5, 2-Amino-5-phosphonopentanoic acid, 2-Amino-5-phosphovaleric acid, DL-2-Amino-5-phosphonopentanoic acid, DL-2-Amino-5-phosphonovaleric acid, 2-Amino-5-phosphonovaleric Acid, 2-Amino-5-phosphopentanoic acid, 2-AMINO-5-PHOSPHONOVALERATE, 2-Amino-5-phosphonopentanoate, dl-APV, AP-5, Norvaline, 5-phosphono-, 76726-92-6, CHEMBL28862, CHEBI:138644, 2-Amino-5-phosphono-pentanoic acid, IN1533, (+/-)-Amino-5-phosphono-pentanoic acid, 5-phosphono-L-norvaline, (+/-)-2-Amino-5-phosphonopentanoic acid, App acid, C5H12NO5P, Apv acid, 79055-67-7, 2-APV, SR-01000075417, L(+)-2-Amino-5-phosphonopentanoic acid, L-2-Amino-5-phosphopentanoic acid, AC1L1AZB, (R)-2-Amino-5-phosphono-pentanoic acid, 5-Phosphono-DL-norvaline, AC1Q50BS, DL-Norvaline, 5-phosphono-, Lopac0_000018, MLS002153456, SCHEMBL158652, D -AP5, CTK5E3350, VOROEQBFPPIACJ-UHFFFAOYSA-, MolPort-000-838-070, MolPort-003-925-572, HMS3260C17, DL-2-amino-5-phosphono valericacid, Tox21_500018, BDBM50004897, BN0086, IN1903, IN2304, DL-2-Amino-5-phosphono-valeric acid, (R)-2-amino-5-phosphonopentanoicacid, AKOS005067826, (y)-2-Amino-5-phosphonopentanoic acid, AN-6706, CCG-204114, LP00018, MCULE-8623591326, TRA0081913, (?)-2-Amino-5-phosphonopentanoic acid, DL -2-Amino-5-phosphono- valeric acid, NCGC00015065-03, NCGC00015065-04, NCGC00015065-05, NCGC00024470-02, NCGC00024470-03, NCGC00260703-01, (APV)2-Amino-5-phosphono-pentanoic acid, 2-Amino-5-phosphono-pentanoic acid anion, LS-97531, SMR000326892, DB-056047, DL-2-Amino-5-phosphonovaleric acid, 98%, 2-Amino-5-phosphono-pentanoic acid(D-AP5), 2-Amino-5-phosphono-pentanoic acid(R-AP5), 2-Amino-5-phosphono-pentanoic acid(S-AP5), D -(-)-2-Amino-5-phosphono- valeric acid, DL-2-Amino-5-phosphonopentanoic acid, solid, EU-0100018, FT-0641590, A 5282, C13734, D-(-)-2-AMINO-5-PHOSPHONO-PENTANOIC ACID, L-(+)-2-AMINO-5-PHOSPHONO-PENTANOIC ACID, (+/-)-2-AMINO-5-PHOSPHONO-PENTANOIC ACID, SR-01000075417-1, SR-01000075417-3, ( inverted question mark)-2-Amino-5-phosphonopentanoic acid, ( inverted question mark)-AP-5; ( inverted question mark)-AP-V, InChI=1/C5H12NO5P/c6-4(5(7)8)2-1-3-12(9,10)11/h4H,1-3,6H2,(H,7,8)(H2,9,10,11), AC1MZVFT, 2-azaniumyl-5-phosphonopentanoate


ID: 2363

chemical graph of compound 2363



InChIKey: VOUDTVRGPAGHGA-SQIPALKSSA-N
SMILES: CC(=O)O[C@@H]1C[C@@H]2[C@](C=CC(=O)C2(C)C)([C@@H]3[C@@]1(C4=CC(=O)O[C@H]([C@@]4(CC3)C)C5=COC=C5)C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 23241800
synonyms found at PubChem are:
Deoxygedunin, 21963-95-1, (1R,4bR,5R,6aR,10aR,10bR,12aR)-1-(Furan-3-yl)-4b,7,7,10a,12a-pentamethyl-3,8-dioxo-3,4b,5,6,6a,7,8,10a,10b,11,12,12a-dodecahydro-1H-naphtho[2,1-f]isochromen-5-yl acetate, 14,15-deoxygedunin, GEDUNIN,15-DEOXY, SCHEMBL598727, CHEMBL482795, DTXSID90631483, NSC309913, NSC-309913, [(1R,4bR,5R,6aR,10aR,10bR,12aR)-1-(furan-3-yl)-4b,7,7,10a,12, (1R,4bR,5R,6aR,10aR,10bR,12aR)-1-(Furan-3-yl)-4b,7,7,10a,12a-pentamethyl-3,8-dioxo-3,4b,5,6,6a,7,8,10a,10b,11,12,12a-dodecahydro-1H-phenanthro[2,1-c]pyran-5-yl acetate, 16,14,20,22-tetraen-16-oic acid, 7-(acetyloxy)-21,23-epoxy-17-hydroxy-4,4,8-trimethyl-3-oxo-, .delta.-lactone, (5.alpha.,7.alpha.,13.alpha.,17.alpha.)-, 8.beta.-Podocarp-1-ene-.DELTA.14, 13.beta.-(3-furylhydroxymethyl)-7.alpha.-hydroxy-8,13-dimethyl-3-oxo-, 14,13-lactone, acetate, D-Homo-24-nor-17-oxachola-1,20,22-tetraene-3,16-dione, 7-(acetyloxy)-21,23-epoxy-4,4,8-trimethyl-, (5.alpha.,7.alpha.,13.alpha.,17a.alpha.)-


ID: 2364

chemical graph of compound 2364



InChIKey: VOXZDWNPVJITMN-ZBRFXRBCSA-N
SMILES: C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=C3C=CC(=C4)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5757
synonyms found at PubChem are:
estradiol, beta-Estradiol, 17beta-Estradiol, 50-28-2, Oestradiol, Dihydrofolliculin, Estrace, Ovocyclin, progynon, Dihydrotheelin, Dihydroxyestrin, Aquadiol, Diogynets, Gynergon, Gynoestryl, Vivelle, Diogyn, Oestroglandol, Aerodiol, Corpagen, Dimenformon, Estrovite, Femestral, Follicyclin, Ginosedol, Macrodiol, Oestergon, Ovahormon, Ovasterol, Ovastevol, Perlatanol, Primofol, Profoliol, Altrad, Bardiol, Climara, Divigel, Evorel, Femogen, Lamdiol, Syndiol, Vagifem, Dihydromenformon, estradiol-17beta, cis-Estradiol, Estraderm TTS, Estraderm, Estraldine, Estroclim, Trocosone, Estrogel, Menorest, Nordicol, Zumenon, Systen, D-Oestradiol, D-Estradiol, Progynon DH, Climaderm, Compudose, Dermestril, Estrasorb, Ovocycline, Encore, Estring, Menest, Oesclim, Dihydroxyoestrin, SK-Estrogens, Progynon-DH, Gynestrel, Microdiol, Oestrogynal, Ovociclina, Ovocylin, Tradelia, Estroclim 50, Innofem, Macrol, Zerella, 17beta-Oestradiol, Alora, Oestradiol R, Estring vaginal ring, Dihydrofollicular hormone, Trial SAT, Theelin, dihydro-, Elestrin, Estreva, Estrifam, Extrasorb, Fempatch, Femtran, Ginedisc, Gynodiol, Oestrogel, Esclim, Compudose 200, Compudose 365, GynPolar, Estrofem Forte, Profoliol B, Sandrena Gel, Sisare Gel, Estrofem 2, Oestradiolum, Estradiol-17-beta, Estradiolum, Estradot, Gelestra, 3,17-Epidihydroxyestratriene, Evamist, Zesteem, Dihydroxyesterin, cis-Oestradiol, Estraderm TTS 50, Climara Forte, Estrogens, esterified, Oestradiol Berco, Estraderm MX, VIVELLE-DOT, 17b-Oestradiol, Epiestriol 50, 17beta oestradiol, Oestradiol-17beta, Estrapak 50, 17-beta-estradiol, 17 beta-Estradiol, Estradiol-17 beta, Estradiolum [INN], Estradiolo [DCIT], Oestradiol-17-beta, Amnestrogen, Estrodiolum, Polyestradiol, Estradiolo, Femanest, Femestrol, Estra-1,3,5(10)-triene-3,17beta-diol, Estradiol-3,17beta, B-Estradiol, 17-beta-OH-estradiol, 3,17-beta-Estradiol, NSC-9895, 3,17-beta-Oestradiol, 3,17-Epidihydroxyoestratriene, D-3,17beta-Estradiol, Sandrena 1, E(sub 2), Estraderm (TN), [3H]-estradiol, Estrogel (TN), Climara (TN), Divigel (TN), Estrace (TN), Estring (TN), Innofem (TN), Vagifem (TN), Vivelle (TN), 17.beta.-Estradiol, 17.beta.-Oestradiol, Destradiol, Zesteen, 17-beta-OH-oestradiol, Estradiol [USAN:INN], 3,17.beta.-Estradiol, D-3,17beta-Oestradiol, Estrodiolum [INN-Latin], (17beta)-Estra-1,3,5(10)-triene-3,17-diol, D-3,17-beta-Estradiol, D-3,17-beta-Oestradiol, .beta.-Estradiol, .beta.-Oestradiol, Estrasorb (TN), [3H]]estradiol, 17|A-Oestradiol, CCRIS 280, component of Menrium, UNII-4TI98Z838E, 3,17beta-Estradiol, Estradiol, .beta.-, Estradiol-17.beta., CHEBI:16469, Estra-1,3,5(10)-triene-3,17-diol (17beta)-, Oestradiol-17.beta., Estraderm TTS 100, HSDB 3589, ESTRADIOL HEMIHYDRATE, Oestra-1,3,5(10)-triene-3,17beta-diol, C18H24O2, 17.beta.-OH-estradiol, 17-.BETA.-Estradiol, 17.beta.-OH-oestradiol, 17beta estradiol (E2), EINECS 200-023-8, 17beta-Estra-1,3,5(10)-triene-3,17-diol, 1,3,5-Estratriene-3,17-beta-diol, CHEMBL135, D-3,17.beta.-Estradiol, Dimenformon prolongatum, D-3,17.beta.-Oestradiol, 3,17beta-Dihydroxyestra-1,3,5-triene, Estra-1,3,5(10)-triene-3,17-diol, (17beta)-, 3,17beta-Dihydroxyoestra-1,3,5-triene, 3,17-beta-Dihydroxyoestra-1,3,5-triene, MLS000069494, 3,17b-Dihydroxyestra-1,3,5(10)-triene, (8R,9S,13S,14S,17S)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol, Estra-1,3,5(10)-triene-3,17-beta-diol, Oestra-1,3,5(10)-triene-3,17-beta-diol, 3,17-beta-Dihydroxyestra-1,3,5(10)-triene, 3,17-beta-Dihydroxy-1,3,5(10)-oestratriene, VOXZDWNPVJITMN-ZBRFXRBCSA-N, 17-beta-Estra-1,3,5(10)-triene-3,17-diol, 17beta-Oestra-1,3,5(10)-triene-3,17-diol, 4TI98Z838E, (17beta)-estra-1(10),2,4-triene-3,17-diol, 17-beta-Oestra-1,3,5(10)-triene-3,17-diol, 1,3,5-Estratriene-3,17beta-diol, [3H]E2, CMC_11154, SL-1100, NCGC00091544-04, SMR000059126, DSSTox_CID_573, E0025, 3,17beta-Dihydroxy-1,3,5(10)-estratriene, 3,17beta-Dihydroxyestra-1,3,5(10)-triene, E 8875, DSSTox_RID_75666, Benzogynestry, DSSTox_GSID_20573, Estropause, S-21400, Estasorb, (8R,9S,13S,14S,17S)-13-Methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthrene-3,17-diol, [2,4,6,7-3H]-E2, E 2, Oestradiol-17beta and esters [Steroidal oestrogens], Minivelle, Yuvvexy, 17b-Estradiol, Activella (Salt/Mix), Combipatch (Salt/Mix), (1S,10R,11S,14S,15S)-15-methyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-2(7),3,5-triene-5,14-diol, Estradiol-17 alpha, Climara Pro (Salt/Mix), 3,17-.beta.-Oestradiol, 3,3,5(10)-triene, SR-01000075866, Estra-1,3,5(10)-triene-3,17-diol (17.beta.)-, (+)-3,17.beta.-Estradiol, oestrodiol, Estradiol [USP:INN:BAN], Elestrim, beta-Oestradiol, delta-Estradiol, dihydro-Theelin, alpha-Oestradiol, delta-Oestradiol, TX-004HR, Estradiol complex, UNII-125DP6010H, Estrogel HBF, 1jgl, 1lhu, 1qkt, 1qku, [3H]estradiol, Climara, Menostar, 1,3,5-Estratriene-3,17.beta.-diol, CAS-50-28-2, Activella (TN), Progynova (TN), Elestrin (TN), Estrofem (TN), Menostar (TN), .alpha.-Oestradiol, CPD000059126, Prestwick_207, 3,17b-Estradiol, Angeliq (TN), Bio-E-Gel, Fem7, [3H]-Estrogen, 17 ?-Estradiol, 3,17.beta.-Dihydroxyestra-1,3,5-triene, 3,17.beta.-Dihydroxyoestra-1,3,5-triene, EvaMist (TN), Vivelle-Dot (TN), Alora (TN), 17-beta, 1,3,5,(10)-Estratrien-3,17.beta.-diol, Estra-1,3,5(10)-triene-3,17.beta.-diol, Estraderm TTS (TN), Oestra-1,3,5(10)-triene-3,17.beta.-diol, 2j7x, 3,17.beta.-Dihydroxy-1,3,5(10)-estratriene, 3,17.beta.-Dihydroxy-1,3,5(10)-oestratriene, 3,17.beta.-Dihydroxyestra-1,3,5(10)-triene, 3,3,5-triene, [3H]17beta-estradiol, Estradiol acetate (TN), (17?)-Estra-1,3,5(10)-triene-3,17-diol, 17.beta.-Estra-1,3,5(10)-triene-3,17-diol, Estrasorb Topical (TN), Estradiol valerate (TN), 17.beta.-Oestra-1,3,5(10)-triene-3,17-diol, Opera_ID_1688, Prestwick0_000441, Prestwick1_000441, Prestwick2_000441, Prestwick3_000441, Spectrum5_002055, 17beta-estradiol (E2), Estradiol cypionate (TN), alpha-estradiol (obsolete), beta-Estradiol, >=98%, bmse000642, D08QMX, Epitope ID:136018, (+)-3,17b-Estradiol, EC 200-023-8, AC1L1L2K, SCHEMBL8049, (+)-3,17beta-Estradiol, Estradiol (JAN/USP/INN), BIDD:PXR0065, Lopac0_000503, BSPBio_000482, BSPBio_001065, KBioGR_000405, KBioGR_002269, KBioSS_000405, KBioSS_002270, Oestradiol-17beta and esters, MLS000758312, MLS001076331, MLS001424022, BIDD:ER0125, SPBio_002421, BPBio1_000532, GTPL1012, GTPL1013, DTXSID0020573, BDBM17292, KBio2_000405, KBio2_002269, KBio2_002973, KBio2_004837, KBio2_005541, KBio2_007405, KBio3_000769, KBio3_000770, KBio3_002749, AOB5963, NSC9895, 1a52, 1g50, 2d06, cMAP_000005, MolPort-001-794-632, Bio1_000403, Bio1_000892, Bio1_001381, Bio2_000363, Bio2_000843, HMS1362E07, HMS1569I04, HMS1792E07, HMS1990E07, HMS2051C17, HMS2090E18, HMS2096I04, HMS2236H04, HMS3261F07, HMS3403E07, HMS3713I04, beta-Estradiol, analytical standard, (8S,9S,13S,14S,17S)-13-Methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol, ACN-S003579, BCP08579, HY-B0141, Tox21_111148, Tox21_202057, Tox21_300288, Tox21_500503, 1,5-Estratriene-3,17.beta.-diol, LMST02010001, LS-137, MFCD00003693, s1709, ZINC13520815, [2,4,6,7-3H]-17beta-estradiol, AKOS015896570, 125DP6010H, AN-6628, CCG-100808, CS-1938, DB00783, LP00503, NC00058, IDI1_002118, SMP1_000121, 1,3,5(10)-estratriene-3,17b-diol, NCGC00091544-00, NCGC00091544-01, NCGC00091544-02, NCGC00091544-05, NCGC00091544-06, NCGC00091544-07, NCGC00091544-09, NCGC00091544-10, NCGC00091544-11, NCGC00091544-12, NCGC00091544-13, NCGC00091544-14, NCGC00091544-15, NCGC00091544-16, NCGC00179321-01, NCGC00179321-02, NCGC00254177-01, NCGC00259606-01, NCGC00261188-01, 17-E, 73459-61-7, AC-22346, AJ-64042, AS-13729, BC200811, SC-25771, SY017569, Estra-1,3,5(10)-triene-3,17b-diol, Oestra-1,3,5(10)-triene-3,17b-diol, WLN: L E5 B666TTT&J E1 FQ OQ, AB0012866, AB2000237, Estra-1,5(10)-triene-3,17.beta.-diol, Estradiol, meets USP testing specifications, 3,17beta-dihydroxyestra-1,3,5(10)-trien, Estra-1,3,5(10)-triene -3,17beta-diol, EU-0100503, Oestra-1,5(10)-triene-3,17.beta.-diol, 3,17-dihydroxy-delta(1,3,5-10)-estratriene, C00951, D00105, J10189, Z-4415, (17b)-Estra-1,3,5(10)-triene-3,17-diol, 13b-Methyl-1,3,5(10)-gonatriene-3,17b-ol, 17-decahydrocyclopenta[a]phenanthrene-3,17-diol, 17.beta.-Estra-1,5(10)-triene-3,17-diol, 17.beta.-Oestra-1,5(10)-triene-3,17-diol, Estra-1,3,5(10)-triene-3,17-diol(17b)-, 003E693, SR-01000721892, 13beta-Methyl-1,3,5(10)-gonatriene-3,17beta-ol, Estra-1,5(10)-triene-3,17-diol (17.beta.)-, I06-2405, Q-201503, SR-01000075866-1, SR-01000075866-4, SR-01000721892-3, BRD-K18910433-001-04-4, BRD-K18910433-001-43-2, estra-1(10),2,4-triene-3,17-diol, (17beta)-, Estra-1,5(10)-triene-3,17-diol, (17.beta.)-, 17|A-estradiol;oestradiol;17|A-Oestradiol;|A-Estradiol, Z1847670481, B8B5AEF5-4957-49EB-A14F-444A8212C482, 17-beta-Estradiol hemihydrate 100 microg/mL in Acetonitrile, beta-Estradiol, BioReagent, powder, suitable for cell culture, Estra-1,3,5(10)-triene-3,17-diol (17beta)-, homopolymer, Estradiol, United States Pharmacopeia (USP) Reference Standard, beta-Estradiol, powder, gamma-irradiated, suitable for cell culture, Estradiol, Pharmaceutical Secondary Standard; Certified Reference Material, (13S,17S)-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthrene-3,17-beta-diol, (1S,10R,11S,14S,15S)-15-methyltetracyclo[8.7.0.0(2),.0(1)(1),(1)]heptadeca-2,4,6-triene-5,14-diol, (1S,10R,11S,14S,15S)-15-methyltetracyclo[8.7.0.0;{2,7}.0;{11,15}]heptadeca-2,4,6-triene-5,14-diol, (8''R'',9''S'',13''S'',14''S'',17''S'')-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[''a'']phenanthrene-3,17-diol, 1050677-52-5, 1206475-11-7, 141290-02-0, 17beta-Estradiol solution, 1.0 mg/mL in acetonitrile, ampule of 1 mL, certified reference material, 873662-39-6


ID: 2365

chemical graph of compound 2365



InChIKey: VPGRYOFKCNULNK-ACXQXYJUSA-N
SMILES: CC(=O)OCC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5952
synonyms found at PubChem are:
Deoxycorticosterone acetate, 56-47-3, DESOXYCORTICOSTERONE ACETATE, DOCA, Desoxycortone acetate, Percotol, Cortexone acetate, Decosteron, Decosterone, Sincortex, Syncortyl, DOC acetate, Deoxycortone acetate, Descorterone, Cortacet, Cortenil, Cortesan, Cortifar, Cortigen, Cortinaq, Cortiron, Cortivis, Cortixyl, Decorten, Decorton, Decostrate, Descornaq, Desocort, Docaquosum, Dorcostrin, Doxatone, Doxycamon, Krinocorts, Mincortid, Ocritena, Primocort, Primocortan, Syncorta, Unidocan, Arcort, Cortate, Ocriten, Steraq, Syncort, Doca acetate, Bio-Corten, Doc-Ac, 21-(acetyloxy)-pregn-4-ene-3,20-dione, Desoxycortonum, Desoxykorton, Cortormon, Percortene, 3,20-Dioxopregn-4-en-21-yl acetate, Organon's doca acetate, 21-Acetoxypregn-4-ene-3,20-dione, Percorten, Deoxycorticosterone 21-acetate, 11-Desoxycorticosterone acetate, Pregn-4-ene-3,20-dione, 21-(acetyloxy)-, Corticosterone, deoxy-, acetate, 4-Pregnene-3,20-dione-21-ol acetate, 11-Deoxycorticosterone 21-acetate, 4-Pregnene-3,20-dione 21-acetate, Deoxycorticosterone (acetate), DOXO, 21-Acetoxy-3,20-diketopregn-4-ene, UNII-6E0A168OB8, CCRIS 7517, Desoxycorticosterone-21-acetate, C23H32O4, NSC 9567, EINECS 200-275-9, 21-Hydroxypregn-4-ene-3,20-dione 21-acetate, Pregn-4-ene-3,20-dione, 21-hydroxy-, acetate, BRN 2570798, 11-Deoxycorticosterone acetate, MLS000028509, 11-Deoxycorticosterone, acetate, CHEBI:34671, VPGRYOFKCNULNK-ACXQXYJUSA-N, 6E0A168OB8, Desoxycorticosterone acetate [USP], NCGC00022043-04, SMR000058339, ST075186, DSSTox_CID_2894, DSSTox_RID_76777, DSSTox_GSID_22894, Descotone, Desoxycorticosterone acetate (USP), CAS-56-47-3, [2-[(8S,9S,10R,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]-2-oxo-ethyl] acetate, [2-[(8S,9S,10R,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate, 2-((1S,10S,11S,14S,15S,2R)-2,15-dimethyl-5-oxotetracyclo[8.7.0.0<2,7>.0<11,15> ]heptadec-6-en-14-yl)-2-oxoethyl acetate, 21-Hydroxyprogesterone 21-acetate, Desoxycorticosterone acetate [USAN], 21-Acetoxypregn-4-en-3,20-dione, 21-Acetyloxypregn-4-ene-3,20-dione, Doca (TN), 21-Acetoxyprogesterone, Opera_ID_47, AC1L1LHI, AC1Q62NM, SCHEMBL4169, 4-08-00-02195 (Beilstein Handbook Reference), MLS001074065, ARONIS24066, MEGxm0_000470, CHEMBL1200542, DTXSID6022894, ACon1_002189, CTK6A2440, Deoxycorticosterone acetate, 98%, MolPort-001-740-061, HMS2230B14, HY-B1472, ZINC4428527, Tox21_110876, s4243, SBB080582, 21-Acetoxy-4-pregnene-3,20-dione, AKOS004910359, AKOS015837895, Tox21_110876_1, ACN-043382, CS-5159, MCULE-8036810785, NCGC00022043-05, NCGC00022043-06, AJ-51107, AN-41689, AS-11731, LS-59473, SC-16126, 3,20-Dioxopregn-4-en-21-yl acetate #, 21-Hydroxypregn-4-ene-3,20-dione acetate, KB-227196, TR-031785, D0047, ST24041044, C14554, D03698, 21-Hydroxy-4-pregnene-3,20-dione 21-acetate, AB00383000_10, Delta4-Pregnen-21-ol-3, 20-dione 21-acetate, 003D660, SR-01000000097, SR-01000000097-3, W-105514, BRD-K24556098-001-01-9, BRD-K24556098-001-19-1, I14-26720, 11-Deoxycorticosterone acetate;DOC acetate;Cortexone acetate, Desoxycortone acetate, European Pharmacopoeia (EP) Reference Standard, Deoxycorticosterone acetate, United States Pharmacopeia (USP) Reference Standard, 106111-90-4, 2-((8S,9S,10R,13S,14S,17S)-10,13-dimethyl-3-oxo-2,3,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-oxoethyl acetate, 39282-34-3, acetic acid [2-keto-2-[(8S,9S,10R,13S,14S,17S)-3-keto-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]ethyl] ester


ID: 2366

chemical graph of compound 2366



InChIKey: VPNYRYCIDCJBOM-UHFFFAOYSA-M
SMILES: C[N+]1(CCC(C1)OC(=O)C(C2CCCC2)(C3=CC=CC=C3)O)C.[Br-]

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 11693
synonyms found at PubChem are:
GLYCOPYRROLATE, 596-51-0, glycopyrronium bromide, Glycopyrrolate bromide, Robinul, Gastrodyn, Asecryl, Nodapton, Tarodyl, Tarodyn, Glycopyrronii bromidum, Copyrrolate, Glycopyrronium, Cuvposa, AHR-504, ROBINUL FORTE, Bromuro de glicopirronio, Bromure de glycopyrronium, Robinal, NSC 250836, NSC 251251, NSC 251252, Seebri Neohaler, Seebri Breezhaler, AHR 504, NVA-237, Glycopyrronii bromidum [INN-Latin], EINECS 209-887-0, Glycopyrroni bromidum, Bromure de glycopyrronium [INN-French], Bromuro de glicopirronio [INN-Spanish], 3-Hydroxy-1,1-dimethylpyrrolidinium bromide alpha-cyclopentylmandelate, NVA 237, Glycopyrrolate [USAN], Bromure de ritropirronio, Bromure de ritropirronium, 1,1-Dimethyl-3-hydroxypyrrolidinium bromide alpha-cyclopentylmandelate, 1-Methyl-3-pyrrolidyl alpha-phenylcyclopentaneglycolate methobromide, Ritropirronium bromide [INN], Robinul (TN), DSSTox_CID_3109, Pyrrolidinium, 3-((cyclopentylhydroxyphenylacetyl)oxy)-1,1-dimethyl-, bromide, Glycopyrrolate (USP), DSSTox_RID_76878, DSSTox_GSID_23109, Seebri, Pyrrolidinium,1-dimethyl-, bromide, 3-(2-Cyclopentyl-2-hydroxy-2-phenylacetoxy)-1,1-dimethylpyrrolidinium Bromide, Pyrrolidinium, 1,1-dimethyl-3-hydroxy-, bromide, alpha-cyclopentylmandelate, CPD000469282, SMR000469282, Glycopyrronium bromide (JAN/INN), AD-237, NSC250836, NSC251251, NSC251252, PT-001, 3-(erythro-2-Cyclopentyl-2-hydroxy-2-phenylacetoxy)-1,1-dimethylpyrrolidiniumbromid, NCGC00179456-02, WLN: T5KTJ A1 A1 COVXQR&- AL5TJ &Q &E, C19H28BrNO3, Glycopyrrolate [USAN:USP], Lonhala Magnair, Pyrrolidinium,1-dimethyl-, bromide, .alpha.-cyclopentylmandelate, Mandelic acid, ester with 3-hydroxy-1,1-dimethylpyrrolidinium bromide, 53808-86-9, Cuvposa (TN), .beta.-1-Methyl-3-pyrrolidyl-.alpha.-cyclopentylmandelate methobromide, 1,1-Dimethyl-3-hydroxypyrrolidinium bromide .alpha.-cyclopentylmandelate, 1-Methyl-3-pyrrolidinyl .alpha.-phenylcyclopentaneglycolate methobromide, 3-Hydroxy-1,1-dimethylpyrrolidinium bromide .alpha.-cyclopentylmandelate, 3-Hydroxy-1,1-dimethylpyrrolidinium bromide-.alpha.-cyclopentylmandelate, Pyrrolidinium, 3-hydroxy-1,1-dimethyl-, bromide, alpha-cyclopentylmandelate, (1,1-dimethylpyrrolidin-1-ium-3-yl) 2-cyclopentyl-2-hydroxy-2-phenylacetate bromide, Pyrrolidinium, 3-hydroxy-1,1-dimethyl-, bromide, alpha-cyclopentylmandelate (8CI), Seebri breezhaler (TN), AC1Q1RGS, CAS-596-51-0, GLYCOPYRRONE BROMIDE, AC1L1XX0, AC1LAW54, SCHEMBL41436, Glycopyrronium Bromide ,(S), MLS001424112, MLS002222301, CHEMBL1201027, DTXSID6023109, C19H28NO3, CHEBI:90972, MolPort-006-112-011, VPNYRYCIDCJBOM-UHFFFAOYSA-M, Glycopyrrolate, >=98% (HPLC), HMS1570E14, HMS2051P12, HMS2094A05, HMS2097E14, HMS2235F12, HMS3259P04, HMS3369F10, HMS3393P12, HMS3714E14, Pharmakon1600-01505753, [(3S)-1,1-dimethylpyrrolidin-1-ium-3-yl] (2R)-2-cyclopentyl-2-hydroxy-2-phenylacetate;bromide, BCP07110, CHF-5992, Tox21_113144, Tox21_113145, MFCD00072137, NSC759238, s4660, 3-(2-phenyl-2-cyclopentylglycoloyloxy)-1,1-dimethylpyrrolidinium bromide, AKOS015962136, Tox21_113144_1, CCG-101030, CCG-213543, CS-1763, NC00280, NC00694, NSC-250836, NSC-251251, NSC-251252, NSC-759238, RL04249, NCGC00179456-04, AC-23382, AN-46262, BC209826, HY-17465, OR315526, SAM001246629, SAM002589987, AB0010706, LS-138344, FT-0626787, G0392, ST24047338, D00540, SR-01000763650, I14-3643, Nodapton|||Robanul|||Robinul|||Tarodyl|||Tarodyn, SR-01000763650-3, 1-methyl-3-pyrrolidyl alpha-cyclopentylmandelate methobromide, Glycopyrrolate, United States Pharmacopeia (USP) Reference Standard, 1-methyl-3-pyrrolidyl alpha-phenyl-alpha-cyclopentylglycolate methobromide, Glycopyrronium bromide, European Pharmacopoeia (EP) Reference Standard, Glycopyrronium impurity N, European Pharmacopoeia (EP) Reference Standard, (1,1-dimethylpyrrolidin-1-ium-3-yl) 2-cyclopentyl-2-hydroxy-2-phenyl-acetate bromide, 3-(2-cyclopentyl-2-hydroxy-2-phenylacetoxy)-1,1-dimethylpyrrolidin-1-ium bromide, 3-{[cyclopentyl(hydroxy)phenylacetyl]oxy}-1,1-dimethylpyrrolidin-1-ium bromide, alpha-cyclopentylmandelic acid ester with 3-hydroxy-1,1-dimethylpyrrolidinium bromide, erythro-3-Hydroxy-1,1-dimethylpyrrolidinium bromide alpha-cyclopentylmandelate, erythro-3-Hydroxy-1,1-dimethylpyrrolidinium bromide alpha-cyclopentylmandelate., Glycopyrronium for peak identification, European Pharmacopoeia (EP) Reference Standard, ZNYLRIGBNGHLRL-UHFFFAOYSA-N


ID: 2367

chemical graph of compound 2367



InChIKey: VPOWSDDTEVCUHB-UHFFFAOYSA-N
SMILES: CC(=O)OCC(CC(CCCCCCCCCCCC=C)O)O.CC(=O)OCC(CC(CCCCCCCCCCCC#C)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6710728
synonyms found at PubChem are:
AVOCATIN A, SPBio_000063, AC1O8JZD, Spectrum2_000172, Spectrum3_000238, Spectrum4_001533, BSPBio_001915, KBioGR_001966, SPECTRUM210025, CHEMBL1568351, KBio3_001415, HMS1923C09, CCG-38382, SDCCGMLS-0066843.P001, NCGC00095230-01, NCGC00095230-02, NCGC00095230-03, 2,4-dihydroxyheptadec-16-enyl acetate; 2,4-dihydroxyheptadec-16-ynyl acetate


ID: 2368

chemical graph of compound 2368



InChIKey: VPSRQEHTHIMDQM-FKLPMGAJSA-N
SMILES: CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@H]2CCC3=CC=CC=C3N(C2=O)CC(=O)O.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5362123
synonyms found at PubChem are:
BENAZEPRIL HYDROCHLORIDE, 86541-74-4, Benazepril HCl, Lotensin, Cibacen, Cibacene, Briem, Tensanil, Zinadril, Cibace, Labopol, Cibacen CHF, Benazepril (hydrochloride), UNII-N1SN99T69T, CGS 14824A HCl, HSDB 7081, CGS 14824A, CHEBI:3012, N1SN99T69T, CGS-14824A, Lotensin (TN), DSSTox_CID_25922, DSSTox_RID_81225, DSSTox_GSID_45922, (3S)-3-(((1S)-1-Carboxy-3-phenylpropyl)amino)-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepine-1-acetic acid, 3-ethyl ester, monohydrochloride, C24H29ClN2O5, (3S)-3-[[(1S)-1-(Ethoxycarbonyl)-3-phenylpropyl]amino]-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepine-1-acetic acid hydrochloride, 1H-1-Benzazepine-1-acetic acid, 2,3,4,5-tetrahydro-3-((1-(ethoxycarbonyl)-3-phenylpropyl)amino)-2-oxo-, monohydrochloride, (S-(R*,R*))-, 1H-1-Benzazepine-1-acetic acid, 3-((1-(ethoxycarbonyl)-3-phenylpropyl)amino)-2,3,4,5-tetrahydro-2-oxo-, monohydrochloride, (S-(R*,R*))-, 2-((S)-3-(((S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino)-2-oxo-2,3,4,5-tetrahydro-1H-benzo[b]azepin-1-yl)acetic acid hydrochloride, 2-[(3S)-3-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid hydrochloride, SMR000469199, CAS-86541-74-4, benazcpril, NCGC00095132-01, 2-((S)-3-((S)-1-ethoxy-1-oxo-4-phenylbutan-2-ylamino)-2-oxo-2,3,4,5-tetrahydro-1H-benzo[b]azepin-1-yl)acetic acid hydrochloride, 2-[(3S)-3-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid;hydrochloride, Benazepril hydrochloride [USAN:JAN], AC1NSFPI, Benazepril hydrochloride [USAN:USP:JAN], benazepril monohydrochloride, CHEMBL1694, SCHEMBL42194, Benazepril Hydrochloride,(S), MLS001076668, MLS001333171, MLS001333172, MLS001401429, C24H28N2O5.HCl, SPECTRUM1505200, CGS-14824A HCL, DTXSID9045922, CTK8B3291, HY-B0093A, KS-00000XHP, MolPort-003-666-601, VPSRQEHTHIMDQM-FKLPMGAJSA-N, BCPP000350, HMS1922L07, Pharmakon1600-01505200, TWT-8154, Tox21_111441, ANW-42214, Benazepril hydrochloride (JAN/USAN), CCG-39520, MFCD00895734, NSC758920, s1284, AKOS015888536, Tox21_111441_1, BCP9000387, CS-1796, KS-1397, NC00211, NSC-758920, NCGC00165740-05, AK163656, AN-14751, CPD000469199, KB-65121, LS-27972, SAM001246712, SC-22757, AX8022900, TL8005618, TR-026954, B3611, FT-0654634, C07701, D00620, Benazepril hydrochloride, >=98% (HPLC), solid, A841712, SR-01000762893, SR-01000762893-3, Benazepril hydrochloride, VETRANAL(TM), analytical standard, Benazepril hydrochloride, European Pharmacopoeia (EP) Reference Standard, Benazepril for system suitability, European Pharmacopoeia (EP) Reference Standard, Benazepril hydrochloride, United States Pharmacopeia (USP) Reference Standard, (3S)-3-[(1S)-1-Ethoxycarbonyl-3-phenylpropyl]amino-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepine-1-acetic Acid Hydrochloride, [(3S)-3-{[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino}-2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]acetic acid hydrochloride, 1H-1-benzazepine-1-acetic acid,3-((1-(ethoxycarbonyl)-3-phenylpropyl)amino)-2,3,4,5-tetrahydro-2-oxo-,monohydrochloride,(S-(R*,R*))-, 1H-1-Benzazepine-1-acetic acid,3-[[(1S)-1-(ethoxycarbonyl)-3-phenylpropyl]amino]-2,3,4,5-tetrahydro-2-oxo-,hydrochloride,(3S), 2-[(3S)-3-[[(1S)-1-ethoxycarbonyl-3-phenyl-propyl]amino]-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl]acetic acid hydrochloride, 2-[(3S)-3-[[(2S)-1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl]amino]-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl]ethanoic acid hydrochloride


ID: 2369

chemical graph of compound 2369



InChIKey: VPUNMTHWNSJUOG-BAOINKAISA-N
SMILES: C[C@H]1[C@@H]([C@H]([C@@H]([C@@H](O1)O[C@H]2CC[C@]3([C@@H](C2)CC[C@@H]4[C@@H]3CC[C@]5([C@@]4(CC[C@@H]5C6=CC(=O)OC6)O)C)C)O)OC)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 441867
synonyms found at PubChem are:
Neriifolin, 466-07-9, UNII-5RD2ADS9WV, Digitoxigenin 3-(alpha-L-thevetoside), 5RD2ADS9WV, CHEBI:7522, 3beta-(6-deoxy-3-O-methyl-alpha-L-glucopyranosyloxy)-14-hydroxy-5beta-card-20(22)-enolide, Digitoxigenin + thevetose [German], EINECS 207-372-5, NSC 123976, BRN 0100752, 4-18-00-01486 (Beilstein Handbook Reference), Digitoxigenin + thevetose, AC1L9BT5, SCHEMBL644057, CHEMBL501533, (5beta)-3beta-((6-Deoxy-3-O-methyl-alpha-L-glucopyranosyl)oxy)-14-hydroxycard-20(22)-enolide, 5-beta-Card-20(22)-enolide, 3-beta-((6-deoxy-3-O-methyl-beta-L-glucopyranosyl)oxy)-14-hydroxy-, ZINC8214742, LMST01120021, C08876, 3-[(3S,5R,8R,9S,10S,13R,14S,17R)-3-[(2R,3S,4R,5S,6S)-3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl]oxy-14-hydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one


ID: 2370

chemical graph of compound 2370



InChIKey: VPVOXUSPXFPWBN-VKHMYHEASA-N
SMILES: C[C@@H](C(=O)C1=NC2=C(NC1)NC(=NC2=O)N)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 65253
synonyms found at PubChem are:
sepiapterin, L-Sepiapterin, 17094-01-8, UNII-CJQ26KO7HP, Lopac-S-154, CJQ26KO7HP, 2-Amino-6-(S)-lactoyl-7,8-dihydro-4(3H)-pteridinone, Sepiapterine, Sepiapterin, solid, AC1Q6CXA, AC1L22WM, Lopac0_001123, 6-lactoyl-7,8-dihydropterin, MLS002153268, SCHEMBL258399, CHEMBL1255653, VPVOXUSPXFPWBN-VKHMYHEASA-N, HMS2234O10, HMS3263B07, Tox21_501123, 1839AH, MFCD00210214, ZINC17721961, AKOS022181294, CCG-205198, LP01123, ACM17094018, NCGC00015913-01, NCGC00094391-01, NCGC00094391-02, NCGC00094391-03, NCGC00261808-01, AJ-70113, SMR001230707, EU-0101123, FT-0771591, S-154, ST50405213, C00835, SR-01000075522, SR-01000075522-1, (S)-2-amino-6-(2-hydroxypropanoyl)-7,8-dihydropteridin-4(1H)-one, (S)-2-Amino-6-(2-hydroxypropanoyl)-7,8-dihydropteridin-4(3H)-one, 6-((2S)-2-hydroxypropanoyl)-2-amino-3,7,8-trihydropteridin-4-one, (S)-2-amino-7,8-dihydro-6-(2-hydroxy-1-oxopropyl)-4(1H)-Pteridinone, 1-(2-amino-7,8-dihydro-4-hydroxy-6-pteridinyl)-2-hydroxy-1-Propanone, 2-amino-6-[(2S)-2-hydroxypropanoyl]-1,4,7,8-tetrahydropteridin-4-one, 2-amino-6-[(2S)-2-hydroxypropanoyl]-7,8-dihydro-1H-pteridin-4-one, 2-amino-7,8-dihydro-6-[(2S)-2-hydroxy-1-oxopropyl]-4(1H)Pteridinone, 4(3H)-Pteridinone, 2-amino-7,8-dihydro-6-[(2S)-2-hydroxy-1-oxopropyl]-, S(-)-2-Amino-7,8-dihydro-6-(2-hydroxy-1-oxopropyl)-4(1H)-pteridione, S-(-)-2-Amino-7,8-dihydro-6-(2-hydroxy-1-oxopropyl)-4(1H)-pteridinone, 4(1H)-Pteridinone, 2-amino-7,8-dihydro-6-(2-hydroxy-1-oxopropyl)-, (S)-


ID: 2371

chemical graph of compound 2371



InChIKey: VQAYFKKCNSOZKM-IOSLPCCCSA-N
SMILES: CNC1=NC=NC2=C1N=CN2[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 102175
synonyms found at PubChem are:
N6-Methyladenosine, 1867-73-8, N-Methyladenosine, 6-Methyladenosine, N(6)-Methyladenosine, 6-Methylaminopurinosine, 6-Methylaminopurine riboside, Adenosine, N-methyl-, 6-Methylaminopurine D-riboside, 6-Methylaminopurine ribonucleoside, N6-methyladenosine (m6A), (2R,3S,4R,5R)-2-(Hydroxymethyl)-5-(6-(methylamino)-9H-purin-9-yl)tetrahydrofuran-3,4-diol, UNII-CLE6G00625, CHEBI:21891, (N-6)-Methyladenosine, N(6)-monomethyladenosine, CHEMBL383144, CLE6G00625, NSC 29409, M6A, (2R,3S,4R,5R)-2-(hydroxymethyl)-5-[6-(methylamino)-9H-purin-9-yl]oxolane-3,4-diol, (2R,3S,4R,5R)-2-Hydroxymethyl-5-(6-methylamino-purin-9-yl)-tetrahydro-furan-3,4-diol, NSC-29409, NSC627045, 4rdn, 6MD, Prestwick_343, N6 -methyladenosine, AC1L2SAS, Prestwick0_000338, Prestwick1_000338, Prestwick2_000338, Prestwick3_000338, Epitope ID:140951, SCHEMBL40634, BSPBio_000375, MLS002153780, SPBio_002296, Adenosine, N-methyl- (8CI), AC1Q4Y57, BPBio1_000413, DTXSID6020858, CTK0H6388, MolPort-003-901-012, VQAYFKKCNSOZKM-IOSLPCCCSA-N, HMS1569C17, HMS2096C17, HMS2234N05, HMS3713C17, HY-N0086, ZINC4245632, 2575AH, BDBM50163023, PDSP1_001030, PDSP2_001014, s3190, Adenosine, N-methyl- (8CI)(9CI), AKOS024260287, CCG-220338, CS-3285, GS-6701, LS-7512, NCGC00162241-01, NCGC00162241-02, NCGC00162241-04, AJ-49684, AK153126, SMR001233164, AX8289383, 6-methylamino-9-beta-D-ribofuranosyl-Purine, FT-0774416, ST24034024, ST50412061, 6-methylamino-9-beta-delta-ribofuranosyl-Purine, Purine, 6-methylamino-9-beta-D-ribofuranosyl-, N-methyl-9-beta-L-ribofuranosyl-9H-purin-6-amine, J-700317, N-methyl-9-alpha-L-ribofuranosyl-9H-purin-6-amine, BRD-K81807412-001-03-1, (2R,3S,4R,5R)-2-(hydroxymethyl)-5-[6-(methylamino)purin-9-yl]oxolane-3,4-diol, (2R,3S,4R,5R)-2-(hydroxymethyl)-5-[6-(methylamino)purin-9-yl]tetrahydrofuran-3,4-diol, (4S,2R,3R,5R)-5-(hydroxymethyl)-2-[6-(methylamino)purin-9-yl]oxolane-3,4-diol


ID: 2372

chemical graph of compound 2372



InChIKey: VQHSOMBJVWLPSR-RNEZNVSZSA-N
SMILES: C([C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)OC([C@@H](CO)O)[C@@H]([C@H](CO)O)O)O)O)O)O

biological descriptors:

CFTR relevance: weak CFTR corrector

Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown

reference list:

"DY Thomas" "KA Teske" "R Robert" "JW Hanrahan" "Y Luo" "GW Carlile" "D Zhang"


CID is 90657618
synonyms found at PubChem are:
Cellobiitol


ID: 2373

chemical graph of compound 2373



InChIKey: VQHSOMBJVWLPSR-WELRSGGNSA-N
SMILES: C([C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)O[C@H]([C@@H](CO)O)[C@@H]([C@H](CO)O)O)O)O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 160514
synonyms found at PubChem are:
Cellobiotol, Cellobiitol, 4-O-beta-D-Glucopyranosyl-D-glucitol, GLUCITOL-4-GUCOPYANOSIDE, 535-94-4, Lactosit, 4-o-|A-d-glucopyranosyl-d-glucitol, Spectrum_001688, SpecPlus_000530, AC1L4NRA, Spectrum2_001613, Spectrum3_000982, Spectrum4_001108, Spectrum5_001679, AC1Q55IR, BSPBio_002643, KBioGR_001556, KBioSS_002168, DivK1c_006626, SCHEMBL459992, SPECTRUM1503989, SPBio_001645, GLC-(1-4)GLO, CHEMBL3039116, KBio1_001570, KBio2_002168, KBio2_004736, KBio2_007304, KBio3_001863, ZINC3978767, CCG-38896, SDCCGMLS-0066809.P001, D-Glucitol, 4-O-beta-D-glucopyranosyl-, NCGC00178556-01, 1947DA78-C156-4AE4-B7C7-7B77776438FB, WURCS=1.0/2,1/[12122h|1,5][h1121h]1+1,2+3, (2S,3R,4R,5R)-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexane-1,2,3,5,6-pentol, (2S,3R,4R,5R)-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxyhexane-1,2,3,5,6-pentol, (2S,3R,4R,5R)-4-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxyhexane-1,2,3,5,6-pentol


ID: 2374

chemical graph of compound 2374



InChIKey: VQLPLYSROCPWFF-ROUUACIJSA-N
SMILES: CN([C@H]1CCCC[C@@H]1N2CCCC2)C(=O)CC3=CC(=C(C=C3)Cl)Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6604724
synonyms found at PubChem are:
(-)-U-50488, 67198-19-0, (+/-) trans-U-50488 methanesulfonate, Tocris-0471, Tocris-0495, Tocris-0496, AC1O7GSI, trans-(-)-3,4-Dichloro-N-methyl-N-[2-(1-pyrrolidinyl)cyclohexyl]benzeneacetamide hydrochloride, Lopac0_000472, Lopac0_001266, BSPBio_001511, KBioGR_000231, KBioSS_000231, CHEMBL58033, SCHEMBL10804846, KBio2_000231, KBio2_002799, KBio2_005367, KBio3_000461, KBio3_000462, 2-(3,4-Dichloro-phenyl)-N-methyl-N-(2-pyrrolidin-1-yl-cyclohexyl)-acetamide, CHEBI:107647, Bio1_000413, Bio1_000902, Bio1_001391, Bio2_000231, Bio2_000711, HMS1361L13, HMS1791L13, HMS1989L13, HMS3402L13, ZINC591998, BDBM50000780, AKOS030531019, CCG-204564, IDI1_033981, NCGC00024605-01, NCGC00024605-02, NCGC00024605-03, NCGC00024605-04, NCGC00024605-05, NCGC00024605-06, NCGC00024605-07, NCGC00024605-08, NCGC00024605-09, NCGC00024605-10, NCGC00024605-11, NCGC00024605-12, (-)-U-50488H, n-methyl-n-[-2-pyrrolizinocyclohexyl]-2- acetamide, BRD-K53532120-001-02-4, BRD-K53532120-003-03-8, BRD-K53532120-003-11-1, (1s-trans)-3,4-dichloro-N-methyl-N-[2-(1-pyrrolidinyl)cyclohexyl]-benzeneacetamide, 2-(3,4-dichlorophenyl)-N-methyl-N-((1S,2S)-2-(pyrrolidin-1-yl)cyclohexyl)acetamide, 2-(3,4-dichlorophenyl)-N-methyl-N-[(1S,2S)-2-pyrrolidin-1-ylcyclohexyl]acetamide, 2-(3,4-dichlorophenyl)-N-methyl-N-[(2S)-2-(pyrrolidin-1-yl)cyclohexyl]acetamide


ID: 2375

chemical graph of compound 2375



InChIKey: VQQVWGVXDIPORV-UHFFFAOYSA-N
SMILES: C1=CC=C2C(=C1)C(=O)N3C4=CC=CC=C4C(=O)C3=N2

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 73549
synonyms found at PubChem are:
Tryptanthrin, Indolo[2,1-b]quinazoline-6,12-dione, 13220-57-0, Tryptanthrine, Couroupitine a, TCMDC-125859, GNF-PF-2691, NSC 349447, CHEBI:9768, CHEMBL306946, VQQVWGVXDIPORV-UHFFFAOYSA-N, NSC349447, Indolo(2,1-b)quinazoline-6,12-dione, SR-01000521538, Tryptantherin, Indolo[2,12-dione, AC1Q1HJD, D0I9AT, AC1L2K2A, Oprea1_754264, MLS001049121, GTPL8224, SCHEMBL2426211, CTK0H6551, ZINC33299, DTXSID90157431, Tryptanthrin, >=98% (HPLC), MolPort-002-516-459, HMS2271H05, KS-00000C3R, 5941AA, ANW-68868, BDBM50240612, MFCD00012073, STK078931, AKOS000671350, Indolo[2,1-b]quizoline-6,12-dione, CCG-208326, MCULE-7521697515, NSC-349447, TRA0036916, NCGC00160337-01, NCGC00160337-02, AJ-08570, AK-57813, CJ-00188, DS-15687, NCI60_003113, SMR000386951, ST047334, SY017117, ZB000930, NCGC00160337-01!TRYPTANTHRINE, AX8156048, KB-254423, TC-157613, FT-0733127, C10742, K-4146, C-45803, J-006143, SR-01000521538-1, SR-01000521538-4, Indolo(2,1-b)quinazoline-6,12-dione (8CI)(9CI), 11-hydrobenzo[d]quinazolino[3,2-a]azolidine-6,12-dione


ID: 2376

chemical graph of compound 2376



InChIKey: VQTDPCRSXHFMOL-UHFFFAOYSA-N
SMILES: CC(=O)C1=C(C=C(C=C1)OC)OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 70016
synonyms found at PubChem are:
2',4'-Dimethoxyacetophenone, 829-20-9, 1-(2,4-dimethoxyphenyl)ethanone, 2,4-Dimethoxyacetophenone, 1-(2,4-Dimethoxyphenyl)ethan-1-one, Ethanone, 1-(2,4-dimethoxyphenyl)-, Acetophenone, 2',4'-dimethoxy-, PEONOL METHYL ETHER, VQTDPCRSXHFMOL-UHFFFAOYSA-N, 1-acetyl-2,4-dimethoxybenzene, NSC46645, EINECS 212-587-2, PubChem10582, ACMC-209pqs, AI3-10505, AC1Q5EIZ, AC1L2D6B, AC1Q48YL, AC1Q48YM, 2;,4;-Dimethoxyacetophenone, Resacetophenone dimethyl ether, SCHEMBL246262, 2',4'-dimethoxy-acetophenone, CHEMBL3039420, CTK5F0209, KS-00000MNP, VQTDPCRSXHFMOL-UHFFFAOYSA-, 4-Acetylresorcinol dimethyl ether, DTXSID70232073, MolPort-000-871-950, STR06915, ZINC1678791, 1-(2,4-Dimethoxy-phenyl)-ethanone, 2',4'-Dimethoxyacetophenone, 97%, ANW-37634, BBL027722, Ethanone,1-(2,4-dimethoxyphenyl)-, NSC-46645, SBB063154, STL301369, AKOS000119028, AC-2999, CCG-214744, MCULE-6426506729, PS-3811, SDCCGMLS-0066943.P001, AJ-29549, AN-47740, BP-12734, CJ-27497, K479, KB-87384, SC-25926, ST092355, SY015389, AB0014245, DB-019962, ST2414925, TR-025886, 2',4'-Dihydroxyacetophenone, dimethyl ether, D2030, FT-0633006, A10066, Y-9625, SR-05000002414, I01-0609, SR-05000002414-1, W-104155, F0001-2122, InChI=1/C10H12O3/c1-7(11)9-5-4-8(12-2)6-10(9)13-3/h4-6H,1-3H3


ID: 2377

chemical graph of compound 2377



InChIKey: VRDIULHPQTYCLN-UHFFFAOYSA-N
SMILES: CCCC1=NC=CC(=C1)C(=S)N

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 4967
synonyms found at PubChem are:
prothionamide, Protionamide, 14222-60-7, Protionamid, Ektebin, 2-Propylthioisonicotinamide, 2-propylpyridine-4-carbothioamide, Trevintix, Peteha, Tuberex, 2-Propyl-thioisonicotinamide, Prothionamidum, Protionizina, Tebeform, 2-Propylisonicotinylthioamide, Protionamida, Protionamidum, 2-Propyl-4-pyridinecarbothioamide, 4-Pyridinecarbothioamide, 2-propyl-, TH-1321, 2-Propyl-4-thiocarbamoylpyridine, Isonicotinamide, 2-propylthio-, RP 9778, Protionamidum [INN-Latin], Protionamida [INN-Spanish], Protionamide [INN:DCF], 9778 R.P., Trevintix (TN), 1321 TH, TH 1321, Protionamide (INN), UNII-76YOO33643, EINECS 238-093-7, BRN 0118164, Protionamide (Prothionamide), MLS000042521, C9H12N2S, VRDIULHPQTYCLN-UHFFFAOYSA-N, 76YOO33643, RP-9778, NCGC00095164-01, 9778 R.P, SMR000047660, DSSTox_CID_25940, DSSTox_RID_81238, DSSTox_GSID_45940, Q-201638, CAS-14222-60-7, SR-05000001518, Protion, Protionamide [INN:BAN:DCF], AC1LDFXW, Prothionamide (JP15), Prothionamide (JP17), Opera_ID_999, Spectrum2_000019, Spectrum3_001964, D0L7UQ, SCHEMBL74572, BSPBio_003564, 5-22-02-00376 (Beilstein Handbook Reference), MLS001201789, MLS006011877, SPECTRUM1505316, SPBio_000057, CHEMBL1378024, DTXSID7045940, CHEBI:32066, KBio3_002911, KS-00000XMA, MolPort-000-159-776, Prothionamide, >=99% (HPLC), HMS1922D06, HMS2090J11, HMS2235M12, HMS3372K04, HMS3655O18, HMS3715G13, KUC109576N, Pharmakon1600-01505316, 4-Pyridinecarbothioamide,2-propyl-, ALBB-010476, BB_SC-02027, BCP13522, HY-B0306, KSC-27-052D, ZINC3874803, ZX-AN009319, Tox21_111463, BBL010291, CCG-40049, CP-057, FCH834501, NSC758962, s1881, STK366469, STL454225, AKOS005172678, Tox21_111463_1, AC-4518, AN-7060, API0014409, CS-2345, DB12667, KS-1282, MCULE-3817450515, NSC-758962, 2-propylpyridine-4-carbimidothioic acid, NCGC00095164-02, NCGC00095164-03, NCGC00095164-04, NCGC00095164-05, AK403145, BC206644, CC-33996, LS-84822, M860, SC-45844, 4-Pyridinecarbothioamide, 2-propyl-(9CI), SBI-0207058.P001, AB0015417, AB2000348, KB-232156, 4-Pyridinecarbothioamide, 2-propyl- (9CI), amino(2-propyl(4-pyridyl))methane-1-thione, FT-0630412, P2302, ST45135960, D01195, M-2606, AB00393463-12, AB01093435-02, AB01093435_03, AB01093435_04, A807874, C-06755, I06-0623, SR-05000001518-1, SR-05000001518-2, SR-05000001518-3, BRD-K75360161-001-09-9


ID: 2378

chemical graph of compound 2378



InChIKey: VRSRBPOCDOKYKT-UHFFFAOYSA-N
SMILES: C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C4=NC=CC=N4.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3038520
synonyms found at PubChem are:
Piribedil hydrochloride, 78213-63-5, 2-(4-Piperonyl-1-piperazinyl)pyrimidine hydrochloride, Pyrimidine, 2-(4-piperonyl-1-piperazinyl)-, hydrochloride, 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]pyrimidine hydrochloride, Pyrimidine, 2-(4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl)-, monohydrochloride, 3605-01-4 (Parent), SR-01000076091, Pyrimidine,2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-, hydrochloride (1:1), AC1MI50C, Piribedil Mono-hydrochloride, MLS002222191, C16H18N4O2.HCl, C16H18N4O2.2HCl, SCHEMBL3765569, CHEMBL1865834, DTXSID20228860, MolPort-003-983-662, HMS1571C21, BN0420, AKOS024456341, API0003874, CCG-220980, VA11537, NCGC00180920-01, AN-25213, SMR001307248, LS-135517, V1787, A839364, SR-01000076091-3, SR-01000076091-10, 2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]pyrimidine hydrochloride, AC1Q1SRB, SCHEMBL14973600


ID: 2379

chemical graph of compound 2379



InChIKey: VRSRXLJTYQVOHC-YEJXKQKISA-N
SMILES: C[C@@H]1[C@@H]2C3=CC(=C(C=C3CCN2CC4=C1C=CC(=C4OC)OC)OC)OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 101301
synonyms found at PubChem are:
Corydaline, (+)-Corydaline, 518-69-4, Corydalin, UNII-08N392L8VX, d-Corydaline, NSC 406036, BRN 0096972, CHEBI:14027, Berbine, 2,3,9,10-tetramethoxy-13-methyl-, 08N392L8VX, 6H-Dibenzo(a,g)quinolizine, 5,8,13,13a-tetrahydro-2,3,9,10-tetramethoxy-13-methyl-, (13S-E)-, 2,3,9,10-tetramethoxy-13beta-methyl-13abeta-berbine, NSC-298182, (13S,13aR)-2,3,9,10-tetramethoxy-13-methyl-5,8,13,13a-tetrahydro-6H-isoquino[3,2-a]isoquinoline, (13S,13aR)-2,3,9,10-tetramethoxy-13-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline, (+/-)-Corydaline, Corydaline, (+/-)-, Corydaline DL-form [MI], 6018-35-5, AC1L2QJK, 5-21-06-00173 (Beilstein Handbook Reference), SCHEMBL230676, MEGxp0_000624, CHEMBL2165401, ACon0_001192, ACon1_000349, CTK8F8790, KS-00001FKA, DTXSID90199735, MolPort-001-740-784, TCMDC-143075, Berbine, 2,3,9,10-tetramethoxy-13beta-methyl-, (+/-)-, 6H-Dibenzo(a,g)quinolizine, 5,8,13,13a-tetrahydro-2,3,9,10-tetramethoxy-13-methyl-, (13S-trans)-, HY-N0923, ZINC25692299, AKOS030242363, CCG-208480, CS-4248, MCULE-6042650831, (13SR,13Ars)-5,8,13,13a-tetrahydro-2,3,9,10-tetramethoxy-13-methyl-6H-dibenzo(a,g)-quinolizine, 6H-Dibenzo(a,g)quinolizine, 5,8,13,13a-tetrahydro-2,3,9,10-tetramethoxy-13-methyl-, (13R,13aS)-rel-, 6H-Dibenzo(a,g)quinolizine, 5,8,13,13a-tetrahydro-2,3,9,10-tetramethoxy-13-methyl-, trans-(+/-)-, AN-45504, LS-55008, FT-0624067, V0362, C-7350, C15530, 518C694, C-54668, SR-05000002225, SR-05000002225-2, BRD-K13148078-001-01-2, 13abeta-Berbine, 2,3,9,10-tetramethoxy-13alpha-methyl-, UNII-6MUC9717YK component VRSRXLJTYQVOHC-YEJXKQKISA-N, 13a-beta-Berbine, 2,3,9,10-tetramethoxy-13-alpha-methyl-, 13a-beta-Berbine, 2,3,9,10-tetramethoxy-13-alpha-methyl- (8CI), 13abeta-Berbine, 2,3,9,10-tetramethoxy-13alpha-methyl- (8CI), (13S)-5,8,13,13abeta-Tetrahydro-2,3,9,10-tetramethoxy-13alpha-methyl-6H-dibenzo[a,g]quinolizine, 6H-Dibenzo(a,g)quinolizine, 5,8,13,13a-tetrahydro-2,3,9,10-tetramethoxy-13-methyl-, (13S-trans)- (9CI)


ID: 2380

chemical graph of compound 2380



InChIKey: VSGNGLJPOGUDON-UHFFFAOYSA-N
SMILES: C1=CC(=CC=C1C(CN)CP(=O)(O)O)Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 1641
synonyms found at PubChem are:
Phaclofen, 114012-12-3, [3-amino-2-(4-chlorophenyl)propyl]phosphonic acid, (3-Amino-2-(4-chlorophenyl)propyl)phosphonic acid, Phosphonic acid, (3-amino-2-(4-chlorophenyl)propyl)-, 108351-35-5, Phosphonic acid,P-[3-amino-2-(4-chlorophenyl)propyl]-, 3-Amino-2-(4-chlorophenyl)propylphosphonic acid, 3-Amino-2-(4-chlorophenyl) propylphosphonic acid, SR-01000075640, Phaclofen, solid, beta-(4-Chlorophenyl)-3-aminopropylphosphonic acid, ACMC-20djlx, AC1L1BWO, AC1Q3NDJ, Biomol-NT_000256, D02HNM, Lopac0_000967, SCHEMBL339995, BPBio1_000970, GTPL1091, CHEMBL1255941, CTK4A8561, MolPort-003-959-151, VSGNGLJPOGUDON-UHFFFAOYSA-N, HMS3263A15, Tox21_500967, BN0416, MFCD00069328, AKOS024418761, CCG-205047, LP00967, MCULE-7710657775, NCGC00015781-03, NCGC00015781-04, NCGC00015781-05, NCGC00015781-06, NCGC00024483-02, NCGC00024483-03, NCGC00024483-04, NCGC00261652-01, CC-33608, SC-43783, LS-183985, RT-015021, EU-0100967, FT-0631072, P-118, 3-Amino-2-(4-chlorophenyl)propanephosphonic acid, C-15347, L000482, J-003047, SR-01000075640-1, SR-01000075640-3, (RS)-3-Amino-2-(4-chlorophenyl)propylphosphonic acid, Phosphonic acid, P-[3-amino-2-(4-chlorophenyl)propyl]-, Phosphonic acid, (3-amino-2-(4-chlorophenyl)propyl)-, (+-)-


ID: 2381

chemical graph of compound 2381



InChIKey: VSHNBNRUBKFQCR-HVYAKZLKSA-N
SMILES: C[C@]12CCC3C(C1CCC2=O)CCC4=C3C=CC(=C4)OC(=O)CCC(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5702254
synonyms found at PubChem are:
estrone hemisuccinate, SPBio_001516, Spectrum_001760, AC1NWAX7, Spectrum2_001578, Spectrum4_001093, Spectrum5_001896, KBioGR_001506, KBioSS_002240, DivK1c_000641, HMS502A03, KBio1_000641, KBio2_002240, KBio2_004808, KBio2_007376, NINDS_000641, CCG-39356, IDI1_000641, 4-[[(13S)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl]oxy]-4-oxobutanoic acid


ID: 2382

chemical graph of compound 2382



InChIKey: VSJCDPYIMBSOKN-UHFFFAOYSA-N
SMILES: C1=CC2=C(C=C1O)OC(C(C2=O)O)C3=CC(=C(C(=C3)O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 20399
synonyms found at PubChem are:
Dihydrorobinetin, 2,3-Dihydrorobinetin, Hydrorobinetin, Robinetin, dihydro-, 3,3',4',5',7-Pentahydroxyflavanone, NSC59266, 93432-80-5, EINECS 224-486-0, NSC-59266, 3,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)chroman-4-one, 70460-55-8, 4H-1-Benzopyran-4-one, 2,3-dihydro-3,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-, FLAVANONE, 3,3',4',5',7-PENTAHYDROXY-, (R,R)-(+)-, (2R-trans)-2,3-Dihydro-3,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-4-benzopyrone, 4H-1-Benzopyran-4-one, 2,3-dihydro-3,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-, trans-, FLAVANONE DER., 3,7,3',4',5'-Pentahydroxyflavanone, NSC 59266, DIHYDROROBINETIN(RG), AC1L2G6S, SCHEMBL432880, CHEMBL444171, CTK5H2494, AKOS032948421, MCULE-5340165807, 4CN-1405, LS-68938, NCI60_004442, Flavanone 3,3',4',5',7-pentahydroxy-, ST50331519, W1555, FLAVANONE, 3',4',5',7-PENTAHYDROXY, A826426, 3,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-2,3-dihydrochromen-4-one, 2,3-DIHYDRO-3,7-DIHYDROXY-2-(3,4,5-TRIHYDROXYPHENYL)-4H-1-BENZOPYRAN-4-ONE, 3,7-bis(oxidanyl)-2-[3,4,5-tris(oxidanyl)phenyl]-2,3-dihydrochromen-4-one, 3,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-4-one, 2542-38-3, 25532-62-1, 7400-09-1


ID: 2383

chemical graph of compound 2383



InChIKey: VSJKWCGYPAHWDS-FQEVSTJZSA-N
SMILES: CC[C@@]1(C2=C(COC1=O)C(=O)N3CC4=CC5=CC=CC=C5N=C4C3=C2)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 24360
synonyms found at PubChem are:
camptothecin, Camptothecine, (S)-(+)-Camptothecin, 7689-03-4, Campathecin, (+)-Camptothecine, d-Camptothecin, 20(S)-Camptothecine, (+)-Camptothecin, 21,22-Secocamptothecin-21-oic acid lactone, NSC94600, (S)-Camptothecin, 20(S)-Camptothecin, Camptothecine (8CI), Camptothecine (S,+), CHEMBL65, UNII-XT3Z54Z28A, MLS000766223, XT3Z54Z28A, CHEBI:27656, VSJKWCGYPAHWDS-FQEVSTJZSA-N, Camptothecin, Camptotheca acuminata, NSC-94600, (4S)-4-ethyl-4-hydroxy-1H-pyrano[3',4':6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione, Camptothecin derivative, Q-200785, (S)-4-ethyl-4-hydroxy-1H-Pyrano[3',4':6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione, (S)-4-Ethyl-4-hydroxy-1H-pyrano[3',4':6,7]indolizino[1,2-b]quinoline-3,14-(4H,12H)-dione, 1H-Pyrano(3',4':6,7)indolizino(1,2-b)quinoline-3,14(4H,12H)-dione, 4-ethyl-4-hydroxy-, (S)-, 4-Ethyl-4-hydroxy-1H-pyrano[3&prime;,4&prime;:6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)dione, SR-01000075798, SR-01000597379, d-camptothecine, (s)-camptothecine, Camptothecin,(S), ( )-Camptothecin, (S)-4-ethyl-4-hydroxy-1H-Pyrano(3',4':6,7)indolizino(1,2-b)quinoline-3,14(4H,12H)-dione, 1H-Pyrano(3',4':6,7)indolizino(1,2-b)quinoline-3,14(4H,12H)-dione, 4-ethyl-4-hydroxy-, (4S)-, 1H-Pyrano[3',4':6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione, 4-ethyl-4-hydroxy-, (4S)-, 1H-Pyrano[3',4':6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione, 4-ethyl-4-hydroxy-, (S)-, 4-ETHYL-4-HYDROXY-1,12-DIHYDRO-4H-2-OXA-6,12A-DIAZA-DIBENZO[B,H]FLUORENE-3,13-DIONE, Prestwick_102, CAMPTOTHECINUM, (+)-Camptothecin;, PubChem10183, Spectrum_000299, Tocris-1100, SpecPlus_000712, AC1L2NDR, Prestwick0_000200, Prestwick1_000200, Prestwick2_000200, Prestwick3_000200, Spectrum2_000903, Spectrum3_001203, Spectrum4_000738, Spectrum5_001126, Lopac-C-9911, D09YDM, AC1Q2C5X, SCHEMBL6038, Lopac0_000341, BSPBio_000159, BSPBio_002586, KBioGR_001036, KBioSS_000779, KBioSS_002283, cid_24360, DivK1c_000826, DivK1c_006808, SPECTRUM1502232, SPBio_000746, SPBio_002080, AC1Q2C60, BPBio1_000175, Jsp000050, DTXSID0030956, HMS502J08, KBio1_000826, KBio1_001752, KBio2_000779, KBio2_003347, KBio2_005915, KBio3_002086, BIC8442, 4-Ethyl-4-hydroxy-1H-pyrano-[3',4':6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione, MolPort-001-738-745, NINDS_000826, ZX-AFC000426, Bio1_000400, Bio1_000889, Bio1_001378, HMS1568H21, HMS1921N08, HMS2089F08, HMS2095H21, HMS3261E03, HMS3654D13, HMS3712H21, ZINC105309, (S)-4-Ethyl-4-hydroxy-1H-pyrano-[3',4':6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione, ACT02668, BCP02857, ZX-AT019935, Tox21_500341, AC-202, BBL033963, BDBM50008923, BG0120, CCG-40255, GR-301, s1288, STK801886, AKOS004119861, API0001826, CS-1049, DB04690, KS-5235, LP00341, MCULE-1654983682, SDCCGMLS-0066688.P001, CAS-2114454, IDI1_000826, NCGC00015290-01, NCGC00016994-01, NCGC00016994-02, NCGC00016994-03, NCGC00016994-04, NCGC00016994-05, NCGC00016994-06, NCGC00016994-07, NCGC00016994-08, NCGC00016994-09, NCGC00016994-10, NCGC00016994-11, NCGC00016994-12, NCGC00016994-16, NCGC00024997-01, NCGC00024997-02, NCGC00024997-03, NCGC00024997-04, NCGC00024997-05, NCGC00024997-06, NCGC00178592-01, NCGC00178592-02, NCGC00261026-01, AJ-11194, AK-39842, AN-16065, BC203226, BR-39842, HY-16560, K332, KB-38584, NCI60_042105, OR014824, SMR000445686, SY010324, AX8038860, ST2412720, EU-0100341, FT-0623436, N1868, C 9911, C01897, J10012, M01564, S-2515, 32320-EP2270008A1, 32320-EP2272827A1, 32320-EP2275420A1, 32320-EP2277507A1, 32320-EP2277865A1, 32320-EP2280013A1, 32320-EP2281815A1, 32320-EP2286795A1, 32320-EP2286812A1, 32320-EP2289892A1, 32320-EP2292615A1, 32320-EP2292617A1, 32320-EP2295055A2, 32320-EP2295416A2, 32320-EP2298748A2, 32320-EP2298764A1, 32320-EP2298765A1, 32320-EP2298778A1, 32320-EP2301933A1, 32320-EP2305640A2, 32320-EP2305642A2, 32320-EP2305671A1, 32320-EP2308855A1, 32320-EP2311453A1, 32320-EP2311827A1, 32320-EP2311840A1, AB00052452-08, AB00052452-09, AB00052452_10, (S)-(+)-Camptothecin, >=90% (HPLC), powder, 157594-EP2277507A1, 157594-EP2286795A1, 179002-EP2280013A1, 689C034, SR-01000075798-1, SR-01000075798-4, SR-01000597379-1, SR-01000597379-3, BRD-K37890730-001-09-4, BRD-K37890730-001-10-2, (S)-4-ethyl-4-hydroxy-1,12-dihydro-4H-2-oxa-6,12a-diaza-dibenzo[b,h]florene-3,13-dione, (S)-4-ethyl-4-hydroxy-1,12-dihydro-4H-2-oxa-6,12a-diaza-dibenzo[b,h]fluorene-3,13-dione, 4-Ethyl-4-hydroxy-1H-pyrano-[3[,4[:6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione, Topotecan Related Compound C, United States Pharmacopeia (USP) Reference Standard, (19S)-19-ethyl-19-hydroxy-17-oxa-3,13-diazapentacyclo[11.8.0.0(2),(1)(1).0?,?.0(1)?,(2)?]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione, 1H-Pyrano[3',7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione, 4-ethyl-4-hydroxy-, (S)-, 4(S)-Ethyl-4-hydroxy-1H-pyrano-[3',4':6,7]indolizino[1,2-b]quinoline-3,14 (4H,12H)-dione, 4-ethyl-4-hydroxy-(4S)-3,4,12,14-tetrahydro-1H-pyrano[3'',4'':6,7]indolizino[1,2-b]quinoline-3,14-dione, 4-Ethyl-4-hydroxy-1,12-dihydro-4H-2-oxa-6,12a-diaza-dibenzo[b,h]fluorene-3,13-dione (camptothecin or CPT), 4-Ethyl-4-hydroxy-1,12-dihydro-4H-2-oxa-6,12a-diaza-dibenzo[b,h]fluorene-3,13-dione (Camptothecin), 4-Ethyl-4-hydroxy-1,12-dihydro-4H-2-oxa-6,12a-diaza-dibenzo[b,h]fluorene-3,13-dione (CPT, Camptothecin)


ID: 2384

chemical graph of compound 2384



InChIKey: VSJZZGYSZUIAFS-UHFFFAOYSA-N
SMILES: CC(=O)NC1=CC=C(C=C1)NC2=NC(=CS2)C3=CC(=C(C=C3)OC)OC

biological descriptors:

CFTR relevance: CFTR corrector

Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown

reference list:

"GL Lukacs" "N Pedemonte" "O Zegarra-Moran" "LJ Galietta" "K Du" "AS Verkman" "E Caci"


CID is 1117211
synonyms found at PubChem are:
AC1LLWFV, Oprea1_137180, Oprea1_825573, SCHEMBL837656, MolPort-000-690-671, ZINC853352, AKOS002382724, MCULE-1907627141, SR-01000477289, SR-01000477289-1, N-[4-[[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]amino]phenyl]acetamide


ID: 2385

chemical graph of compound 2385



InChIKey: VSNHCAURESNICA-UHFFFAOYSA-N
SMILES: C(=O)(N)NO

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3657
synonyms found at PubChem are:
hydroxyurea, Hydroxycarbamide, 127-07-1, N-Hydroxyurea, 1-HYDROXYUREA, Hydrea, Oxyurea, Carbamoyl oxime, Biosupressin, Hydroxycarbamine, Onco-carbide, Carbamohydroxamic acid, Carbamohydroximic acid, Hydura, Litalir, Carbamyl hydroxamate, Hydurea, N-Carbamoylhydroxylamine, Urea, hydroxy-, Droxia, Hidrix, Hydroxicarbamidum, Hydroxylurea, Hydreia, Litaler, Siklos, Idrossicarbamide [DCIT], Hidroxicarbamida, Hydroxyharnstoff, Hydroxycarbamidum, Carbamohydroxyamic acid, N-Hydroxymocovina, Hydroxylamine, N-carbamoyl-, Hydroxyharnstoff [German], Hydroxycarbamid, N-Hydroxymocovina [Czech], Oncocarbide, Idrossicarbamide, SQ 1089, Hydroxylamine, N-(aminocarbonyl)-, Carrbamoyl Oxime, SK 22591, Hydroxycarbamidum [INN-Latin], Hidroxicarbamida [INN-Spanish], urea, N-hydroxy-, Hydroxyurea (D4), NCI-C04831, HU, CCRIS 958, HYDROXY-UREA, NSC 32065, N-HYDROXY UREA, Mylocel, carbamide oxide, Hydroxyurea [USAN:BAN], UNII-X6Q56QN5QC, Hydroxyurea (USP), Droxia (TM), Droxia (TN), Hydrea (TM), N-(Aminocarbonyl) Hydroxyamine, hydroxyaminomethanamide, AI3-51139, HSDB 6887, Hydroxyurea (Cytodrox), DRG-0253, NSC32065, EINECS 204-821-7, HYDREA (TN), CHEMBL467, SQ-1089, BRN 1741548, Hydroxycarbamide (JAN/INN), X6Q56QN5QC, CHEBI:44423, S-phase/G-1 interface inhibitor, VSNHCAURESNICA-UHFFFAOYSA-N, Hydroxy Urea-15N, NCGC00015520-03, DSSTox_CID_5438, H 8627, DSSTox_RID_77787, DSSTox_GSID_25438, NHY, tetratogen: inhibits ribonucleoside diphosphate reductase, CAS-127-07-1, SMR000059149, SR-01000075919, Hydroxyurea [USAN:USP], oxyrea, Cytodrox, hydroxyl urea, hydroxy urea, 1-oxidanylurea, Hydroxyurea(d4), aminohydroxamic acid, carbamic acid oxime, Carbomohydroxamic acid, Spectrum_000909, Hydroxycarbamide [INN], WLN: ZVMQ, AC1Q4ZXK, Hydrea (Bristol Meyers), Spectrum2_000064, Spectrum3_000462, Spectrum4_000012, Spectrum5_000836, Lopac-H-8627, D07CWD, MolMap_000029, NCIMech_000139, AC1L1GF8, Hydroxyurea, 98%, powder, ACMC-1C22W, Lopac0_000596, BSPBio_002164, KBioGR_000383, KBioSS_001389, 4-03-00-00170 (Beilstein Handbook Reference), hydroxycarbamide (hydroxyurea), KSC490O3R, MLS001332381, MLS001332382, MLS002153389, DivK1c_000556, N-(Aminocarbonyl)hydroxylamine, SPECTRUM1500344, SPBio_000247, GTPL6822, DTXSID6025438, CTK3J0738, HMS501L18, KBio1_000556, KBio2_001389, KBio2_003957, KBio2_006525, KBio3_001384, MolPort-000-003-971, NINDS_000556, Bio1_000451, Bio1_000940, Bio1_001429, HMS1920F09, HMS2091L17, HMS2234I03, HMS3261H14, HMS3373G18, HMS3655K20, NCI C04831, Pharmakon1600-01500344, ACT02611, ALBB-028465, EBD12517, HY-B0313, ZINC8034120, Tox21_110168, Tox21_300319, Tox21_500596, ANW-18958, BBL009928, BDBM50017811, CCG-35236, LS-709, MFCD00007943, NSC-32065, NSC757072, s1896, STL145898, AKOS005716276, AKOS006222547, Tox21_110168_1, ZINC100019199, AN-6974, CS-2353, DB01005, LP00596, MCULE-9465284053, NSC-757072, RP18352, RTR-003905, IDI1_000556, KS-0000020X, TRA-0204880, NCGC00015520-01, NCGC00015520-02, NCGC00015520-04, NCGC00015520-05, NCGC00015520-06, NCGC00015520-07, NCGC00015520-08, NCGC00015520-09, NCGC00015520-10, NCGC00015520-11, NCGC00093974-01, NCGC00093974-02, NCGC00093974-03, NCGC00093974-04, NCGC00093974-05, NCGC00254007-01, NCGC00261281-01, AC-22674, NCI60_002773, SC-17803, SBI-0050578.P004, AB0013265, AB1009531, Hydrea, Biosupressin, Cytodrox, Hydroxyurea, KB-219051, ST2415349, TL8000673, TR-003905, EU-0100596, FT-0083575, FT-0627160, C07044, D00341, H20210, Hydroxyurea, Vetec(TM) reagent grade, >=98%, AB00052018-09, AB00052018-10, AB00052018_11, AB00052018_12, 127H071, A805636, I05-0250, J-504798, SR-01000075919-1, SR-01000075919-3, SR-01000075919-8, E0723DBA-5AF3-49D1-B5F6-59420AB87AC9, F8880-0905, Z1522566612, Hydroxycarbamide, European Pharmacopoeia (EP) Reference Standard, Hydroxyurea, United States Pharmacopeia (USP) Reference Standard


ID: 2386

chemical graph of compound 2386



InChIKey: VSQQQLOSPVPRAZ-RRKCRQDMSA-N
SMILES: C1[C@@H]([C@H](O[C@H]1N2C=C(C(=O)NC2=O)C(F)(F)F)CO)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6256
synonyms found at PubChem are:
Trifluridine, TRIFLUOROTHYMIDINE, 70-00-8, Viroptic, 5-Trifluorothymidine, Trifluridina, Trifluridinum, Virophta, Trifluoromethyldeoxyuridine, F3TDR, F3DThd, TFDU, 5-(Trifluoromethyl)deoxyuridine, 5-Trifluoromethyl-2-deoxyuridine, Trifluoridine, Fluridine, Trifluridinum [INN-Latin], Trifluridina [INN-Spanish], 2'-Deoxy-5-(trifluoromethyl)uridine, Trifluridine [USAN:INN], 5-Trifluoro-2'-deoxythymidine, 2'-Deoxy-5-trifluoromethyluridine, 5-Trifluoromethyl-2'-deoxyuridine, UNII-RMW9V5RW38, alpha,alpha,alpha-Trifluorothymidine, 1-((2R,4S,5R)-4-Hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-5-(trifluoromethyl)pyrimidine-2,4(1H,3H)-dione, CF3dUrd, Viroptic (TN), Thymidine, alpha,alpha,alpha-trifluoro-, CCRIS 2348, Uridine, 2'-deoxy-5-(trifluoromethyl)-, Triflurdine (Viroptic), Trifluridine (Viroptic), EINECS 200-722-8, NSC 75520, F3T, Trifluorothymine deoxyriboside, NSC 529182, BRN 0568095, CHEMBL1129, RMW9V5RW38, MLS000028361, CHEBI:75179, 5-(Trifluoromethyl)-2'-deoxyuridine, HS-0007, SMR000058583, 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-(trifluoromethyl)pyrimidine-2,4-dione, 2,4(1H,3H)-Pyrimidinedione, 1-(2-deoxy-beta-D-ribofuranosyl)-5-(trifluoromethyl)-, DSSTox_CID_26602, DSSTox_RID_81757, DSSTox_GSID_46602, C10H11F3N2O5, 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-(trifluoromethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione, 1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-(trifluoromethyl)pyrimidine-2,4-dione, Trifluridin, NSC75520, NSC529182, Trifluridine [USAN:USP:INN], HSDB 8126, CAS-70-00-8, NCGC00166323-01, Opera_ID_1810, 5-Trifluoromethylthymidine, Trifluridine (USP/INN), Viroptic;Trifluorothymidine, D05RHI, Trifluoromethyl Deoxyuridine, AC1L1M4O, cid_6256, SCHEMBL3479, MLS001148248, MLS006010219, Trifluridine (JAN/USP/INN), GTPL8697, DTXSID4046602, cid_6708818, MolPort-003-959-693, VSQQQLOSPVPRAZ-RRKCRQDMSA-N, HMS2233N19, HMS3715C14, 5-trifluoromethyl-2''-deoxyuridine, BCP09147, HY-A0061, KS-00000FU6, ZINC3842753, Tox21_112411, BDBM50132298, MFCD00006534, PC2508, Trifluorothymidine, >=99% (HPLC), AKOS015919482, Tox21_112411_1, ACN-036847, CCG-221056, CS-1602, DB00432, NUC0000876, NCGC00166323-02, AJ-45814, AK-24803, AN-11686, BR-24803, CC-35357, KB-80814, SC-09179, SRI-10817-12, SRI-10817_14, Viroptic, Trifluorothymidine, Trifluridine, AB0068586, AB2000289, AX8011895, LS-153788, AM20100660, FT-0082240, S1778, D00391, S-5386, 006T534, C-18551, SR-01000721911, J-700255, J-700357, SR-01000721911-2, BRD-K03243820-001-12-1, BRD-K03243820-001-25-3, 2 inverted exclamation marka-Deoxy-5-trifluoromethyluridine, Trifluridine, British Pharmacopoeia (BP) Reference Standard, Trifluridine, United States Pharmacopeia (USP) Reference Standard, 1-((2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-tetrahydrofuran-2-yl)-5-(trifluoromethyl)pyrimidine-2,4(1H,3H)-dione, 1-((2R,5R)-4-Hydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-5-trifluoromethyl-1H-pyrimidine-2,4-dione


ID: 2387

chemical graph of compound 2387



InChIKey: VSZUGNOVOOTAQU-INIZCTEOSA-N
SMILES: C[C@]12CCC(=O)C=C1CCC3=C2C=CC=C3OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6708585
synonyms found at PubChem are:
14-METHOXY-4,4-BISNOR-4,8,11,13-PODOCARPATETRAEN-3-ONE, Spectrum_001217, SpecPlus_000170, Spectrum2_000287, Spectrum3_000132, Spectrum4_000938, Spectrum5_001773, AC1O8FE9, BSPBio_001804, KBioGR_001496, KBioSS_001697, SPECTRUM100648, DivK1c_006266, SPBio_000194, CHEMBL1318710, KBio1_001210, KBio2_001697, KBio2_004265, KBio2_006833, KBio3_000984, ZINC3978388, CCG-39845, SDCCGMLS-0066418.P001, NCGC00095449-01, NCGC00095449-02, (4aS)-8-methoxy-4a-methyl-3,4,9,10-tetrahydrophenanthren-2-one


ID: 2388

chemical graph of compound 2388



InChIKey: VTCDZPUMZAZMSB-UHFFFAOYSA-N
SMILES: COC1=CC(=CC(=C1OC)OC)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 69505
synonyms found at PubChem are:
3,4,5-Trimethoxyphenol, 642-71-7, Antiarol, Phenol, 3,4,5-trimethoxy-, CHEBI:2760, 3,4,5-TRIMETHOXY PHENOL, VTCDZPUMZAZMSB-UHFFFAOYSA-N, Anitarol, EINECS 211-387-2, Spectrum_000525, SpecPlus_000623, AI3-38432, 1,3,5-trimethoxyphenol, Spectrum3_001208, Spectrum4_001487, Spectrum5_000193, 3,4,5-trirnethoxyphenol, 3,4,5-trimethoxy-phenol, 3,4,5-?Trimethoxyphenol, C10765, AC1L2C0Z, BSPBio_002596, KBioGR_002093, KBioSS_001005, SPECTRUM200110, DivK1c_006719, SCHEMBL210578, AC1Q56J6, ACMC-1B666, CHEMBL1319047, CTK3J5040, KBio1_001663, KBio2_001005, KBio2_003573, KBio2_006141, KBio3_002096, 3,4,5-Trimethoxyphenol, 97%, DTXSID20214405, MolPort-002-462-093, ZINC405113, ANW-46736, CT-422, AKOS005258271, AC-5984, CCG-214337, GF-0143, MCULE-1478686730, TRA-0184202, NCGC00095916-01, NCGC00095916-02, 4CN-0953, AJ-22434, AN-10409, SC-74937, ST092709, ZB013613, DB-054637, RT-002330, ST2404572, FT-0614170, FT-0614171, W1976, X-4180, SR-05000002420, I01-8859, SR-05000002420-1, W-104852, BRD-K28698314-001-01-3, BRD-K28698314-001-02-1, InChI=1/C9H12O4/c1-11-7-4-6(10)5-8(12-2)9(7)13-3/h4-5,10H,1-3H


ID: 2389

chemical graph of compound 2389



InChIKey: VTJXFTPMFYAJJU-UHFFFAOYSA-N
SMILES: C1=CC(=C(C=C1C=C(C#N)C#N)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 2052
synonyms found at PubChem are:
Tyrphostin 23, 118409-57-7, Tyrphostin A23, AG 18, RG-50810, (3,4-Dihydroxybenzylidene)malononitrile, AG-18, Tyrphostin AG18, Tyrphostin RG50810, 2-(3,4-dihydroxybenzylidene)malononitrile, UNII-RV0GCD31OJ, alpha-Cyano-(3,4-dihydroxy)cinnamonitrile, RG 50810, 2-[(3,4-dihydroxyphenyl)methylidene]propanedinitrile, Propanedinitrile,2-[(3,4-dihydroxyphenyl)methylene]-, ag18, (3,4-Dihydroxyphenyl)methylene propanedinitrile, RV0GCD31OJ, C10H6N2O2, IN1041, NCGC00016043-03, (3,4-dihydroxybenzylidene)propanedinitrile, DSSTox_CID_25215, DSSTox_RID_80754, DSSTox_GSID_45215, Propanedinitrile, ((3,4-dihydroxyphenyl)methylene)-, CAS-118409-57-7, SR-01000075506, tyrphostin-23, 3,4-dihydroxybenzylidenemalononitrile, Tocris-0493, ACMC-20dhi7, BiomolKI_000011, Lopac-T-7165, BiomolKI2_000021, D0A0JL, AC1L1CT6, AC1Q4PY6, cid_2052, Lopac0_001160, Oprea1_072726, AG 18 (Tyrphostin 23), Tyrphostin 23, >=98%, MLS002153315, Tyrphostin A23 and AG 18, CHEMBL76904, SCHEMBL241922, BDBM4339, BMK1-B11, DTXSID9045215, CHEBI:92862, CTK4B0662, ZINC15331, AOB5120, EX-A901, MolPort-003-850-808, VTJXFTPMFYAJJU-UHFFFAOYSA-N, HMS2233I22, HMS3263H21, HMS3266E18, HMS3369M02, HMS3653D19, BCP06838, Tox21_110287, Tox21_501160, 2085AH, 2773AH, BBL008106, HSCI1_000108, IN2258, MFCD00133899, s8009, STL139213, 3,4-Dihydroxybenzylidene malononitrile, AKOS005715658, Tox21_110287_1, AG18;Tyrphostin 23; RG-50810, CCG-100615, CS-1387, LP01160, MCULE-8159081339, 3,4-(Dihydroxybenzylidene)malononitrile, KS-0000185K, NCGC00016043-01, NCGC00016043-02, NCGC00016043-04, NCGC00016043-05, NCGC00016043-06, NCGC00016043-07, NCGC00016043-08, NCGC00024615-01, NCGC00024615-02, NCGC00024615-03, NCGC00024615-04, NCGC00261845-01, AC-30286, benzylidenemalononitrile (BMN) deriv. 23, HY-15644, SC-95402, SMR001230729, ZB000733, AB0152128, KB-270755, LS-172378, RT-016155, 2-(3,4-Dihydroxy-benzylidene)-malononitrile, 4CH-004570, EU-0101160, FT-0675716, T 7165, W-5079, [(3,4-Dihydroxyphenyl)methylene]-propenedinitrile, J-003744, SR-01000075506-1, SR-01000075506-3, SR-01000075506-6, BRD-K49657628-001-02-3, BRD-K49657628-001-03-1, BRD-K49657628-001-05-6, Propanedinitrile, 2-[(3,4-dihydroxyphenyl)methylene]-


ID: 2390

chemical graph of compound 2390



InChIKey: VTNQPKFIQCLBDU-UHFFFAOYSA-N
SMILES: CCC1=CC=CC(=C1N(COCC)C(=O)CCl)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 1988
synonyms found at PubChem are:
acetochlor, 34256-82-1, 2-Chloro-N-(ethoxymethyl)-N-(2-ethyl-6-methylphenyl)acetamide, Acetochlore, Azetochlor, Harness, Nevirex, Acenit, Erunit, Acetamide, 2-chloro-N-(ethoxymethyl)-N-(2-ethyl-6-methylphenyl)-, Caswell No. 003B, Acetochlore [ISO-French], UNII-8L08WMO94K, Acetochlor [ANSI:BSI:ISO], CCRIS 7709, 2-Chloro-2'-methyl-6-ethyl-N-ethoxymethylacetanilide, 2-Chloro-N-(ethoxymethyl)-6'-ethyl-o-acetotoluidide, HSDB 6550, MON 097, MG 02, EINECS 251-899-3, EPA Pesticide Chemical Code 121601, BRN 2859702, 8L08WMO94K, CHEBI:2394, VTNQPKFIQCLBDU-UHFFFAOYSA-N, 2-Chloro-N-(ethoxymethyl)-6'-ethylacet-o-toluidide, DSSTox_CID_3848, DSSTox_RID_77206, 2-chloro-n-ethoxymethyl-6'-ethylacet-o-toluidide, DSSTox_GSID_23848, top hand, SMR000777859, CAS-34256-82-1, Spectrum_001979, SpecPlus_000626, AC1L1COB, AC1Q3TBK, Spectrum2_001915, Spectrum3_000873, Spectrum4_000713, Spectrum5_002071, SCHEMBL21390, BSPBio_002545, KBioGR_001265, KBioSS_002545, SPECTRUM330089, MLS001055474, MLS002695926, DivK1c_006722, SPBio_001910, CHEMBL1517425, DTXSID8023848, o-Acetotoluidide, 2-chloro-N-(ethoxymethyl)-6'-ethyl-, KBio1_001666, KBio2_002536, KBio2_005104, KBio2_007672, KBio3_002045, 2-Chloro-N-(ethoxymethyl)-6'-ethylacet-o-toluidide (8CI), MolPort-003-665-473, HMS3029L16, o-Acetotoluidide, 2-chloro-N-(ethoxymethyl)-6'-ethyl- (8CI), ZINC1532058, Tox21_202445, Tox21_300889, CCG-39458, Acetochlor 10 microg/mL in Isooctane, Acetamide, 2-chloro-N-(ethoxymethyl)-N-(2-ethyl-6-methylphenyl)- (9CI), AKOS015889911, GS-6265, LS-1221, NE28170, KS-0000269N, Acetochlor 100 microg/mL in Cyclohexane, NCGC00090754-01, NCGC00090754-02, NCGC00090754-03, NCGC00090754-04, NCGC00090754-05, NCGC00090754-06, NCGC00090754-07, NCGC00090754-08, NCGC00090754-09, NCGC00254793-01, NCGC00259994-01, 123113-74-6, AJ-26741, CJ-24116, KB-47073, Acetochlor, PESTANAL(R), analytical standard, C10925, 256A821, SR-01000846094, I01-4388, J-019525, SR-01000846094-2, BRD-K16652251-001-02-7, 2-chloro-2'-ethyl-6'-methyl-N-(ethoxymethyl)acetanilide, 2-chloro-2'-ethyl-6'-methyl-N-(ethoxymethyl) acetanilide, N-(ethoxymethyl)-2-chloro-N-(2-ethyl,6-methylphenyl)acetamide, 2-Chloro-N-(ethoxymethyl)-N-(2-ethyl-6-methylphenyl)acetamide #


ID: 2391

chemical graph of compound 2391



InChIKey: VTUMIISWLFIURS-KPZWWZAWSA-N
SMILES: COC1=C(C=C(C=C1)[C@@H]2[C@H](CC3=C(O2)C(=C(C=C3OC)OC)I)O)OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6708556
synonyms found at PubChem are:
8-IODOCATECHIN TETRAMETHYL ETHER, KBio1_001144, Spectrum_000546, SpecPlus_000104, Spectrum2_000881, Spectrum3_000674, Spectrum4_001588, Spectrum5_000276, AC1O8FD4, BSPBio_002367, KBioGR_002176, KBioSS_001026, SPECTRUM240567, DivK1c_006200, SPBio_000662, CHEMBL3039029, KBio2_001026, KBio2_003594, KBio2_006162, KBio3_001587, CHEBI:108585, CCG-39659, SDCCGMLS-0066487.P001, NCGC00178685-01, BRD-K07396820-001-02-4, (2R)-2alpha-(3,4-Dimethoxyphenyl)-5,7-dimethoxy-8-iodochroman-3beta-ol, (2R,3S)-2-(3,4-dimethoxyphenyl)-8-iodo-5,7-dimethoxy-3,4-dihydro-2H-chromen-3-ol


ID: 2392

chemical graph of compound 2392



InChIKey: VUFGUVLLDPOSBC-XRZFDKQNSA-M
SMILES: CC(=O)OCC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)CC3=CC=CS3)SC1)C(=O)[O-].[Na+]

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6023
synonyms found at PubChem are:
CEPHALOTHIN SODIUM, 58-71-9, cefalotin sodium, Sodium cephalothin, Cephalothin sodium salt, Sodium cefalotin, Sodium cephalotin, Cefalotina sodica, Keflin, Cefalothine, Toricelocin, Ceporacin, Cepovenin, Lospoven, Microtin, Synclotin, Cephalotin sodium salt, Cet Injektionsfl, Cefalothin sodium, Tokiosarl Ampullen, Keflin In Plastic Container, Cephalothin (sodium), Cefalotin sodium salt, Lovvalline Injektionsfl, Lilly 38253, UNII-C22G6EYP8B, Keflin N Injektionsflaschen, Cefalotina sodica [Spanish], 7-(Thiophene-2-acetamido)cephalosporanic acid sodium salt, EINECS 200-394-6, C22G6EYP8B, CEPHALOTHIN SODIUM W/ DEXTROSE IN PLASTIC CONTAINER, CHEBI:3542, Sodium (6R,7R)-3-(acetoxymethyl)-8-oxo-7-(2-(thiophen-2-yl)acetamido)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate, CEPHALOTHIN SODIUM W/ SODIUM CHLORIDE IN PLASTIC CONTAINER, 7-(2-Thienylacetamido)cephalosporanic acid sodium salt, Keflin (TN), Monosodium (6R,7R)-3-(hydroxymethyl)-8-oxo-7-(2-(2-thienyl)acetamido)-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylate acetate (ester), 7-(THIOPHENE-2-ACETAMIDO)CEPHALOSPORANIC ACID SODIUM, MLS000069577, Cefalothine sodium, 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 3-((acetyloxy)methyl)-8-oxo-7-((2-thienylacetyl)amino)-, monosodium salt, (6R,7R)-, 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 3-((acetyloxy)methyl)-8-oxo-7-((2-thienylacetyl)amino)-, monosodium salt, (6R-trans)-, 5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 3-(hydroxymethyl)-8-oxo-7-(2-(2-thienyl)acetamido)-, acetate, monosodium salt, SMR000058777, Cephalothin sodium [USAN], 7-[2-Thienylacetamido]-cephalosporanic acid, Cephalothin sodium [USAN:USP], Prestwick_971, CEFALOTHIN NA, sodium cefalotin(1-), Cephalothin sodium (USP), Cefalotin sodium (JP17), D0DT5E, Cefalothin sodium salt,(S), CHEMBL1632, C16H15N2NaO6S2, SCHEMBL148785, SPECTRUM1500166, C16H15N2O6S2.Na, 153-61-7 (Parent), HMS500E19, MolPort-002-511-511, VUFGUVLLDPOSBC-XRZFDKQNSA-M, HMS1570O19, HMS1920K11, HMS2091A14, HMS2097O19, HMS3260J08, HMS3714O19, HY-B1275, Cephalothin sodium, Cefalotin sodium, Tox21_500283, CCG-38923, MFCD00072025, s4594, AKOS015896088, AB02836, CS-4850, KS-1135, LP00283, MCULE-2927862684, NCGC00093737-01, NCGC00260968-01, AC-15529, AN-41764, SC-25746, Cephalothin sodium salt, 96.0-101.0%, KB-303028, LS-150070, EU-0100283, FT-0603065, ST24049179, C 4520, C-2720, C08100, D00907, I06-1756, 7-(2-THIENYLACETAMIDO)CEPHALOSPORANIC ACID SODIUM, Cephalothin sodium salt, BioReagent, suitable for cell culture, Cephalotin sodium salt, Antibiotic for Culture Media Use Only, Cefalotin sodium, European Pharmacopoeia (EP) Reference Standard, Cephalothin sodium, United States Pharmacopeia (USP) Reference Standard, sodium 7beta-(2-thienylacetamido)-3-acetoxymethyl-3-cephem-4-carboxylate, Cefalotin for impurity B identification, European Pharmacopoeia (EP) Reference Standard, sodium (6R, 7R)-3-acetoxymethyl-7-(thien-2-ylacetamido)ceph-3-em-4-carboxylate, sodium (6R,7R)-3-acetoxymethyl-7-(thien-2-ylacetamido)ceph-3-em-4-carboxylate, (6R,7R)-3-ACETOXYMETHYL-8-OXO-7-(2-THIOPHEN-2-YL-ACETYLAMINO)-5-THIA-1-AZA-BICYCLO[4.2.0]OCT-2-ENE-2-CARBOXYLATE SODIUM, 11048-05-8, 297760-78-2, 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid,3-[(acetyloxy)methyl]-8-oxo-7-[(2-thienylacetyl)amino]-, monosodiumsalt, (6R,7R)-, 53493-25-7, 63-60-5, Monosodium (6R,7R)-3-(hydroxymethyl)-8-oxo-7-(2-(2-thienyl)acetamido)-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylate acetate, sodium (6R,7R)-3-(acetoxymethyl)-8-oxo-7-[(2-thienylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate, sodium (6R,7R)-3-(acetoxymethyl)-8-oxo-7-[[2-(2-thienyl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate, sodium (6R,7R)-3-(acetyloxymethyl)-8-oxo-7-[(2-thiophen-2-ylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate, sodium (6R,7R)-3-[(acetyloxy)methyl]-8-oxo-7-[2-(thiophen-2-yl)acetamido]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate


ID: 2393

chemical graph of compound 2393



InChIKey: VURXQEHHDMDTOV-UHFFFAOYSA-M
SMILES: C1=CC=[N+](C=C1)CCCO.[Cl-]

biological descriptors:

CFTR relevance: inactive

Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown

reference list:

"MH Nantz" "LJ Galietta" "K By" "EJ Niedzinski" "M Eda" "MF Springsteel" "MJ Haddadin" "MJ Kurth" "AS Verkman"


CID is 459572
synonyms found at PubChem are:
3-pyridin-1-ium-1-ylpropan-1-ol, AC1LA0R7, SCHEMBL2760699, 1-(3-Hydroxypropyl)pyridinium chloride, 1-(3-hydroxypropyl)-pyridinium chloride, 3-pyridin-1-ium-1-ylpropan-1-ol chloride, 187863-16-7


ID: 2394

chemical graph of compound 2394



InChIKey: VUWXAQFLTSBUDB-UHFFFAOYSA-N
SMILES: CCCCCCN(CCCCCC)C(=O)CC1=C(NC2=CC=CC=C21)C3=CC=C(C=C3)F

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 132496
synonyms found at PubChem are:
FGIN-1-27, 142720-24-9, N,N-Dihexyl-2-(4-fluorophenyl)indole-3-acetamide, Fgin 1 27, Fgin 1-27, N,N-Di-n-hexyl-2-(4-fluorophenyl)indole-3-acetamide, CHEMBL63154, 1H-Indole-3-acetamide, 2-(4-fluorophenyl)-N,N-dihexyl-, 2-(2-(4-fluorophenyl)-1H-indol-3-yl)-N,N-dihexylacetamide, 2-[2-(4-fluorophenyl)-1H-indol-3-yl]-N,N-dihexylacetamide, SR-01000075838, Tocris-0658, Lopac-D-8555, Biomol-NT_000279, D0A0ED, Lopac0_000453, MLS002153299, AC1L313J, BPBio1_001277, FGIN1-27, SCHEMBL1229718, CHEBI:92171, CTK8E7869, DTXSID90162141, MolPort-003-941-172, HMS2233E09, HMS3261K08, HMS3266F19, HMS3372L08, ZINC3780965, Tox21_500453, BDBM50045877, MFCD00467704, AKOS024458597, CCG-204545, LP00453, KS-0000186V, NCGC00015376-01, NCGC00015376-02, NCGC00015376-03, NCGC00015376-04, NCGC00015376-05, NCGC00015376-06, NCGC00015376-07, NCGC00024711-01, NCGC00024711-02, NCGC00024711-03, NCGC00024711-04, NCGC00261138-01, SMR001230718, KB-282275, LS-183378, RT-012707, B6394, EU-0100453, ST50405215, D 8555, J-007686, SR-01000075838-1, SR-01000075838-3, BRD-K09778810-001-01-5, 2-[2-(4-fluorophenyl)indol-3-yl]-N,N-dihexylacetamide, [N,N-di-n-hexyl-2-(4-fluorophenyl) indole-3-acetamide], 2-[2-(4-Fluoro-phenyl)-1H-indol-3-yl]-N,N-dihexyl-acetamide


ID: 2395

chemical graph of compound 2395



InChIKey: VVDXNJRUNJMYOZ-DHXVBOOMSA-N
SMILES: CCCCCC[C@@H]([C@@H](C)O)N1C=NC2=C1N=CN=C2N.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 11056106
synonyms found at PubChem are:
EHNA, D05ZHQ, GTPL5179, 9-[(2R,3S)-2-hydroxynonan-3-yl]-9H-purin-6-aminium chloride, EHNA hydrochloride, erythro-9-(2-Hydroxy-3-nonyl)adenine hydrochloride, EHNA, Hydrochloride, 81408-49-3, CHEBI:64139, 58337-38-5, erythro-9-(2-Hydroxy-3-nonyl)adenine, HCl, (2R,3S)-3-(adenin-9-yl)-2-nonanol hydrochloride, rac erythro-9-(2-Hydroxy-3-nonyl)adenine, Hydrochloride, NSC-263164, erythro-9-(2-Hydroxy-3-nonyl)-adenine hydrochloride, 51350-19-7, rac erythro-9-(2-Hydroxy-3-nonyl)adenine Hydrochloride, (2R,3S)-EHNA.HCl, MLS000860033, CHEMBL1257094, DTXSID9040473, CTK8F9418, MolPort-003-941-234, (2R,3S)-EHNA HYDROCHLORIDE, Tox21_500504, AKOS024456497, CCG-208066, LP00504, NCGC00093903-01, NCGC00261189-01, SMR000326891, B6662, EU-0100504, FT-0669390, (2R,3S)-9-(2-hydroxy-3-nonyl)adenine hydrochloride, 9-(2-Hydroxy-3-nonyl)adenine hydrochloride, erythro-, Erythro-9-(2-hydroxy-3-nonyl)adenine monohydrochloride, UNII-D94V1GC7I3 component VVDXNJRUNJMYOZ-DHXVBOOMSA-N, (2R,3S)-3-(6-amino-9H-purin-9-yl)nonan-2-ol hydrochloride, Erythro-9-(2-hydroxy-3-nonyl)adenine monohydrochloride, (+/-)-, Erythro-9-(2-hydroxy-3-nonyl)adenine,hc l potent inhibitor of a, (R,S)-6-amino-beta-hexyl-alpha-methyl-9H-purine-9-ethanol hydrochloride, 9H-Purine-9-ethanol, 6-amino-beta-hexyl-alpha-methyl-, monohydrochloride, (R*,S*)-, 9H-Purine-9-ethanol, 6-amino-beta-hexyl-alpha-methyl-, hydrochloride (1:1), (alphaR,betaS)-rel-, Erythro-9-(2-hydroxy-3-nonyl) Adenine HCl(2R,3S)-3-(6-amino-9H-purin-9-yl)nonan-2-ol hydrochloride, Erythro-9-(2-hydroxy-3-nonyl) adenine HCl(2R,3S)-3-(6-amino-9H-purin-9-yl)nonan-2-ol hydrochlorideErythro


ID: 2396

chemical graph of compound 2396



InChIKey: VVHDYJFDZYHAMR-UHFFFAOYSA-N
SMILES: CCNC(=O)C1C(C(C(O1)N2C=NC3=C2N=CN=C3NCC4=CC=CC=C4)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 4400
synonyms found at PubChem are:
N6-Benzyl-NECA, AC1L1I2Y, Lopac0_000236, PDSP1_000830, PDSP2_000817, CCG-204331, B-152, EU-0100236, SR-01000075201, SR-01000075201-1, 5-[6-(benzylamino)purin-9-yl]-N-ethyl-3,4-dihydroxyoxolane-2-carboxamide


ID: 2397

chemical graph of compound 2397



InChIKey: VVIUBCNYACGLLV-UHFFFAOYSA-N
SMILES: C(CS(=O)O)N

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 107812
synonyms found at PubChem are:
hypotaurine, 2-Aminoethanesulfinic acid, 300-84-5, Ethanesulfinic acid, 2-amino-, 2-Aminoethylsulfinic acid, Cystaminesulfinic acid, UNII-5L08GE4332, C2H7NO2S, CHEBI:16668, VVIUBCNYACGLLV-UHFFFAOYSA-N, 5L08GE4332, 2-aminoethanesulfinate, Cystaminesulfinate, 2-Aminoethylsulfinate, Tocris-0208, 2-amino-Ethanesulfinate, Lopac-H-1384, ACMC-1CMF0, bmse000452, 2-amino-Ethanesulfinic acid, AC1L32SI, Lopac0_000573, SCHEMBL154548, 2-aminoethane-1-sulfinic acid, Hypotaurine, >=98% (TLC), CHEMBL1256480, DTXSID8075380, SCHEMBL15177935, MolPort-003-941-598, HMS3261D08, KS-000018QJ, ZINC3995571, 2- degrees +/->>uOOIeNC>>CEa, Tox21_500573, FCH932650, MFCD00038197, AKOS006340932, API0007736, CCG-204662, CS-6985, LP00573, NCGC00015499-01, NCGC00015499-02, NCGC00015499-03, NCGC00015499-04, NCGC00015499-05, NCGC00024496-01, NCGC00024496-02, NCGC00024496-03, NCGC00261258-01, HY-100803, LS-174281, TC-166555, B6224, EU-0100573, FT-0713850, C00519, H 1384, C-48596, SR-01000075902, J-017773, SR-01000075902-1, BFE65B28-22CA-40B8-A677-2A9C0E17D0D0, hypotaurine zwitterion, 2-ammonioethanesulfinate, 2-azaniumylethanesulfinate, 2-mmonioethane-1-sulfinate, 2-azaniumylethane-1-sulfinate, CHEBI:57853


ID: 2398

chemical graph of compound 2398



InChIKey: VVLMSCJCXMBGDI-UHFFFAOYSA-M
SMILES: C[N+](C)(C)CC#CCN1CCCC1=O.[I-]

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3027782
synonyms found at PubChem are:
Oxotremorine M, oxotremorine methiodide, 63939-65-1, CHEMBL23957, SR-01000075338, oxotremorine M iodide, Oxotremorine-M iodide, Oxotremorine M, solid, AC1MHKBB, MLS000859927, NIOSH/ER9552000, CTK8G2226, HMS501C21, AOB4621, MolPort-003-983-655, HMS2233F17, HMS3262P10, HMS3267E18, HMS3372B22, Tox21_500954, BN0401, AKOS024456364, CCG-222258, FCH2296542, LP00954, NCGC00094256-01, NCGC00261639-01, LS-47470, SMR000326788, ER95520000, EU-0100954, O-100, SR-01000075338-1, SR-01000075338-3, trimethyl-[4-(2-oxopyrrolidin-1-yl)but-2-ynyl]azanium iodide, 4-(2-Oxo-1-pyrrolidinyl)-N,N,N-trimethyl-2-butyn-1-aminium iodide, N,N,N-Trimethyl-4-(2-oxo-1-pyrolidinyl)-2-butyn-1-ammonium iodide, 2-Butyn-1-aminium, 4-(2-oxo-1-pyrrolidinyl)-N,N,N-trimethyl-, iodide, N,N,N,-Trimethyl-4-(2-oxo-1-pyrrolidinyl)-2-butyn-1-ammonium iodide, N,N,N-Trimethyl-4-(2-oxo-1-pyrrolidinyl)-2-butyn-1-ammonium iodide


ID: 2399

chemical graph of compound 2399



InChIKey: VVOAZFWZEDHOOU-UHFFFAOYSA-N
SMILES: C=CCC1=CC(=C(C=C1)O)C2=C(C=CC(=C2)CC=C)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 72300
synonyms found at PubChem are:
Magnolol, 528-43-8, 5,5'-Diallyl-[1,1'-biphenyl]-2,2'-diol, 5,5'-Diallyl-2,2'-biphenyldiol, 5,5'-Diallyl-2,2'-dihydroxybiphenyl, 2,2'-Bichavicol, Dehydrodichavicol, 2'-Bichavicol, UNII-001E35HGVF, NSC 293099, 4-allyl-2-(5-allyl-2-hydroxy-phenyl)phenol, MLS001048917, 001E35HGVF, 2-(2-hydroxy-5-prop-2-enylphenyl)-4-prop-2-enylphenol, CHEBI:6643, VVOAZFWZEDHOOU-UHFFFAOYSA-N, 5,5'-Diallylbiphenyl-2,2'-diol, SMR000387108, 5,5'-di(prop-2-en-1-yl)biphenyl-2,2'-diol, Q-100598, (1,1'-Biphenyl)-2,2'-diol, 5,5'-di-2-propenyl-, [1,1'-Biphenyl]-2,2'-diol, 5,5'-di-2-propenyl-, SR-01000758206, Kopnolia, HSDB 7686, Magnolol,(S), PubChem19035, 3r5n, UPCMLD-DP037, AC1L2HT7, AC1Q7B1V, cid_72300, SCHEMBL132477, REGID_for_CID_72300, CHEMBL180920, ZINC1645, DTXSID0044076, UPCMLD-DP037:001, BDBM78304, CTK1G9448, MolPort-002-507-434, HMS2269N09, HMS3651O18, BCP28276, HY-N0163, KS-000009BG, AC-931, BBL027818, BN0720, CM0085, MFCD00016658, NSC293099, s2321, STK801955, AKOS005266409, ACN-035415, CCG-208588, CS-5021, DS-1284, MCULE-1351244567, NSC-293099, RTR-031540, SMP2_000086, Magnolol, >=95% (HPLC), from plant, NCGC00161609-01, NCGC00161609-02, 4CN-0760, AJ-08064, AK-72952, AN-15430, BC205200, BR-72952, CC-30123, CJ-00060, LS-44356, O906, SC-25620, SY016075, ZB000381, AB0016717, AX8016874, KB-279770, TR-031540, D3971, FT-0628104, N1359, ST24029219, 5,5;-Diallyl-[1,1;-biphenyl]-2,2;-diol, C10651, J10186, S-2836, 528M438, C-16714, 5,5'-Di-2-propenyl-[1,1'-biphenyl]-2,2'-diol, I01-2281, SR-01000758206-3, SR-01000758206-4, BRD-K26168087-001-01-4, Magnolol, European Pharmacopoeia (EP) Reference Standard, 2-(2-oxidanyl-5-prop-2-enyl-phenyl)-4-prop-2-enyl-phenol, 5,5'-bis(prop-2-en-1-yl)-[1,1'-biphenyl]-2,2'-diol, 2-[2-hydroxy-5-(prop-2-en-1-yl)phenyl]-4-(prop-2-en-1-yl)phenol


ID: 2400

chemical graph of compound 2400



InChIKey: VWMSLTGKBPRHSC-CRCLSJGQSA-N
SMILES: C1[C@@H]([C@@](CN1)(CO)O)O

biological descriptors:

CFTR relevance: CFTR corrector

Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown

reference list:

"C Boinot" "M Jollivet Souchet" "F Becq" "R Ferru-Clément"


CID is 46894967
synonyms found at PubChem are:
SCHEMBL17802624, AKOS006356084, 3alpha,4beta-Dihydroxypyrrolidine 3beta-methanol


ID: 2401

chemical graph of compound 2401



InChIKey: VWPOSFSPZNDTMJ-UCWKZMIHSA-N
SMILES: CC(C)(C)NCC(COC1=CC=CC2=C1C[C@@H]([C@@H](C2)O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 39147
synonyms found at PubChem are:
nadolol, 42200-33-9, Corgard, Solgol, SQ-11725, Anabet, Corgaretic, Nadic, Nadololum [INN-Latin], (2R,3S)-5-(3-(tert-Butylamino)-2-hydroxypropoxy)-1,2,3,4-tetrahydronaphthalene-2,3-diol, (2R,3S)-5-[3-(tert-butylamino)-2-hydroxypropoxy]-1,2,3,4-tetrahydronaphthalene-2,3-diol, Corgard (TN), Nadolol [USAN:BAN:INN:JAN], CHEMBL649, Nadololum, MLS000028580, VWPOSFSPZNDTMJ-UCWKZMIHSA-N, SQ 11725, SMR000058975, DSSTox_CID_3342, EN300-50860, DSSTox_RID_76983, DSSTox_GSID_23342, CCRIS 1048, HSDB 6532, EINECS 255-706-3, (2R,3S)-5-({3-[(1,1-dimethylethyl)amino]-2-hydroxypropyl}oxy)-1,2,3,4-tetrahydronaphthalene-2,3-diol, CPD000058975, 2,3-cis-1,2,3,4-Tetrahydro-5-((2-hydroxy-3-tert-butylamino)propoxy)-2,3-naphthalenediol, 2,3-Naphthalenediol, 5-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)-1,2,3,4-tetrahydro-, 5-(3-((1,1-Dimethylethyl)amino)-2-hydroxypropoxy)-1,2,3,4-tetrahydro-2,3-naphthalenediol, SR-01000000251, 2,3-Naphthalenediol, 5-[3-[(1,1-dimethylethyl)amino]-2-hydroxypropoxy]-1,2,3,4-tetrahydro-, NCGC00016851-01, Prestwick_108, Corzide (TN), Anabet (TN), CAS-42200-33-9, Solgol (TN), Apo-Nadol (TN), Alti-Nadolol (TN), Novo-Nadolol (TN), SQ11725, Spectrum_001643, Opera_ID_1099, Prestwick0_000818, Prestwick1_000818, Prestwick2_000818, Spectrum2_001546, Spectrum3_001586, Spectrum4_000193, Spectrum5_001255, D05SHK, AC1Q1MO3, AC1Q77IZ, SCHEMBL4177, Nadolol, analytical standard, BSPBio_003152, GTPL554, KBioGR_000765, KBioSS_002123, cid_39147, MLS001148087, MLS002548875, DivK1c_000427, Nadolol (JP17/USP/INN), SPECTRUM1503260, SPBio_001392, SPBio_002636, INV102, DTXSID3023342, Nadolol 1.0 mg/ml in Methanol, BDBM25766, CTK4I5836, HMS501F09, KBio1_000427, KBio2_002123, KBio2_004691, KBio2_007259, KBio3_002652, INV-102, MolPort-003-666-474, NINDS_000427, HMS1570D17, HMS1922O05, HMS2093A15, HMS2233E12, HMS3259C07, HMS3714D17, Pharmakon1600-01503260, AC1L2151, Tox21_110646, CCG-39324, MFCD00079476, NSC758430, AKOS015895037, Tox21_110646_1, API0003480, DB01203, NC00464, NSC-758430, RTR-032791, VA11340, IDI1_000427, SMP1_000203, NCGC00021623-03, NCGC00021623-05, NCGC00089811-02, LS-94578, SAM002264627, SAM002548970, SC-78480, SBI-0051806.P002, AX8143086, KB-206505, FT-0630624, VU0239635-6, D00432, AB00052338_13, 200N339, SR-01000000251-2, SR-01000000251-3, BRD-A87606379-001-03-4, BRD-A87606379-001-13-3, Nadolol, European Pharmacopoeia (EP) Reference Standard, Nadolol, United States Pharmacopeia (USP) Reference Standard, 1403-22-1


ID: 2402

chemical graph of compound 2402



InChIKey: VWTINHYPRWEBQY-UHFFFAOYSA-N
SMILES: CC[N+](CC)(CC1=CC=CC=C1)CC(=O)NC2=C(C=CC=C2C)C.C1=CC=C(C=C1)C(=O)[O-]

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 19518
synonyms found at PubChem are:
DENATONIUM BENZOATE, 3734-33-6, Bitrex, Lidocaine benzyl benzoate, Anispray, Aversion, Denatonium (benzoate), Gori, Caswell No. 083BB, THS-839, UNII-M5BA6GAF1O, Denatonium benzoate anhydrous, WIN 16568, BENZYLDIETHYL, Denatonii benzoas [INN-Latin], EINECS 223-095-2, Benzoate de denatonium [INN-French], Benzoato de denatonio [INN-Spanish], M5BA6GAF1O, Denatonium benzoate [USAN:INN:BAN], EPA Pesticide Chemical Code 009106, NSC 157658, Denatonium benzoate granules, Benzyldiethyl((2,6-xylylcarbamoyl)methyl)ammonium benzoate, Benzyldiethyl[(2,6-xylylcarbamoyl)methyl]ammonium benzoate, NCGC00017043-02, CAS-3734-33-6, N-Benzyl-2-((2,6-dimethylphenyl)amino)-N,N-diethyl-2-oxoethanaminium benzoate, Benzenemethanaminium, N-(2-((2,6-dimethylphenyl)amino)-2-oxoethyl)-N,N-diethyl-, benzoate, DSSTox_CID_14376, DSSTox_RID_79149, DSSTox_GSID_34376, W-106547, ((2,6-Xylylcarbamoyl)methyl)diethyl benzyl ammonium benzoate, C28H34N2O3, Ammonium, benzyldiethyl((2,6-xylylcarbamoyl)methyl)-, benzoate, Denatonii benzoas, N-(2-((2,6-Dimethylphenyl)amino)-2-oxoethyl)-N,N-diethylbenzeneme- thanaminium benzoate, Benzoato de denatonio, Benzoate de denatonium, 2-[diethylbenzylamino]-N-(2,6-dimethylphenyl)acetamide, benzoic acid, Benzenemethanaminium, N-(2-((2,6-dimethylphenyl)amino)-2-oxoethyl)-N,N-diethyl-, benzoate (1:1), Benzenemethanaminium, N-[2-[(2,6-dimethylphenyl)amino]-2-oxoethyl]-N,N-diethyl-, benzoate (1:1), Bitrex (TM), AC1L2EAG, AC1Q5LWT, SCHEMBL49511, MLS002154073, Denatonium benzoate, >=98%, CHEMBL1371493, Denatonium Benzoate 25% in EG, DTXSID8034376, THS 839, MolPort-003-929-793, VWTINHYPRWEBQY-UHFFFAOYSA-N, HMS1571A03, HMS2093L12, HMS2098A03, HMS2233O05, HMS3373C04, HMS3715A03, Pharmakon1600-01505987, EBD28935, HY-B1146, KS-000001ET, Tox21_110754, Tox21_301587, MFCD00031578, NSC157658, NSC759299, SBB057812, AKOS015888129, Tox21_110754_1, APN0000341, CCG-213592, CS-4750, MCULE-8272134756, NSC-157658, NSC-759299, Denatonium benzoate, analytical standard, NCGC00017043-01, NCGC00091886-04, NCGC00164432-01, NCGC00255373-01, AC-14888, AK161798, AN-20948, AS-15511, BC208282, CC-26334, LS-16789, P665, SC-13384, SMR001233385, KB-272057, Ammonium,6-xylylcarbamoyl)methyl]-, benzoate, D2124, FT-0622841, ST24048507, ST51007042, K-8241, A823606, C-22434, I01-0224, Benzyldiethyl(2,6-xylylcarbamoylmethyl)ammonium benzoate, BENZYLDIETHYL [(2,6-XYLYLCARBAMOYL)-AMMONIUM BENZO, Benzyldiethyl(2,6-xylyl-carbamoyl-methyl)-ammonium benzoate, Denatonium benzoate, certified reference material, TraceCERT(R), benzyl-[2-(2,6-dimethylanilino)-2-oxoethyl]-diethylazanium benzoate, benzyl-[2-(2,6-dimethylanilino)-2-oxoethyl]-diethylazanium;benzoate, Benzyldiethyl[(2,6-dimethylphenylcarbamoyl)methyl]ammonium Benzoate, benzyl({[(2,6-dimethylphenyl)carbamoyl]methyl})diethylazanium benzoate, benzyl-[(2,6-dimethylphenyl)carbamoylmethyl]-diethyl-azanium benzoate, Benzyl-[(2,6-dimethylphenylcarbamoyl)methyl]-diethylammonium benzoate, benzyl-[2-(2,6-dimethylanilino)-2-oxo-ethyl]-diethyl-ammonium benzoate, Denatonium benzoate, United States Pharmacopeia (USP) Reference Standard, N,N-Diethyl-N-[(2,6-dimethylphenylcarbamoyl)methyl]benzylammonium benzoate, [2-(2,6-dimethylanilino)-2-oxoethyl]-diethyl-(phenylmethyl)ammonium benzoate, Benzenemethanaminium,6-dimethylphenyl)amino]-2-oxoethyl]-N,N-diethyl-, benzoate, Benzenemethanaminium,N-[2-[(2,6-dimethylphenyl)amino]-2-oxoethyl]-N,N-diethyl-, benzoate, N,N-Diethyl-N-[(2,6-dimethylphenyl-carbamoyl)-methyl]-benzyl-ammonium benzoate, N-[2-[(2,6-Dimethylphenyl)amino]-2-oxoethyl]-N,N-diethyl-benzenemethanaminium benzoate, N-benzyl-2-(2,6-dimethylphenylamino)-N,N-diethyl-2-oxoethanaminium benzoate, [2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-diethyl-(phenylmethyl)azanium benzoate, N,N- paragraph signthornOO>>u-N-[(2,6- paragraph signthorn(1/4)x+/-(1/2)>>u degrees +/->>u(1/4)xo pound>>u)(1/4)x>>u]-UEth>>u-+/-(1/2)(1/4)xEai section sign, N-[2-[(2,6-Dimethylphenyl)amino]-2-oxoethyl]-N,N-diethyl-benzenemethanaminium benzoate; N,N-Diethyl-N-[(2,6-dimethylphenylcarbamoyl)methyl]benzylammonium benzoate; Benzyldiethyl(2,6-xylylcarbamoylmethyl)ammonium benzoate, UEth>>u paragraph signthornOO>>u[(2,6- paragraph signthorn(1/4)x+/-(1/2)>>u degrees +/->>u(1/4)xo pound>>u)(1/4)x>>u]i section sign+/-(1/2)(1/4)xEaNI, BENZYLDIETHYL [(2,6-XYLYLCARBAMOYL)-AMMONIUM BENZOATE


ID: 2403

chemical graph of compound 2403



InChIKey: VWTYVHKMUKFWST-UHFFFAOYSA-N
SMILES: CC1=NN(C(=O)C1)C(=S)N

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"MH Nantz" "LJ Galietta" "K By" "EJ Niedzinski" "M Eda" "MF Springsteel" "MJ Haddadin" "MJ Kurth" "AS Verkman"


CID is 698523
synonyms found at PubChem are:
3-methyl-5-oxo-4,5-dihydro-1H-pyrazole-1-carbothioamide, 4,5-dihydro-3-methyl-5-oxopyrazole-1-carbothioamide, 27130-71-8, AC1LF6R8, TimTec1_002882, ARONIS021521, KS-00004CZG, MolPort-001-516-264, HMS1542C22, STK024341, AKOS000488187, ZINC100007276, FCH1196902, ST040649, BB0275820, 3-methyl-5-oxo-4H-pyrazole-1-carbothioamide, 1-(aminothioxomethyl)-3-methyl-2-pyrazolin-5-one, SR-01000493659, SR-01000493659-1, A1037/0048578


ID: 2404

chemical graph of compound 2404



InChIKey: VXEAYBOGHINOKW-UHFFFAOYSA-N
SMILES: CN(C)CCC=C1C2=CC=CC=C2C=CC3=CC=CC=C31.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 22576
synonyms found at PubChem are:
Cyclobenzaprine hydrochloride, 6202-23-9, Cyclobenzaprine HCL, Flexeril, Flexiban, Amrix, Cycloflex, Tensodox, Cloben, Cyben, Novo-Cycloprine, MK 130 hydrochloride, Proheptatriene hydrochloride, Proheptatriene monohydrochloride, TNX-102, 3-(5H-dibenzo[a,d][7]annulen-5-ylidene)-N,N-dimethylpropan-1-amine hydrochloride, UNII-0VE05JYS2P, Proheptatrien monohydrochloride, Cyclobenzaprine (hydrochloride), EINECS 228-264-4, NSC 78206, NSC 169900, NSC 173379, 10,11delta-Amitriptyline hydrochloride, 0VE05JYS2P, CHEBI:3997, 5-(3-Dimethylaminopropylidene)dibenzo[a,e]cycloheptatriene hydrochloride, Flexeril (TN), 5-(3-Dimethylaminopropylidene)-5H-dibenzo-(a,d)cycloheptene hydrochloride, 1-Propanamine, 3-(5H-dibenzo(a,d)cyclohepten-5-ylidene)-N,N-dimethyl-, hydrochloride, DSSTox_CID_25105, DSSTox_RID_80672, N,N-Dimethyl-5H-dibenzo(a,d)cycloheptene-delta(sup 5,gamma)-propylamine hydrochloride, DSSTox_GSID_45105, W-105056, Tabradol, Miosan, Multi-Relax, 3-(5H-Dibenzo(a,d)cyclohepten-5-ylidene)propyl(dimethyl)ammonium chloride, 5H-Dibenzo(a,d)cycloheptene-delta(sup 5)-gamma-propylamine, N,N-dimethyl-, hydrochloride, 10,11.delta.-Amitriptyline hydrochloride, WLN: L C676 BHJ B3N1&1 &GH, NSC78206, 5H-Dibenzo[a, N,N-dimethyl-, hydrochloride, MK-130, NSC-78206, NSC169900, NSC173379, SR-01000075761, CAS-6202-23-9, 5H-Dibenzo[a,.gamma.-propylamine, N,N-dimethyl-, hydrochloride, N,d]cycloheptene-.delta.,5.gamma.-propylamine, hydrochloride, Tonmya, 1-Propanamine,d]cyclohepten-5-ylidene)-N,N-dimethyl-, hydrochloride, N,d]cycloheptene-.delta.(sup5,.gamma.)-propylamine hydrochloride, 5-[3-(Dimethylamino)propylidene]-5H-dibenzo-[a,d]cycloheptene hydrochloride, 3-(dibenzo[2,1-b:1',2'-e][7]annulen-11-ylidene)-N,N-dimethylpropan-1-amine;hydrochloride, Prestwick_790, Cyclobenzaprine hydrochloride [USAN], PubChem15660, PubChem18912, Cyclobenzaprine hydrochloride [USAN:USP], Nortriptyline Impurity E, D0NN8N, AC1L2KN5, C20H21N.HCl, SCHEMBL41376, Cyclobenzaprine very low dose, MLS002153815, SPECTRUM1503207, TNX-102 SL, 303-53-7 (Parent), CHEMBL1200636, DTXSID2045105, CTK8F8847, TNX-105, MolPort-003-666-812, VXEAYBOGHINOKW-UHFFFAOYSA-N, HMS1569I12, HMS1922I11, MK-130 [AS THE BASE], Pharmakon1600-01503207, ACT06294, BCP21781, Cyclobenzaprine hydrochloride (USP), EUR-1002, HY-B0740, Tox21_110040, Tox21_500303, CCG-39312, MFCD00079039, NSC758414, s4283, AKOS015906329, Tox21_110040_1, AC-1916, BCP9000565, CS-2981, LP00303, NSC-169900, NSC-173379, NSC-758414, NCGC00013841-01, NCGC00013841-09, NCGC00093752-01, NCGC00093752-02, NCGC00093752-03, NCGC00093752-04, NCGC00093752-05, NCGC00095017-01, NCGC00095017-02, NCGC00095017-03, NCGC00095017-04, NCGC00260988-01, AN-14454, AS-15745, CC-26027, KB-76226, LS-60768, Q517, SC-18388, SMR000326702, EU-0100303, FT-0603166, ST24041508, C 4542, D00772, M-1230, 202C239, C-19294, SR-01000075761-1, SR-01000075761-6, Cyclobenzaprine Hydrochloride 1.0 mg/ml in Methanol (as free base), 3-(5H-Dibenzo[a,d]cyclohepten-5-ylidene)-N,N-dimethyl-1-propanamine Hydrochloride, 3-(5H-dibenzo[a,d]cyclohepten-5-ylidene)-N,N-dimethylpropan-1-amine hydrochloride, 5H-Dibenzo(a,d)cycloheptene-delta5,gamma-propylamine, N,N-dimethyl-, hydrochloride, 5H-Dibenzo(a,d)cycloheptene-delta5,gamma-propylamine, N,N-dimethyl-, hydrochloride (8CI), Cyclobenzaprine hydrochloride, European Pharmacopoeia (EP) Reference Standard, N,N-dimethyl-5H-dibenzo(a,d)cycloheptene-Delta(5,gamma)-propylamine hydrochloride, AKOS026750130, N, N-Dimethyl-5 H-dibenzo[ a, d]cycloheptene-D 5,g-propylamine HCl


ID: 2405

chemical graph of compound 2405



InChIKey: VXFJYXUZANRPDJ-WTNASJBWSA-N
SMILES: CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@@H](C)C(=O)N2[C@H]3CCCC[C@@H]3C[C@H]2C(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5484727
synonyms found at PubChem are:
trandolapril, 87679-37-6, Mavik, Gopten, Odrik, Trandolaprilum [Latin], Trandolaprilum, Udrik, RU-44570, Preran, Odric, RU44570, RU 44570, Trandolapril [INN:BAN], UNII-1T0N3G9CRC, Indolapril, CCRIS 6594, Mavik (TN), Trandolapril (JAN/INN), 1T0N3G9CRC, C24H34N2O5, (2S,3aR,7aS)-1-[(2S)-2-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic acid, NCGC00182079-02, DSSTox_CID_3692, DSSTox_RID_77151, DSSTox_GSID_23692, (2S,3aR,7aS)-1-((S)-N-((S)-1-Carboxy-3-phenylpropyl)alanyl)hexahydro-2-indolinecarboxylic acid, 1-ethyl ester, 1-(2-((1-(ethoxycarbonyl)-3-phenylpropyl)amino)-1-oxopropyl)octahydro-1H-indol-2-carboxylic acid, (2S,3aR,7aS)-1-(N-((1S)-1-((Ethyloxy)carbonyl)-3-phenylpropyl)-L-alanyl)octahydro-1H-indole-2-carboxylic Acid, 1H-Indole-2-carboxylic acid, 1-((2S)-2-((1-(ethoxycarbonyl)-3-phenylpropyl)amino)-1-oxopropyl)octahydro-, (2S,3aR,7aS)-, 1H-Indole-2-carboxylic acid, octahydro-1-(2-((1-(ethoxycarbonyl)-3-phenylpropyl)amino)-1-oxopropyl)-, (2S-(1(R*(R*)),2-alpha,3a-alpha,7a-beta))-, CAS-87679-37-6, Trandolapril [USP:INN:BAN], NCGC00095153-01, AC1NUNSR, CI-907, D0M5OC, CHEMBL1519, SCHEMBL16610, BIDD:GT0804, CHEBI:9649, GTPL6453, DTXSID2023692, CTK8E8021, MolPort-006-167-568, VXFJYXUZANRPDJ-WTNASJBWSA-N, HMS3262J10, HY-B0592, ZINC1853205, Tox21_111453, Tox21_113152, Tox21_500924, BDBM50369775, BG0519, MFCD00865776, AKOS015843316, AKOS015896050, API0004465, CCG-222228, CS-2809, DB00519, KS-1467, LP00924, NCGC00182079-03, NCGC00261609-01, KB-81195, LS-82763, SC-17973, AX8035229, TC-070968, FT-0082544, ST24050183, Trandolapril, >=98% (HPLC), white powder, D00383, 679T376, A842336, SR-02000000917, I06-1849, SR-02000000917-2, BRD-K28550399-001-01-4, Trandolapril, European Pharmacopoeia (EP) Reference Standard, Trandolapril, United States Pharmacopeia (USP) Reference Standard, (2S,3aR,7aS)-1-(((S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl)-L-alanyl)octahydro-1H-indole-2-carboxylic acid, (2s,3ar,7as)-1-[(2s)-2-[[(1S)-1-(ethoxycarbonyl)-3-phenylpropyl]amino]-1-oxopropyl]octahydro-1h-indole-2-carboxylic acid, (2S,3aR,7aS)-1-[(2S)-2-[[(2S)-1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl]amino]propanoyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic acid, (2S,3aR,7aS)-1-[(2S)-2-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]-1-oxopropyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic acid, (2S,3aR,7aS)-1-[(2S)-2-[[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]propanoyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylicacid, (2S,3aR,7aS)-1-[(2S)-2-{[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino}propanoyl]-octahydro-1H-indole-2-carboxylic acid


ID: 2406

chemical graph of compound 2406



InChIKey: VXMYWVMXSWJFCV-UHFFFAOYSA-N
SMILES: C1CC(=O)NN=C1C2=CC=C(C=C2)N3C=CN=C3

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 55918
synonyms found at PubChem are:
IMAZODAN, 84243-58-3, Imazodan [INN], Imazodanum [Latin], 6-(4-(1H-imidazol-1-yl)phenyl)-4,5-dihydropyridazin-3(2H)-one, UNII-6PVQ5VQW24, Cl 914, 6PVQ5VQW24, CHEMBL12831, NCGC00015547-02, 4,5-Dihydro-6-[4-(1H-imidazol-1-yl)phenyl]-3(2H)-pyridazinone, C13H12N4O, Imazodanum, 3-(4-imidazol-1-ylphenyl)-4,5-dihydro-1H-pyridazin-6-one, 3(2H)-Pyridazinone, 4,5-dihydro-6-(4-(1H-imidazol-1-yl)phenyl)-, 3(2H)-Pyridazinone, 4,5-dihydro-6-[4-(1H-imidazol-1-yl)phenyl]-, 4,5-dihydro-6-(4-(1H-imidazol-1-yl)phenyl)-3(2H)-pyridazinone, CI 914, Lopac-I-0782, D09UMA, AC1L1K2C, DSSTox_CID_25160, DSSTox_RID_80710, DSSTox_GSID_45160, Lopac0_000639, MLS000862182, SCHEMBL148436, ZINC1553, Imazodan, >=99% (HPLC), DTXSID1045160, CTK8G0276, MolPort-003-941-762, 89198-09-4 (hydrochloride), HMS2233L24, HMS3261P20, HMS3369I22, KS-000001DA, Tox21_110171, Tox21_500639, BDBM50000315, MFCD00867109, AKOS027327583, CCG-204726, LP00639, QC-1573, NCGC00015547-01, NCGC00015547-03, NCGC00015547-04, NCGC00094006-01, NCGC00094006-02, NCGC00261324-01, CC-29477, DS-11856, K504, SMR000326945, ZB000359, CAS-84243-58-3, LS-177806, EU-0100639, FT-0630925, I 0782, 4,5-dihydro-6-[4-(1H-imidazol-1-yl)phenyl]-, C-14396, SR-01000075931, SR-01000075931-1, 6-(4-Imidazol-1-yl-phenyl)-4,5-dihydro-2H-pyridazin-3-one, (CI-914)6-(4-Imidazol-1-yl-phenyl)-4,5-dihydro-2H-pyridazin-3-one, 6-(4-Imidazol-1-yl-phenyl)-4,5-dihydro-2H-pyridazin-3-one(CI-914), 6-(4-Imidazol-1-yl-phenyl)-4,5-dihydro-2H-pyridazin-3-one(Imazodan)


ID: 2407

chemical graph of compound 2407



InChIKey: VXOBVHAUXZVHTL-UHFFFAOYSA-N
SMILES: CC(=O)OC1=CC(=C2C(=C1)OC=C(C2=O)C3=CC=C(C=C3)OC)OC(=O)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 1403142
synonyms found at PubChem are:
54443-59-3, BIOCHANIN A DIACETATE, 3-(4-methoxyphenyl)-4-oxo-4H-chromene-5,7-diyl diacetate, ST077133, KBio2_006941, AC1LQLRV, Spectrum_001325, SpecPlus_000599, Spectrum2_000050, Spectrum3_001881, BSPBio_003382, KBioSS_001805, SPECTRUM300601, DivK1c_006695, SPBio_000179, CHEMBL1437166, CHEBI:92488, CTK1F8870, KBio1_001639, KBio2_001805, KBio2_004373, KBio3_002885, DTXSID70362788, MolPort-000-424-922, VXOBVHAUXZVHTL-UHFFFAOYSA-N, ZINC1279974, CCG-39880, STK888445, AKOS002164302, MCULE-3430002549, SDCCGMLS-0066942.P001, NCGC00095605-01, NCGC00095605-02, NCGC00178104-01, VU0243845-2, BRD-K28075147-001-02-5, Z57280938, F3139-0414, 7-acetyloxy-3-(4-methoxyphenyl)-4-oxochromen-5-yl acetate, [5-acetyloxy-3-(4-methoxyphenyl)-4-oxochromen-7-yl] acetate, 4H-1-Benzopyran-4-one, 5,7-bis(acetyloxy)-3-(4-methoxyphenyl)-, 5-(acetyloxy)-3-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl acetate


ID: 2408

chemical graph of compound 2408



InChIKey: VXPCQISYVPFYRK-UHFFFAOYSA-N
SMILES: CCN(CC)C(C)CN1C2=CC=CC=C2SC3=CC=CC=C31.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 122824
synonyms found at PubChem are:
Ethopropazine hydrochloride, Profenamine hydrochloride, 1094-08-2, Profenamine HCl, Ethopropazine HCl, Pardisol, Parfezin, Parphezein, Dibutil, Profenamine monohydrochloride, Lysivane, Parphezin, Isothazine hydrochloride, Parsidol (VAN), Lysivane hydrochloride, Dibutil hydrochloride, Parsidol hydrochloride, Parsidol monohydrochloride, 10-(2-(Diethylamino)propyl)phenothiazine monohydrochloride, EINECS 214-134-4, NSC 64074, NSC 169467, N,N-Diethyl-alpha-methyl-10H-phenothiazine-10-ethylamine monohydrochloride, ethopropazine monohydrochloride, CHEMBL1200970, CHEBI:31568, l-10-(2-Diethylaminopropyl)phenothiazine hydrochloride, 10-Phenothiazineethylamine, N,N-diethyl-alpha-methyl-, hydrochloride, N,N-diethyl-1-(10H-phenothiazin-10-yl)propan-2-amine hydrochloride, Profenamine hibenzate, DSSTox_CID_25347, DSSTox_RID_80815, DSSTox_GSID_45347, 10-[2-(Diethylamino)propyl]phenothiazine hydrochloride, 10-(2-(Diethylamino)propyl)-phenothiazin Hydrochloride, Phenothiazine, 10-(2-(diethylamino)propyl)-, monohydrochloride, N,N-diethyl-alpha-methyl-10H-phenothiazine-10-ethylamine hydrochloride, 10H-Phenothiazine-10-ethanamine, N,N-diethyl-alpha-methyl-, monohydrochloride, diethyl(1-methyl-2-phenothiazin-10-ylethyl)amine, chloride, SR-05000001626, Prophenamine HCl, 10H-Phenothiazine-10-ethanamine,N-diethyl-.alpha.-methyl-, monohydrochloride, Ethopropazine hydrochloride [USP], Parsidol (TN), Prestwick_195, EINECS 256-019-1, AC1L3VBR, AC1Q3FBW, NCGC00016562-01, CAS-1094-08-2, C19H24N2S.HCl, SCHEMBL123703, SPECTRUM1500293, DTXSID4045347, Profenamine hydrochloride (JAN), VXPCQISYVPFYRK-UHFFFAOYSA-N, HMS1570H21, HMS1920O04, Pharmakon1600-01500293, BCP12225, NSC64074, Tox21_110496, Tox21_500873, CCG-40202, MFCD00012653, NSC-64074, NSC169467, NSC757029, SBB057672, AKOS015901042, Tox21_110496_1, API0008593, LP00873, MCULE-2860573503, NSC-169467, NSC-757029, NCGC00094678-01, NCGC00094678-02, NCGC00178860-06, NCGC00261558-01, 42957-54-0, LS-105454, FT-0625740, ST51006789, D01118, Ethopropazine hydrochloride, >=98% (HPLC), powder, SR-05000001626-2, I14-15990, N,N-diethyl-1-phenothiazin-10-ylpropan-2-amine hydrochloride, N,N-diethyl-1-phenothiazin-10-ylpropan-2-amine;hydrochloride, 10H-Phenothiazine-10-ethanamine,N,N-diethyl-a-methyl-,hydrochloride(1:1)


ID: 2409

chemical graph of compound 2409



InChIKey: VYFLPFGUVGMBEP-UHFFFAOYSA-N
SMILES: COC1=C(C(=C(C=C1)CN2CCNCC2)OC)OC.Cl.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 83201
synonyms found at PubChem are:
Trimetazidine dihydrochloride, 13171-25-0, 1-(2,3,4-Trimethoxybenzyl)piperazine dihydrochloride, Kyurinett, Trimetazidine hydrochloride, Trimetajust, Lubomail, Vastarel, Yosimilon, 1-[(2,3,4-trimethoxyphenyl)methyl]piperazine dihydrochloride, Trimetazidine 2HCl, Trimetazidine DiHCl, Trimetazidine (dihydrochloride), UNII-48V6723Z1P, EINECS 236-117-0, S 4004, 48V6723Z1P, Piperazine, 1-[(2,3,4-trimethoxyphenyl)methyl]-, dihydrochloride, DSSTox_CID_25407, DSSTox_RID_80858, DSSTox_GSID_45407, W-108326, Piperazine, 1-(2,3,4-trimethoxybenzyl)-, dihydrochloride, Adexor, Piperazine, 1-((2,3,4-trimethoxyphenyl)methyl)-, dihydrochloride, SR-01000781912, NCGC00016697-01, CAS-13171-25-0, Yoshimilon, 1-[(2,3,4-trimethoxyphenyl)methyl]piperazine;dihydrochloride, Vastarel F, Trimetazidine hydrochloride [JAN], Kyurinett (TN), 1-(2,3,4-trimethoxybenzyl)piperazindihydrochlorid, Prestwick_871, ACMC-209bnm, AC1Q3AXB, Trimetazine dihydrochloride, AC1L34XH, TRIMETAZIDINE DI, HCL, SCHEMBL580378, CHEMBL3561076, DTXSID1045407, CHEBI:32262, CTK4B7458, BBC/800, MolPort-003-938-319, VYFLPFGUVGMBEP-UHFFFAOYSA-N, HMS1569N19, BCP21402, HY-B0968, KS-000004PG, Trimetazidine hydrochloride (JP17), ZX-AS005000, Tox21_110568, ANW-19376, s4543, AKOS015895369, Tox21_110568_1, AB05480, AC-5896, ACN-048531, API0004512, CCG-213960, CS-4453, KS-1125, MCULE-8416517930, NCGC00016697-04, AK-57671, AN-10546, KB-62084, N738, SC-17319, AX8155407, LS-113497, ST2403058, TC-108121, TL8000751, FT-0630397, D01606, Y-9855, 2,3,4-trimethoxybenzylpiperazine dihydrochloride, 171T250, C-20292, I06-0609, SR-01000781912-3, SR-01000781912-4, 1-[(2,3,4-Trimethoxyphenyl)methyl]piperazine diHCl, F2173-1142, 1-(2,3,4-TRIMETHOXYBENZYL)PIPERAZINE DIHYDROCHLORI, 1-(2,3,4-Trimethoxybenzyl)piperazine dihydrochloride, 97%, Trimetazidine Dihydrochloride 1.0 mg/ml in Methanol (as free base), Piperazine, 1-((2,3,4-trimethoxyphenyl)methyl)-, dihydrochloride (9CI), Piperazine, 1-[(2,3,4-trimethoxyphenyl)methyl]-, hydrochloride (1:2), Trimetazidine for system suitability, European Pharmacopoeia (EP) Reference Standard, AKOS026749994


ID: 2410

chemical graph of compound 2410



InChIKey: VYGQUTWHTHXGQB-FFHKNEKCSA-N
SMILES: CCCCCCCCCCCCCCCC(=O)OC/C=C(\C)/C=C/C=C(\C)/C=C/C1=C(CCCC1(C)C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5280531
synonyms found at PubChem are:
retinyl palmitate, VITAMIN A PALMITATE, Retinol palmitate, 79-81-2, all-trans-Retinyl palmitate, Arovit, Retinol, hexadecanoate, Optovit-A, Retinyl hexadecanoate, Aquapalm, Dispatabs Tabs, Vitazyme A, Optovit A, Axerophthol palmitate, Vitamin A Solubilized, trans-Retinol palmitate, trans-Retinyl palmitate, Lutavit A 500 Plus, UNII-1D1K0N0VVC, all-trans-Retinol palmitate, Arovit (Roche), all-trans-Vitamin A palmitate, Aquasol A (TN), CCRIS 3280, Retinol, palmitate, all-trans-, C36H60O2, EINECS 201-228-5, O~15~-hexadecanoylretinol, BRN 1917366, 1D1K0N0VVC, Ester found in fish liver oils, Retinol palmitate (6CI,7CI), [(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenyl] hexadecanoate, Retinol, all-trans-, palmitate, CHEBI:17616, Palmitic acid, ester with retinol, VYGQUTWHTHXGQB-FFHKNEKCSA-N, Retinol, palmitate, all-trans- (8CI), NCGC00095056-03, DSSTox_CID_1241, DSSTox_RID_76033, DSSTox_GSID_21241, (2E,4E,6E,8E)-Hexadecanoic acid 3,7-dimethyl-9-(2,6,6-trimethyl-cyclohex-1-enyl)-nona-2, 4,6,8,tetraenyl ester, CAS-79-81-2, (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraen-1-yl hexadecanoate, SMR000112463, o15-palmitoylretinol, retinol-palmitate, (2E,4E,6E,8E)-3,7-Dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraen-1-yl palmitate, Palmitic acid retinol, Retinyl palmitic acid, Vitamin- A palmitate, O~15~-palmitoylretinol, Retinyl hexadecanoic acid, Retinol palmitate [JAN], Spectrum5_001201, bmse000501, EC 201-228-5, AC1NQX64, AC1Q2W2H, AC1Q65TE, Retinol palmitate (JP17), CHEMBL1675, SCHEMBL41649, MLS001332437, MLS001332438, SPECTRUM1503604, all-trans-retinyl hexadecanoate, DTXSID1021241, HMS500M11, MolPort-003-666-488, ALL TRANS-RETINOL PALMITATE, HMS1922E10, HMS2093G13, HMS2268C06, Pharmakon1600-01503604, ZINC8214494, Tox21_113452, Tox21_303008, CCG-39342, LMPR01090013, NSC758478, s4126, retinol, O~15~-(1-oxohexadecyl)-, AKOS015918435, LS-2307, NSC-758478, IDI1_000249, NCGC00095056-01, NCGC00095056-02, NCGC00256427-01, 37340-08-2, AC-20001, AN-24005, BC215972, S302, SC-15989, SBI-0051830.P002, 2840-EP2305825A1, C02588, D00164, AB00052360_04, A839762, SR-05000001910, I14-7612, SR-05000001910-1, Retinyl palmitate, potency: >=1,700,000 USP units per g, UNII-81G40H8B0T component VYGQUTWHTHXGQB-FFHKNEKCSA-N, Retinyl palmitate, Type IV, ~1,800,000 USP units/g, oil, Retinyl palmitate, United States Pharmacopeia (USP) Reference Standard, 3,7-Dimethyl-9-(2,6,6,-trimethyl-1-cyclohexen-1-yl)-2,4,6,8-nonatetraen-1-ol palmitate, (2E,4E,6E,8E)-3,7-Dimethyl-9-(2,6,6-trimethyl-cyclohex-en-1-yl)-2,4,6,8-nonateetraen-1-yl-palmitate, (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-enyl)nona-2,4,6,8-tetraenyl palmitate, [(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)nona-2,4,6,8-tetraenyl] hexadecanoate, 108066-99-5, 110067-62-4, 3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraen-1-yl hexadecanoate, 674786-07-3, 7488-89-3, hexadecanoic acid [(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)nona-2,4,6,8-tetraenyl] ester, Retinyl Palmitate (Vitamin A Palmitate), Pharmaceutical Secondary Standard; Certified Reference Material, Retinyl palmitate solution, 100 mug/mL (Ethanol with 0.1% (w/v) BHT), ampule of 1 mL, certified reference material


ID: 2411

chemical graph of compound 2411



InChIKey: VYGQXRZAHIZHQV-UHFFFAOYSA-N
SMILES: C1CN(CCC1(C2=CC(=CC=C2)C(F)(F)F)O)CCCC(=O)C3=CC=C(C=C3)F.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 16361
synonyms found at PubChem are:
Trisedil hydrochloride, Trisedyl hydrochloride, Triperidol hydrochloride, Flumoperone hydrochloride, Psycoperidol hydrochloride, Trifluperidol chlorhydrate, EINECS 218-170-1, NSC 169875, Triperidol (TN), UNII-UIC8RB6P81, R 2498, UIC8RB6P81, 4'-Fluoro-4-(4-hydroxy-4-trifluoromethylphenylpiperidino)butyrophenone hydrochloride, Butyrophenone, 4'-fluoro-4-(4-hydroxy-4-(alpha,alpha,alpha-trifluoro-m-tolyl)piperidino)-, hydrochloride, AC1L27SO, C22H23F4NO2.HCl, LS-48381, D08637, 1-(4-fluorophenyl)-4-[4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidin-1-ium-1-yl]butan-1-one chloride, 1-Butanone, 1-(4-fluorophenyl)-4-(4-hydroxy-4-(3-(trifluoromethyl)phenyl)-1-piperidinyl)-, hydrochloride, 1-Butanone, 1-(4-fluorophenyl)-4-(4-hydroxy-4-(3-(trifluoromethyl)phenyl)-1-piperidinyl)-, hydrochloride (9CI), Butyrophenone, 4'-fluoro-4-(4-hydroxy-4-(alpha,alpha,alpha-trifluoro-m-tolyl)piperidino)-, hydrochloride (VAN), Butyrophenone, 4'-fluoro-4-(4-hydroxy-4-(alpha,alpha,alpha-trifluoro-m-tolyl)piperidino)-, hydrochloride (VAN) (8CI), Butyrophenone, 4'-fluoro-4-(4-hydroxy-4-(alpha,alpha,alpha-trifluoro-m-tolyl)piperidino)-,hydrochloride, Trifluperidol hydrochloride, Trifluperidol HCl, 2062-77-3, NCGC00094484-01, DSSTox_CID_25810, DSSTox_RID_81147, DSSTox_GSID_45810, 4'-Fluoro-4-[4-hydroxy-4-(alpha,alpha,alpha-trifluoro-m tolyl)piperidino]butyrophenone hydrochloride, CAS-2062-77-3, 1-Butanone, monohydrochloride, MLS002153425, SCHEMBL316725, CHEMBL1257039, DTXSID2045810, CTK8G3604, Tox21_111284, Tox21_501243, NSC169875, AKOS030627166, Tox21_111284_1, API0008439, CCG-222547, LP01243, NSC-169875, NCGC00015983-04, NCGC00261928-01, SMR001230800, EU-0101243, FT-0696998, T-103, R 2498 hydrochloride; Triperidol hydrochloride, SR-01000075410, J-013476, SR-01000075410-1, Trifluperidol hydrochloride(r 2498)neu roleptic dopamine, Butyrophenone,.alpha.,.alpha.-trifluoro-m-tolyl)piperidino]-, hydrochloride, Butyrophenone,.alpha.,.alpha.-trifluoro-m-tolyl)piperidino]-,hydrochloride, 4 inverted exclamation marka-Fluoro-4-[4-hydroxy-4-(|A,|A,|A-trifluoro-m tolyl)piperidino]butyrophenone hydrochloride


ID: 2412

chemical graph of compound 2412



InChIKey: VYHHSBHXZVSILO-UHFFFAOYSA-N
SMILES: CC(=O)OC1=CC(=C2C(=C1)OC(=CC2=O)C3=CC=C(C=C3)OC)OC(=O)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 4303567
synonyms found at PubChem are:
ACACETIN DIACETATE, KBio1_001498, Spectrum_000643, SpecPlus_000458, Spectrum2_000192, Spectrum3_000194, Spectrum4_001511, Spectrum5_000301, AC1N7JP8, BSPBio_001747, KBioGR_002201, KBioSS_001123, SPECTRUM200833, DivK1c_006554, SPBio_000143, CHEMBL1566650, SCHEMBL10026579, KBio2_001123, KBio2_003691, KBio2_006259, KBio3_001247, CCG-38398, SDCCGMLS-0066375.P001, NCGC00095492-01, NCGC00095492-02, NCGC00179038-01, SR-05000002622, SR-05000002622-1, [5-acetyloxy-2-(4-methoxyphenyl)-4-oxochromen-7-yl] acetate, 5892-39-7


ID: 2413

chemical graph of compound 2413



InChIKey: VYIBOCHDJVESIU-UHFFFAOYSA-N
SMILES: CCOC1=CC=C(C=C1)C(=O)C2=C(C(=C(C=C2)O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6708739
synonyms found at PubChem are:
2,3,4-TRIHYDROXY-4'-ETHOXYBENZOPHENONE, KBio1_001717, Spectrum_000569, SpecPlus_000677, Spectrum2_000424, Spectrum3_000179, Spectrum4_001497, Spectrum5_000233, AC1O8FM8, BSPBio_001677, KBioGR_002133, KBioSS_001049, SPECTRUM200424, DivK1c_006773, SCHEMBL724437, SPBio_000408, CHEMBL1322879, KBio2_001049, KBio2_003617, KBio2_006185, KBio3_001177, CCG-38684, SDCCGMLS-0066401.P001, NCGC00095812-01, NCGC00095812-02, SR-05000002522, (4-ethoxyphenyl)-(2,3,4-trihydroxyphenyl)methanone, SR-05000002522-1, BRD-K15464532-001-02-9


ID: 2414

chemical graph of compound 2414



InChIKey: VYIRVAXUEZSDNC-RDJLEWNRSA-N
SMILES: CC1=C(C(C[C@@H](C1)O)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C(=O)[C@@]2(C[C@H](CC2(C)C)O)C)/C)/C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5281228
synonyms found at PubChem are:
Capsanthin, 465-42-9, Paprika extract, Capsanthin/capsorubin, UNII-420NY1J57N, EINECS 207-364-1, CHEBI:3375, (3R,3'S,5'R)-3,3'-Dihydroxy-beta,kappa-caroten-6'-one, 420NY1J57N, 3,3'-Dihydroxy-beta,kappa-caroten-6'one, beta,kappa-Caroten-6'one, 3,3'dihydroxy-, all trans Capsanthin, HSDB 7977, all-trans-capsanthin, UPCMLD-DP025, AC1NQY83, SCHEMBL117691, SPECTRUM1505276, CHEMBL1519371, UPCMLD-DP025:001, Capsanthin, >=90.0% (HPLC), ZINC8221201, LMPR01070265, CCG-214238, SDCCGMLS-0066894.P001, NCGC00161603-01, LS-48670, C08584, A827066, SR-05000002758, SR-05000002758-1, I14-56396, beta,kappa-caroten-6'-one, 3,3'-dihydroxy-, (3R,3'S,5'R)-, (2E,4E,6E,8E,10E,12E,14E,16E,18E)-19-((R)-4-Hydroxy-2,6,6-trimethyl-cyclohex-1-enyl)-1-((1R,4S)-4-hydroxy-1,2,2-trimethyl-cyclopentyl)-4,8,13,17-tetramethyl-nonadeca-2,4,6,8,10,12,14,16,18-nonaen-1-one, (2E,4E,6E,8E,10E,12E,14E,16E,18E)-19-[(4R)-4-hydroxy-2,6,6-trimethyl-1-cyclohexenyl]-1-[(1R,4S)-4-hydroxy-1,2,2-trimethylcyclopentyl]-4,8,13,17-tetramethyl-1-nonadeca-2,4,6,8,10,12,14,16,18-nonaenone, (2E,4E,6E,8E,10E,12E,14E,16E,18E)-19-[(4R)-4-hydroxy-2,6,6-trimethylcyclohexen-1-yl]-1-[(1R,4S)-4-hydroxy-1,2,2-trimethylcyclopentyl]-4,8,13,17-tetramethylnonadeca-2,4,6,8,10,12,14,16,18-nonaen-1-one, (2E,4E,6E,8E,10E,12E,14E,16E,18E)-4,8,13,17-tetramethyl-19-[(4R)-2,6,6-trimethyl-4-oxidanyl-cyclohexen-1-yl]-1-[(1R,4S)-1,2,2-trimethyl-4-oxidanyl-cyclopentyl]nonadeca-2,4,6,8,10,12,14,16,18-nonaen-1-one, 113359-44-7, 1363-22-0, 47842-77-3, 5957-29-9


ID: 2415

chemical graph of compound 2415



InChIKey: VYMDGNCVAMGZFE-UHFFFAOYSA-N
SMILES: CCCCC1C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 4781
synonyms found at PubChem are:
phenylbutazone, 50-33-9, 4-Butyl-1,2-diphenylpyrazolidine-3,5-dione, Fenilbutazona, Butazolidin, Diphenylbutazone, Phenylbutazonum, Butapirazol, Butapyrazole, Butazolidine, Butacote, Butadion, Bute, Alkabutazona, Butapirazole, Chembutazone, Fenibutazona, Fenylbutazon, Intrabutazone, Mephabutazon, Mephabutazone, Praecirheumin, Scanbutazone, Alqoverin, Anpuzone, Anuspiramin, Arthrizon, Artrizin, Artrizone, Artropan, Azobutyl, Bunetzone, Butacompren, Butadiona, Butagesic, Butalgina, Butalidon, Butarecbon, Butartril, Butartrina, Butazina, Butazona, Butidiona, Butylpyrin, Buvetzone, Digibutina, Diossidone, Diphebuzol, Ecobutazone, Eributazone, Febuzina, Fenartil, Fenibutal, Fenibutasan, Fenibutol, Fenilbutina, Fenilbutine, Fenilidina, Fenotone, Intalbut, Intrazone, Ipsoflame, Malgesic, Merizone, Nadazone, Nadozone, Novophenyl, Phebuzin, Phebuzine, Phenbutazol, Phenopyrine, Phenylbutaz, Phenyzone, Pyrabutol, Pyrazolidin, Rectofasa, Reumasyl, Reumazin, Reumazol, Reumuzol, Reupolar, Robizone, Rubatone, Alindor, Anerval, Antadol, Azolid, Benzone, Betazed, Busone, Butaluy, Butone, Diozol, Elmedal, Lingel, Reudox, Reumune, Butoz, Buzon, Kadol, Reudo, Butiwas-Simple, Neo-zoline, Phenyl-Mobuzon, Equi bute, Robizon-V, Phenylbutazon, Butaphen, Equipalazone, Flexazone, Ia-But, Pirarreumol B, Buta phen, Bizolin 200, Fenilbutazon, Phenbutazone, Schemergin, Bizolin, Wescozone, Zolaphen, Azdid, Tazone, Uzone, Exrheudon N, 4-Butyl-1,2-diphenyl-3,5-pyrazolidinedione, Robizone-V, Phen-Buta-Vet, Butadionum, Schemergen, Shigrodin, Tencodyne, Tevcodyne, Therazone, Todalgil, Zolidinum, Tetnor, Ticinil, B.t.z., esteve, 3,5-Pyrazolidinedione, 4-butyl-1,2-diphenyl-, Fenilbutazone, Butatron, Usaf ge-15, Fenilbutazone [DCIT], Phenylbutazon [German], 4-n-Butyl-1,2-diphenyl-3,5-pyrazolidinedione, 3,5-Dioxo-1,2-diphenyl-4-N-butylpyrazolidine, VAC-10, 4-Butyl-1,2-diphenyl-3,5-dioxopyrazolidine, A 7514, Fenilbutazona [INN-Spanish], Phenylbutazonum [INN-Latin], DA-192, 1,2-Diphenyl-4-butyl-3,5-pyrazolidinedione, Cotylbutazone, 4-BUTYL-1,2-DIPHENYL-PYRAZOLIDINE-3,5-DIONE, Artizin, Equiphen, Phenyzene, butyl pyrin, fe nilbutine, art rizin, Phenyl butazone, Mepha-Butazon, Alka Butazolidin, G 13,871, UNII-GN5P7K3T8S, Apo-Phenylbutazone, 1,2-Diphenyl-3,5-dioxo-4-butylpyrazolidine, 1,2-Diphenyl-4-butyl-3,5-dioxopyrazolidine, R-3-ZON, 3,5-Dioxo-1,2-diphenyl-4-n-butyl-pyrazolidin, CCRIS 2374, CHEBI:48574, component of Azolid-A, HSDB 3159, 3,5-Dioxe-4 buty-1, diphenyl-pyrazolidine, NCI-C56531, AZOLID (TN), EINECS 200-029-0, NSC 25134, Phenylbutazone [USAN:INN:BAN:JAN], G 13871, BRN 0290080, B.T.Z, GN5P7K3T8S, MLS000069424, 1,2-diphenyl-3,5-dioxo-4-n-butylpyrazoline, VYMDGNCVAMGZFE-UHFFFAOYSA-N, NCI-C55414, NCGC00015846-10, NCGC00015846-11, SMR000059073, 3,5-dioxo-4-butyl-1-diphenyl-pyrazolidine, P1686, DSSTox_CID_1136, P 8386, DSSTox_RID_75967, DSSTox_GSID_21136, P1Z, CAS-50-33-9, 4297-92-1, 4-butyl-1,2-diphenyl-1,2-diazolidine-3,5-dione, SR-01000000004, Alkazone, Phenylbutazone/, Phen-Buta, Pirarreumol "B", Pirarreumol 'B', Phenylbutazone [USP:INN:BAN:JAN], 1,5-dioxopyrazolidine, Spectrum_001079, 4-Butyl-1,5-dione, Opera_ID_888, AC1L1IXW, AC1Q2VLE, Bute;Butazolidin;Butatron, Spectrum2_001282, Spectrum3_000675, Spectrum4_000477, Spectrum5_001335, Lopac-P-8386, D07VHR, Epitope ID:124940, SCHEMBL3632, Lopac0_000993, Oprea1_416494, BSPBio_002369, KBioGR_000954, KBioSS_001559, KSC269K7B, MLS001148412, MLS002152929, DivK1c_000331, SPECTRUM1500482, SPBio_001283, 1,5-dioxo-4-butylpyrazolidine, 3, 4-butyl-1,2-diphenyl-, 4-Butyl-1,5-dioxopyrazolidine, 4-Butyl-1,5-pyrazolidinedione, GTPL7270, 1,3-dioxo-4-N-butylpyrazoline, DTXSID9021136, CTK1G9570, HMS501A13, KBio1_000331, KBio2_001559, KBio2_004127, KBio2_006695, KBio3_001589, KS-00000TLZ, MolPort-001-783-564, NINDS_000331, Phenylbutazone (JP15/USP/INN), Phenylbutazone (JP17/USP/INN), BCPP000108, HMS1920H06, HMS2090H17, HMS2091P08, HMS2233B13, HMS3263G07, HMS3369P16, HMS3649M17, HMS3651G15, HMS3715E21, LS-71, Pharmakon1600-01500482, Phenylbutazone, analytical standard, component of Azolid-A (Salt/Mix), BCP02607, HY-B0230, NSC25134, 3,2-diphenyl-4-N-butylpyrazolidine, Tox21_110242, Tox21_110243, Tox21_201809, Tox21_302763, Tox21_500993, 3,2-diphenyl-4-N-butyl-pyrazolidin, ABP000789, AC-683, CCG-39220, MFCD00005500, NSC-25134, NSC757272, s1654, SBB012526, STK388348, AKOS001592731, Phenylbutazone (Butazolidin, Butatron), Tox21_110242_1, ZINC100004227, CS-2180, DB00812, KS-5127, LP00993, MCULE-4303869118, NE30722, NSC-757272, WLN: T5VNNV EHJ BR& CR& E4, IDI1_000331, NCGC00015846-01, NCGC00015846-02, NCGC00015846-03, NCGC00015846-04, NCGC00015846-05, NCGC00015846-06, NCGC00015846-07, NCGC00015846-08, NCGC00015846-09, NCGC00015846-12, NCGC00015846-13, NCGC00015846-15, NCGC00023855-03, NCGC00023855-04, NCGC00023855-05, NCGC00023855-06, NCGC00023855-07, NCGC00023855-08, NCGC00181112-01, NCGC00256449-01, NCGC00259358-01, NCGC00261678-01, AN-15603, SC-25755, ST066897, SBI-0050966.P004, AB2000198, Bute, Butazolidin, Butatron, Phenylbutazone, EU-0100993, FT-0603217, UNM000001255503, 1,2-Diphenyl-2,3-dioxo-4-N-butylpyrazoline, 1,2-diphenyl-3,5-dioxo-4-butyl-pyrazolidine, Phenylbutazone, SAJ special grade, >=99.0%, 1,2-diphenyl-3,5-dioxo-4-n-butylpyrazolidine, 4-Butyl-1,2 -diphenyl-3,5-dioxo pyrazolidine, 4-Butyl-1,2-diphenyl-3,5-dioxo pyrazolidine, C07440, D00510, 1,2-diphenyl-3,5-dioxo-4-n-butyl-pyrazolidine, AB00052071-15, AB00052071-16, AB00052071_17, AB00052071_18, A828072, AG-205/04675049, I01-0883, SR-01000000004-2, SR-01000000004-4, SR-01000000004-5, SR-01000000004-9, W-105972, BRD-K10843433-001-12-8, BRD-K10843433-001-20-1, SR-01000000004-13, Z57355370, 4-butyl-1,2-diphenyl-1H-pyrazole-3,5(2H,4H)-dione, Phenylbutazone, TraceCERT(R), certified reference material, Phenylbutazone, European Pharmacopoeia (EP) Reference Standard, Phenylbutazone, United States Pharmacopeia (USP) Reference Standard, InChI=1/C19H20N2O2/c1-2-3-14-17-18(22)20(15-10-6-4-7-11-15)21(19(17)23)16-12-8-5-9-13-16/h4-13,17H,2-3,14H2,1H


ID: 2416

chemical graph of compound 2416



InChIKey: VYQGBOFPYBNHBX-UHFFFAOYSA-N
SMILES: CC1=C2C(=C3C=CC(=O)C=C3N2)C=CN1.O.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6419938
synonyms found at PubChem are:
Harmol hydrochloride monohydrate, CHEMBL1535235, H-1312, Prestwick_255, AC1O4WGK, C12H10N2O.HCl.H2O, SCHEMBL3769079, HMS1569L06, 7072AH, SBB003135, AKOS024283042, NCGC00017110-01, NCGC00017110-02, ST059591, CAS-40580-83-4, 1-methylbeta-carbolin-7-ol, chloride, hydrate, 1-methyl-2,9-dihydropyrido[3,4-b]indol-7-one hydrate hydrochloride


ID: 2417

chemical graph of compound 2417



InChIKey: VYQNWZOUAUKGHI-UHFFFAOYSA-N
SMILES: C1=CC=C(C=C1)COC2=CC=C(C=C2)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 7638
synonyms found at PubChem are:
4-Benzyloxyphenol, 4-(Benzyloxy)phenol, Monobenzone, 103-16-2, Hydroquinone monobenzyl ether, Benoquin, Benzoquin, Monobenzyl hydroquinone, Leucodinine, Monobenzon, Superlite, Agerite alba, Hydroquinone benzyl ether, P-(BENZYLOXY)PHENOL, Dermochinona, Carmifal, Depigman, Pigmex, p-Hydroxyphenyl benzyl ether, Alba-Dome, Benzyl p-hydroxyphenyl ether, Monobenzyl ether hydroquinone, Agerite, Benzyl hydroquinone, 4-(Phenylmethoxy)phenol, Phenol, 4-(phenylmethoxy)-, Monobenzona, Monobenzonum, 4-benzyloxy phenol, 4-(Benzyloxyl)phenol, Monobenzone [INN], Monobenzonum [INN-Latin], Monobenzona [INN-Spanish], Superlite (antioxidant), Hydrochinon monobenzylether, 4-phenylmethoxyphenol, Monobenzyl Ether of Hydroquinone, Alba, Hydrochinon monobenzylether [Czech], P-BENZYLOXYPHENOL, Phenol, p-(benzyloxy)-, 4-phenylmethoxy-phenol, NSC 2132, UNII-9L2KA76MG5, 4-Benzyloxy-phenol, Benoquin (TN), HSDB 4019, Monobenzone (Benoquin), 4-(Benzyl-Oxy)Phenol, Monobenzone (USP/INN), EINECS 203-083-3, BRN 1958305, AI3-14325, 9L2KA76MG5, PBP, CHEBI:34380, VYQNWZOUAUKGHI-UHFFFAOYSA-N, NCGC00016360-01, CAS-103-16-2, HYDROQUINONE MONOBENZYL ETHER, N F, DSSTox_CID_717, Hydroquinone monobenzylether, WLN: QR DO1R, DSSTox_RID_75755, DSSTox_GSID_20717, Novo-depigman, SR-05000001819, Monobenzone [USP:INN], p-benzoxyphenol, 4-benzoxyphenol, 4-benzyloxylphenol, Carmifal(TN), p-benzyloxy phenol, p-benzyloxy-phenol, Monobenzon (TN), Superlite (TN), Leucodinine (TN), 4(benzyloxy)phenol, Depigman (TN), Dermochinona (TN), (p)-Benzyloxyphenol, Pigmex (TN), Benoquin, Monobenzone, 4-(benzyloxy)-phenol, para-(Benzyloxy)phenol, PubChem10471, ICN brand of monobenzone, Prestwick0_000912, Prestwick1_000912, Prestwick2_000912, Prestwick3_000912, D0H6TP, AC1L1P7V, AC1Q78XV, CHEMBL1388, Oprea1_698781, SCHEMBL35631, BSPBio_000784, 4-(Benzyloxy)phenol, 98%, 4-06-00-05728 (Beilstein Handbook Reference), KSC490K6P, BIDD:ER0003, SPBio_002973, ACMC-20984r, AC1Q579O, BPBio1_000864, GTPL6830, ZINC1748, Jsp000332, DTXSID2020717, 4-(Benzyloxy)phenol, >=99%, CTK3J0567, NSC2132, MolPort-000-519-128, HMS1570H06, HMS1580P12, HMS2097H06, HMS3655K15, HMS3714H06, Pharmakon1600-01503031, 4-(Benzyloxy)phenol (Monobenzone), ACT04723, BCP09974, CS-B0870, EBD45536, NSC-2132, NSC33918, 4-(Benzyloxy)phenol, 98% 25g, Tox21_110396, Tox21_201147, AN-273, ANW-14809, BBL022939, BDBM50410520, CB0111, FC0743, MFCD00002333, NSC-33918, NSC758211, s1652, SBB038524, STL283939, AKOS000119555, Tox21_110396_1, AC-2492, ACN-034824, CCG-213094, DB00600, LS-7440, LS10011, MCULE-6689165962, NE10175, NSC-758211, PS-8213, RP25778, RTC-062014, TRA0001796, KS-0000098L, NCGC00016360-02, NCGC00016360-03, NCGC00016360-05, NCGC00016360-06, NCGC00258699-01, AJ-08077, BC210056, BR-41211, CJ-00063, HY-30272, KB-52520, L650, MONOBENZONE;PBP;P-BENZYLOXYPHENOL;, SC-19155, TL806329, ZB000402, AB1001901, KB-290097, TC-062014, AB00513959, AM20020110, FT-0616695, ST50170917, C14244, D05072, Hydroquinone monobenzyl ether; Monobenzone; PBP, AB00513959-03, AB00513959_04, AB00513959_05, 103H162, A800687, I01-1484, Q-200440, SR-05000001819-1, SR-05000001819-2, SR-05000001819-3, BRD-K54262262-001-01-7, BRD-K54262262-001-06-6, F0777-0782, Z199511588, Monobenzone, United States Pharmacopeia (USP) Reference Standard, 4-(Benzyloxy)phenol ; Hydroquinone monobenzyl ether ; PBP ; Monobenzone, 4-(Benzyloxy)phenol; Hydroquinone monobenzyl ether; PBP; Monobenzone


ID: 2418

chemical graph of compound 2418



InChIKey: VYZGUUJEDSDDGA-UHFFFAOYSA-N
SMILES: CC(C)(C)C1=CC=C(C=C1)OC2=C(C=CC3=C2C(=O)C4=CC=CC=C4C3=O)N

biological descriptors:

CFTR relevance: strong CFTR potentiator

Category:
Influence on CFTR function enhances CFTR function
Order of interaction binds to CFTR
subcellular compartment Apical membrane & subapical compartment

reference list:

"GL Lukacs" "N Pedemonte" "LJ Galietta" "T Ma" "K Du" "C Folli" "H Yang" "AA Shelat" "A Taddei" "VS Gopinath" "AS Verkman" "RK Guy"


CID is 2848108
synonyms found at PubChem are:
9,10-Anthracenedione, 2-amino-1-[4-(1,1-dimethylethyl)phenoxy]-, 68256-56-4, AC1ME4NZ, SCHEMBL3116592, CTK1J2359, DTXSID30385897, MolPort-002-152-359, ZINC4981639, AKOS030561325, MCULE-8602163630, 1-(4-t-butylphenoxy)-2-amino-9,10-anthraquinone, 1-(4-tert-Butylphenoxy)-2-amino-9,10-anthraquinone, 2-amino-1-(4-tert-butylphenoxy)anthracene-9,10-dione


ID: 2419

chemical graph of compound 2419



InChIKey: VZFRNCSOCOPNDB-AOKDLOFSSA-N
SMILES: C[C@H](/C=C/C=C(/C)\[C@H]1CN[C@@H]([C@H]1CC(=O)O)C(=O)O)C(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5282253
synonyms found at PubChem are:
domoic acid, L-Domoic acid, 14277-97-5, domoate, NSC 288031, HSDB 7242, Domoic Acid, Mytilus edulis, BRN 5768789, UNII-M02525818H, C15H21NO6, CHEBI:34727, M02525818H, 25-[2alpha, 3beta, 4beta (1Z, 3E, 5R)]-2-Carboxy-4-(5-carboxy-1-methyl-1,3-hexadienyl)-3-pyrrolidineacetic Acid, 3-Pyrrolidineacetic acid, 2-carboxy-4-(5-carboxy-1-methyl-1,3-hexadienyl)-, (2S-(2-alpha,3-beta,4-beta(1Z,3E,5S*)))-, (-)-domoic acid, AC1NQZQG, (3S,4S)-4-[(2Z,4E,6R)-6-carboxyhepta-2,4-dien-2-yl]-3-(carboxymethyl)-L-proline, D09KRH, C13732, MLS000517259, SCHEMBL387531, GTPL4181, CHEMBL1232313, DTXSID20274180, Domoic acid, >=90% (HPLC), MolPort-003-932-997, VZFRNCSOCOPNDB-AOKDLOFSSA-N, HMS2268I07, HMS3266E11, (2S,3S,4S)-2-CARBOXY-4-[(1Z,3E,5R)-5-CARBOXY-1-METHYL-1,3-HEXADIENYL]-3-PYRROLIDINEACETIC ACID, ZINC3995581, MFCD06795841, 56711-43-4 (hydrochloride salt), AKOS024457240, CCG-208195, DB02852, 2 alpha-carboxy-4 beta-(5-carboxy-1-methyl-1,3 beta-hexadienyl)-3-pyrrolidineacetic acid, NCGC00024520-02, 3-pyrrolidineacetic acid, 2-carboxy-4-(5-carboxy-1-methyl-1,3-hexadienyl)-, (2S-(2 alpha,3 beta,4 beta(1E,3E,5R*)))-, SMR000127427, LS-137112, B6241, X6864, M02718, SR-01000597723, J-007696, SR-01000597723-1, BRD-K52217427-001-02-3, Domoic acid solution, 332 muM in acetonitrile: water (1:19 (v/v)), (2S,3S,4R,5'R)-2-Carboxy-4-(5'-carboxy-1'-methyl-1Z,3E-hexadienyl)-3-pyrrolidineacetic acid, (2S,3S,4S)-3-(carboxymethyl)-4-[(1Z,3E,5R)-5-carboxy-1-methyl-hexa-1,3-dienyl]pyrrolidine-2-carboxylic acid, (2S,3S,4S)-3-(carboxymethyl)-4-[(2Z,4E,6R)-7-hydroxy-6-methyl-7-oxohepta-2,4-dien-2-yl]pyrrolidine-2-carboxylic acid, (2S,3S,4S)-4-[(2Z,4E,6R)-6-carboxy-6-methylhexa-2,4-dien-2-yl]-3-(carboxymethyl)pyrrolidine-2-carboxylic acid, 3-Pyrrolidineacetic acid, 2-carboxy-4-((1Z,3E,5R)-5-carboxy-1-methyl-1,3-hexadienyl)-, (2S,3S,4S)-, 3-Pyrrolidineacetic acid, 2-carboxy-4-[(1Z,3E,5R)-5-carboxy-1-methyl-1,3-hexadien-1-yl]-, (2S,3S,4S)-


ID: 2420

chemical graph of compound 2420



InChIKey: VZTUIEROBZXUFA-UHFFFAOYSA-N
SMILES: COC1=C(C2=C(CC3C4=CC5=C(C=C4CCN3C2)OCO5)C=C1)OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 34458
synonyms found at PubChem are:
Canadine, Tetrahydroberberine, Xanthopuccine, Canadin, 522-97-4, dl-Canadine, Berberine, tetrahydro-, Canadine dl-form, NSC 94918, 29074-38-2, (d,l)-Tetrahydroberberine, NSC 36351, dl-Tetrahydroberberine, 9,10-Dimethoxy-2,3-(methylenedioxy)berbine, EINECS 208-338-2, 5,8,13,13a-Tetrahydro-9,10-dimethoxy-6H-benzo(g)benzo-1,3-dioxolo(5,6-a)quinolizine, 9,10-Dimethoxy-5,8,13,13a-tetrahydro-6H-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinoline, CHEMBL275097, CHEBI:22998, Berbine, 9,10-dimethoxy-2,3-(methylenedioxy)-, NSC36351, canadine, (+-)-isomer, DSSTox_CID_2724, 5,8,13,13a-tetrahydro-9,10-dimethoxy-6H-benzo(g)-1,3-benzodioxolo(5,6-a)quinolizine, 6H-Benzo[g]-1,3-benzodioxolo[5,6-a]quinolizine, 5,8,13,13a-tetrahydro-9,10-dimethoxy-, DSSTox_RID_76701, DSSTox_GSID_22724, 5,8,13,13a-Tetrahydro-9,10-dimethoxy-6H-benzo[g]-1,3-benzodioxolo[5,6-a]quinolizine, 5,8,13,13a-Tetrahydro-9,10-dimethoxy-6H-benzo[g]benzo-1,3-dioxolo[5,6-a]quinolizine, 6H-Benzo(g)-1,3-benzodioxolo(5,6-a)quinolizine, 5,8,13,13a-tetrahydro-9,10-dimethoxy-, Tetrahydroberberine,THB, (+-)-Tetrahydroberberine, tetrahydro-, NCGC00016486-01, CAS-522-97-4, Tetrahydroberberine,, Prestwick_186, Tetrahydroumbellatine, (+-)-Canadine, (.+-.)-Canadine, AC1L1RLI, (+-)-Tetrahydroberberin, (.+/-.)-Canadine, Prestwick0_000672, Prestwick1_000672, Prestwick2_000672, Prestwick3_000672, CANADINE (DL-), Canadine, (.+-.)-, TimTec1_005946, Oprea1_387569, Oprea1_388593, (.+-.)-Tetrahydroberberine, BSPBio_000763, MLS001202314, CANADINE, (+-)-, SCHEMBL232164, SPBio_002684, BPBio1_000841, DTXSID5022724, Berbine, 9,10-dimethoxy-2,3-(methylenedioxy)-, (+-)-, 9-Deoxy-16,17-dihydroberberine, MolPort-001-728-057, VZTUIEROBZXUFA-UHFFFAOYSA-N, HMS1550O06, HMS1570G05, HMS2097G05, HMS2852B23, HMS3358B11, AC1Q4723, HY-N0925, NSC94918, Tox21_110451, 8070AH, BBL028121, BDBM50203122, NSC-36351, NSC-94918, STK722197, AKOS000277103, AKOS021856290, Tox21_110451_1, ( inverted exclamation markA)-Canadine, API0001827, CCG-202815, EBD2205518, LS-2134, MCULE-3875114127, ACM29074382, Benzo(g)-1,3-benzodioxolo(5,6-a)quinolizine, 5,8,13,13a-tetrahydro-9,10-dimethoxy-, (+-)-, NCGC00173359-04, NCGC00173359-06, AN-45540, KB-81062, NCI60_003328, NCI60_042115, SMR000393885, ST047929, LS-175345, Berbine,10-dimethoxy-2,3-(methylenedioxy)-, FT-0659151, FT-0664216, ( inverted exclamation markA)-Tetrahydroberberine, 522C974, I06-0299, I07-0265, BRD-A69950438-001-04-5, BRD-A69950438-001-11-0, Berbine,10-dimethoxy-2,3-(methylenedioxy)-, (.+-.)-, A2306/0097222, 6H-Benzo[g]-1,6-a]quinolizine, 5,8,13,13a-tetrahydro-9,10-dimethoxy-, 6H-Benzo[g]-1,3-benzodioxolo[5,6-a]quinolizine,5,8,13,13a-tetrahydro-9,10-dimethoxy-, 6H-Benzo[g]-1,6-a]quinolizine, 5,8,13,13a-tetrahydro-9,10,dimethoxy-, (.+-.)-, 16,17-dimethoxy-5,7-dioxa-13-azapentacyclo[11.8.0.0^{2,10}.0^{4,8}.0^{15,20}]henicosa-2,4(8),9,15(20),16,18-hexaene, 26548-75-4, 28111-09-3, 4979-14-0, 6H-Benzo(g)-1,3-benzodioxolo(5,6-a)quinolizine, 5,8,13,13a-tetrahydro-9,10,dimethoxy-, (+-)-, 9,10-bis(methyloxy)-5,8,13,13a-tetrahydro-6H-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinoline, 9,10-dimethoxy-5,6,7,8,13,13a-hexahydro-2H-1,3-dioxoleno[4,5-g]isoquinolino[3, 2-a]isoquinoline, 9,10-Dimethoxy-5,8,13,13a-tetrahydro-6H-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinoline #, DL-CANADINE (GOLDENSEALRT;118-08-1;84603-60-1;2086-83-1;171869-95-7;5936-29-8), Isoquinolino[2,1-b]isoquinoline, 5,6,7,8,13,13a-hexahydro-2,3-methylenedioxy-9,10-dimethoxy-


ID: 2421

chemical graph of compound 2421



InChIKey: VZXLWEWYBUGLJA-XKZIYDEJSA-N
SMILES: CC(=CCCC1(C=CC2=C(O1)C(=C3C(=C2O)C(=O)C4=CC5CC6C4(O3)C(C5O)(OC6(C)C)C/C=C(/C)\C(=O)O)CC=C(C)C)C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6857793
synonyms found at PubChem are:
DIHYDROGAMBOGIC ACID, CHEMBL1526240, Spectrum5_000024, BSPBio_002253, SPECTRUM201524, SCHEMBL13287141, CHEBI:93865, BDBM50442905, CCG-38542, SDCCGMLS-0066906.P001, NCGC00095727-01, NCGC00095727-02, SR-05000002768, SR-05000002768-1


ID: 2422

chemical graph of compound 2422



InChIKey: WANGFTDWOFGECH-UHFFFAOYSA-N
SMILES: CCCCN(CCCC)CCC(C1=C2C=CC(=CC2=C3C=C(C=C(C3=C1)Cl)Cl)C(F)(F)F)O.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 37392
synonyms found at PubChem are:
HALOFANTRINE HYDROCHLORIDE, 36167-63-2, Halofantrine HCl, Halofantrino [Spanish], Halofantrino, (+-)-Halofantrine hydrochloride, WR 171669, Halofantrine Hydrochloride [USAN], WR-171,669, EINECS 252-895-4, UNII-2B7ENL644K, C26H30Cl2F3NO.HCl, WR-171669, 2B7ENL644K, NCGC00016833-01, Halfan (TN), 1,3-Dichloro-6-trifluoromethyl-9-(3-(dibutylamino)-1-hydroxypropyl)phenanthrene HCl, 1-(1,3-Dichloro-6-trifluoromethyl-9-phenanthryl)-3-(di-n-butylamino)propanol hydrochloride, 3-(Dibutylamino)-1-(1,3-dichloro-6-(trifluoromethyl)phenanthren-9-yl)propan-1-ol hydrochloride, 9-(3-(dibutylamino)-1-hydroxypropyl)-1,3-dichloro-6-(trifluoromethyl)phenanthrene hydrochloride, DSSTox_CID_25464, DSSTox_RID_80895, DSSTox_GSID_45464, 1,3-Dichloro-alpha-(2-(dibutylamino)ethyl)-6-(trifluoromethyl)-9-phenanthrenemethanol hydrochloride, 106927-11-1, W-106636, WR-171699, WR 171,699, Halofantrine hydrochloride (USAN), MLS002154111, 1,3-Dichloro-a-[2-(dibutylamino)ethyl]-6-(trifluoromethyl)-9-phenanthrenemethanol hydrochloride, 1,3-Dichloro-alpha-(2-(dibutylamino)ethyl)-6-(trifluoromethyl)phenanthren-1-methanol hydrochloride, 9-Phenanthrenemethanol, 1,3-dichloro-alpha-(2-(dibutylamino)ethyl)-6-(trifluoromethyl)-, hydrochloride, CAS-36167-63-2, 1-(1,3-dichloro-6-trifluoromethyl-9-phenanthryl)-3-di(n-butyl)aminopropanol HCl, SK&F-102866, SMR001233418, 1,3-DICHLORO-ALPHA-[2-(DIBUTYLAMINO)ETHYL]-6-(TRIFLUOROMETHYL)-9-PHENANTHRENEMETHANOL HYDROCHLORIDE, 3-(dibutylamino)-1-[1,3-dichloro-6-(trifluoromethyl)phenanthren-9-yl]propan-1-ol hydrochloride, SKF 102886, Halofantrine hydrochlorid, AC1L1XMK, 3-(dibutylamino)-1-[1,3-dichloro-6-(trifluoromethyl)phenanthren-9-yl]propan-1-ol;hydrochloride, 9-Phenanthrenemethanol, 1,3-dichloro-alpha-(2-(dibutylamino)ethyl)-6-(trifluoromethyl)-,hydrochloride, HALFAN HYDROCHLORIDE, SCHEMBL466895, (-)-Halofantrine hydrochloride, CHEMBL1200901, DTXSID0045464, CTK8G0127, Halofantrine hydrochloride, (-)-, HMS1571O03, Tox21_110637, MFCD00879136, AKOS030254762, Tox21_110637_1, API0002884, CCG-221031, YF10095, NCGC00179250-03, LS-102675, FT-0082696, FT-0600399, Z3682, D02485, 167H632, C-34958, Halofantrine hydrochloride, >=98% (HPLC), solid, SR-01000841216, SR-01000841216-2, Halofantrine hydrochloride, European Pharmacopoeia (EP) Reference Standard, 1-[1,3-dichloro-6-trifluoromethyl-9-phenanthryl]-3-di(n-butyl)aminopropanol hydrochloride, 3-DIBUTYLAMINO-1-(1,3-DICHLORO-6-TRIFLUOROMETHYL-PHENANTHREN-9-YL)-PROPAN-1-OL HCL, 66051-64-7, 9-Phenanthrenemethanol, 1,3-dichloro-alpha-(2-(dibutylamino)ethyl)-6-(trifluoromethyl)-, hydrochloride, (-)-, 1,3-Dichloro-alpha-[2-(dibutylamino)ethyl]-6- (trifluoromethyl)-9-phenathrenemethanol hydrochloride


ID: 2423

chemical graph of compound 2423



InChIKey: WAZQAZKAZLXFMK-UHFFFAOYSA-N
SMILES: COC1=C(C=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)F)F

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3058754
synonyms found at PubChem are:
Deracoxib, 169590-41-4, Deramaxx, 4-(3-(difluoromethyl)-5-(3-fluoro-4-methoxyphenyl)-1H-pyrazol-1-yl)benzenesulfonamide, SC 46, SC 046, Deram, UNII-VX29JB5XWV, SC 59046, SC-59046, VX29JB5XWV, CHEMBL28636, 4-[3-(difluoromethyl)-5-(3-fluoro-4-methoxyphenyl)-1H-pyrazol-1-yl]benzenesulfonamide, C17H14F3N3O3S, CHEBI:73032, NCGC00095312-01, DSSTox_CID_25975, DSSTox_RID_81266, DSSTox_GSID_45975, 4-[3-(difluoromethyl)-5-(3-fluoro-4-methoxyphenyl)pyrazol-1-yl]benzenesulfonamide, CAS-169590-41-4, Deracoxib [USAN:INN], deracoxibum, Deracoxib (USAN), Spectrum2_000521, Spectrum3_001677, Spectrum4_001227, Spectrum5_001644, AC1MHW65, SCHEMBL24645, BSPBio_003493, KBioGR_001694, SPBio_000501, DTXSID4045975, KBio3_002713, EX-A887, MolPort-003-666-614, HMS2093M12, Pharmakon1600-01505222, ZINC607803, BCP04295, KS-00000G0A, Tox21_111503, BDBM50057583, CCG-39562, NSC758935, AKOS016009604, Tox21_111503_1, API0019295, BCP9000598, CS-2107, NSC-758935, NCGC00095312-02, NCGC00095312-04, 4CA-0448, AJ-23690, AK-60962, AS-19558, HY-17509, KB-76437, BCP0726000080, SBI-0206729.P001, AB0035926, AX8123794, FT-0665858, ST24042879, Y0377, D03689, AB01563051_01, SR-05000001985, J-010565, SR-05000001985-1, BRD-K68558722-001-02-4, 4-[3-Difluoromethyl-5-(3-fluoro-4-methoxy-phenyl)-pyrazol-1-yl]-benzenesulfonamide, 4-[5-(3-Fluoro-4-methoxyphenyl)-3-(difluoromethyl)-1H-pyrazol-1-yl]benzenesulfonamide, Benzenesulfonamide, 4-(3-(difluoromethyl)-5-(3-fluoro-4-methoxyphenyl)-1H-pyrazol-1-yl)-


ID: 2424

chemical graph of compound 2424



InChIKey: WBLZUCOIBUDNBV-UHFFFAOYSA-N
SMILES: C(C[N+](=O)[O-])C(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 1678
synonyms found at PubChem are:
3-nitropropionic acid, 3-Nitropropanoic acid, 504-88-1, Bovinocidin, Hiptagenic acid, Propanoic acid, 3-nitro-, beta-Nitropropionic acid, 3-Nitropropionate, Propionic acid, 3-nitro-, beta-Nitropropanoic acid, NCI-C03076, 3-NP acid, NSC 64266, NITROPROPIONIC ACID, BETA, UNII-QY4L0FOX0D, 3-NPA, beta-Nitropropanoate, CCRIS 454, HSDB 4147, 3-nitro-propionic acid, EINECS 208-003-0, QY4L0FOX0D, BNP, .beta.-Nitropropionic acid, BRN 1759889, CHEBI:16348, WBLZUCOIBUDNBV-UHFFFAOYSA-N, NSC64266, BOVINOCIDIN (3-nitropropionic acid), DSSTox_CID_982, DSSTox_RID_75904, 3-nitro-1-propionate, DSSTox_GSID_20982, CHEMBL451226, 3NP, CAS-504-88-1, Nitropropionic aci, beta, SR-01000076030, 3-Nitroporpionic Acid, Spectrum_001674, 3-Nitro-Propanoic acid, SpecPlus_000692, Substrate analogue, 20, AC1L1BZO, beta -nitropropionic acid, Spectrum2_000876, Spectrum3_000993, Spectrum4_001119, Spectrum5_001895, Lopac-N-5636, WLN: WN2VQ, AC1Q28KX, Nitropropionic acid, .beta., 3-Nitropropionic acid, 8CI, Lopac0_000838, SCHEMBL70072, BSPBio_002685, KBioGR_001598, KBioSS_002154, 4-02-00-00771 (Beilstein Handbook Reference), MLS001066410, 3-Nitropropionic acid, 97%, DivK1c_006788, SPECTRUM1504206, SPBio_000951, DTXSID1020982, 3-Nitropropionic acid, >=97%, BDBM82201, CTK3I9712, KBio1_001732, KBio2_002154, KBio2_004722, KBio2_007290, KBio3_001905, MolPort-003-665-655, HMS2235N03, HMS3262H17, HMS3369D16, ZINC895862, Propanoic acid, 3-nitro- (9CI), BCP15066, Tox21_202460, Tox21_303007, Tox21_500838, 6949AB, CCG-40325, MFCD00007406, NSC-64266, AKOS006221915, AKOS015833440, 504-88-1 (FREE ACID), CM10288, CS-W013591, FCH3459604, HY-W012875, LP00838, LS-1311, RTR-031911, SDCCGMLS-0066769.P001, TRA0076505, KS-0000184K, 3-Nitropropanoic acid; 3-nitropropanoate, NCGC00015744-01, NCGC00015744-02, NCGC00015744-03, NCGC00015744-04, NCGC00015744-05, NCGC00015744-06, NCGC00015744-07, NCGC00094169-01, NCGC00094169-02, NCGC00094169-03, NCGC00094169-04, NCGC00256389-01, NCGC00260009-01, NCGC00261523-01, CC-15785, SC-89718, SMR000471863, DB-008848, TR-031911, EU-0100838, FT-0632243, KB-3354019, C05669, N 5636, C-31013, I14-1898, SR-01000076030-1, SR-01000076030-5


ID: 2425

chemical graph of compound 2425



InChIKey: WBSMZVIMANOCNX-UHFFFAOYSA-N
SMILES: C1=CC(=CC=C1C(CN)(CS(=O)(=O)O)O)Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 1564
synonyms found at PubChem are:
2-Hydroxysaclofen, 2-OH-Saclofen, 2-Hydroxy-saclofen, 117354-64-0, 2-hydroxy-s-(-)-saclofen, 3-Amino-2-(4-chlorophenyl)-2-hydroxypropylsulfonic acid, 3-Amino-2-(4-chlorophenyl)-2-hydroxypropanesulfonic acid, 3-amino-2-(4-chlorophenyl)-2-hydroxypropane-1-sulfonic acid, beta-(Aminomethyl)-4-chloro-beta-hydroxybenzeneethanesulfonic acid, Benzeneethanesulfonic acid, beta-(aminomethyl)-4-chloro-beta-hydroxy-, SR-01000075621, AC1L1BQU, 2-Hydroxysaclofen, solid, D0T8SD, Lopac0_000079, SCHEMBL340521, GTPL1068, CHEMBL1256573, CTK8E9547, CHEBI:111179, MolPort-003-940-254, HMS3260O19, HMS3266E03, Tox21_500079, BN0010, MFCD00069282, AKOS015914257, CCG-204174, LP00079, MCULE-2497142105, NCGC00015077-03, NCGC00015077-04, NCGC00015077-05, NCGC00024513-02, NCGC00024513-03, NCGC00260764-01, LS-30248, ST057227, 2-Hydroxysaclofen, >=98% (TLC), solid, RT-007844, EU-0100079, FT-0734558, A 6566, C-54155, J-003609, SR-01000075621-1, SR-01000075621-3, BRD-A27924917-001-01-7, I14-44851, (RS)-3-Amino-2-(4-chlorophenyl)-2-hydroxypropyl-sulfonic acid, (R)-3-amino-2-(4-chlorophenyl)-2-hydroxypropane-1-sulfonic acid, BENZENEETHANESULFONICACID, B-(AMINOMETHYL)-4-CHLORO-B-HYDROXY-, ( inverted question mark)-3-Amino-2-(4-chlorophenyl)-2-hydroxy-propylsulfonic acid


ID: 2426

chemical graph of compound 2426



InChIKey: WBSPCHFEFYQJOP-UHFFFAOYSA-M
SMILES: C1N2C=CC3=CC=CC=C3C2=NC4=[N+]1C=CC5=CC=CC=C54.[I-]

biological descriptors:

CFTR relevance: inactive

Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown

reference list:

"MH Nantz" "LJ Galietta" "K By" "EJ Niedzinski" "M Eda" "MF Springsteel" "MJ Haddadin" "MJ Kurth" "AS Verkman"


CID is 404653
synonyms found at PubChem are:
NSC721080, AC1L8NQ2, CHEMBL1998572, CTK5J6999, NSC-721080, 8h-[1,3,5]triazino[2,1-a:4,5-a']diisoquinolin-7-ium iodide


ID: 2427

chemical graph of compound 2427



InChIKey: WBWDWFZTSDZAIG-UHFFFAOYSA-M
SMILES: CCCCCCCCCCCCCCCC[N+](C)(C)CCN(CC1=CC=C(C=C1)OC)C2=NC=CC=N2.[Br-]

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 11102
synonyms found at PubChem are:
THONZONIUM BROMIDE, 553-08-2, Tonzonium bromide, Thonzide, Thonzonium (bromide), UNII-JI2B19CR0R, NC 1264, JI2B19CR0R, MLS002154065, SMR001233380, Tonzonium bromide (INN), Tonzonium bromide [INN], DSSTox_CID_25326, DSSTox_RID_80805, DSSTox_GSID_45326, Tonzonii bromidum, Hexadecyl(2-((p-methoxybenzyl)-2-pyrimidinylamino)ethyl)dimethylammonium bromide, Hexadecyl(2-[(p-methoxybenzyl)-2-pyrimidinylamino]ethyl)dimethylammonium bromide, Bromuro de tonzonio, Bromure de tonzonium, SR-01000841261, NCGC00016507-01, CAS-553-08-2, Tonzoniumbromid, Nebair, Tonzonii bromidum [INN-Latin], Thonzonium bromide [USAN:USP], Hexadecyl[2-[(p-methoxybenzyl)-2-pyrimidinylamino]ethyl]dimethylammonium bromide, Bromure de tonzonium [INN-French], Bromuro de tonzonio [INN-Spanish], Thonzide (TN), NSC 5648, EINECS 209-032-1, AC1L1WME, Thonzonium Bromide (USAN), SCHEMBL60801, C32H55N4O.Br, REGID_for_CID_11102, CHEMBL1200883, DTXSID1045326, NSC5648, MolPort-006-111-785, HMS1570J12, HMS2097J12, HMS2234H11, HMS3714J12, Pharmakon1600-01503873, HY-B1246, NSC-5648, Tox21_110463, 2755AH, MFCD00133855, NSC760359, AKOS026750378, Tox21_110463_1, API0009025, CCG-213228, CS-4957, NC-1264, NSC-760359, NCGC00016507-05, D02140, SR-01000841261-2, SR-01000841261-3, Cetyl[2-[(p-methoxybenzyl)-2-pyrimidinylamino]ethyl]dimethylammonium bromide, Ammonium, hexadecyl(2-((p-methoxybenzyl)-2-pyrimidinylamino)ethyl)dimethyl-, bromide (8CI), hexadecyl-[2-[(4-methoxyphenyl)methyl-pyrimidin-2-ylamino]ethyl]-dimethylazanium bromide, 1-Hexadecanaminium, N-(2-(((4-methoxyphenyl)methyl)-2-pyrimidinylamino)ethyl)-N,N-dimethyl-, bromide, N-(2-((4-Methoxybenzyl)(pyrimidin-2-yl)amino)ethyl)-N,N-dimethylhexadecan-1-aminium bromide


ID: 2428

chemical graph of compound 2428



InChIKey: WBWFIUAVMCNYPG-BQYQJAHWSA-N
SMILES: CN1C(=NC2=C1C(=O)N(C(=O)N2C)C)/C=C/C3=CC(=CC=C3)Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5353365
synonyms found at PubChem are:
8-(3-Chlorostyryl)caffeine, Csc cpd, 8-CSC, CSC, 148589-13-3, CHEMBL26138, CHEBI:53115, 8-[(E)-2-(3-Chlorophenyl)ethenyl]-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione, 8-(2-(3-Chlorophenyl)methyl)-3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione, 147700-11-6, 1H-Purine-2,6-dione, 8-(2-(3-chlorophenyl)methyl)-3,7-dihydro-1,3,7-trimethyl-, D0I2CD, D0TU7I, 8-(3-chlorostyryl) caffine, Lopac0_000393, MLS000860039, SCHEMBL537055, 8-[2-(3-chlorophenyl)ethenyl]-1,3,7-trimethylpurine-2,6-dione, AC1NS448, GTPL5609, cid_5353365, AOB5970, DTXSID60872447, (E)-8-(3-chlorostyryl)caffeine, MolPort-003-940-662, WBWFIUAVMCNYPG-BQYQJAHWSA-N, HMS2235C15, HMS3261O07, (E)-8-(3-chlorostyryl)-caffeine, 8-[(1E)-3-Chlorostyryl]caffeine, ZINC3809416, Tox21_500393, BDBM50037429, AKOS024457540, CCG-204487, LP00393, NCGC00093821-01, NCGC00093821-02, NCGC00093821-03, NCGC00093821-04, NCGC00261078-01, SMR000326897, LS-184215, C-197, EU-0100393, 8-[(E)-3-Chlorostyryl]-1,3,7-trimethylxanthine, L011922, SR-01000075209, J-008393, SR-01000075209-1, 8-[(E)-2-(3-chlorophenyl)ethenyl]-1,3,7-trimethylpurine-2,6-dione, (E)-8-[2-(3-Chlorophenyl)ethenyl]-3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione, 1,2,3,6-Tetrahydropurin-2,6-dione, 1,3,7-trimethyl-8-[2-(3-chlorophenyl)ethenyl]-, 8-[(E)-2-(3-Chlorophenyl)ethenyl]-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione #, 8-[2-(3-Chloro-phenyl)-vinyl]-1,3,7-trimethyl-3,7-dihydro-purine-2,6-dione


ID: 2429

chemical graph of compound 2429



InChIKey: WCDWBPCFGJXFJZ-UHFFFAOYSA-N
SMILES: C1=CN(C(=N1)[N+](=O)[O-])CC(=O)NCCO

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3276
synonyms found at PubChem are:
etanidazole, 22668-01-5, Radinyl, Etanidazolum, Ethanidazole, Etanidazol, 1H-Imidazole-1-acetamide, N-(2-hydroxyethyl)-2-nitro-, Etanidazol [Spanish], Etanidazolum [Latin], Etandazole, Etanidazole [USAN:INN], UNII-30DKA3Q1HL, N-(2-Hydroxyethyl)-2-nitro-1H-imidazole-1-acetamide, NSC 301467, NSC-301467, SR 2508, SR-2508, NSC301467, N-(2-Hydroxyethyl)-2-nitroimidazole-1-acetamide, BRN 0919296, 30DKA3Q1HL, N-(2-Hydroxyethyl)-1-(2-nitro-1-imidazolyl)acetamide, MLS003115757, CHEBI:75473, NCGC00016767-02, CAS-22668-01-5, DSSTox_CID_25434, DSSTox_RID_80876, DSSTox_GSID_45434, N-(2-hydroxyethyl)-2-(2-nitroimidazol-1-yl)acetamide, C7H10N4O4, N-(2-hydroxyethyl)-2-(2-nitro-1H-imidazol-1-yl)acetamide, SR-05000001859, Radinyl(TM), Radinyl (TN), Prestwick_1056, Spectrum_001574, AC1L1FKH, Prestwick0_000649, Prestwick1_000649, Prestwick2_000649, Prestwick3_000649, Spectrum2_000910, Spectrum4_001183, Spectrum5_001667, Etanidazole (USAN/INN), D0LJ6P, AC1Q5AX1, Etanidazole (SR-2508), SCHEMBL4414, BSPBio_000657, KBioGR_001845, KBioSS_002054, CHEMBL47405, DivK1c_000305, SPECTRUM1503412, DuP-435, SPBio_000760, SPBio_002578, BPBio1_000723, DTXSID8045434, HMS500P07, KBio1_000305, KBio2_002054, KBio2_004622, KBio2_007190, NINDS_000305, WCDWBPCFGJXFJZ-UHFFFAOYSA-N, HMS1570A19, HMS2093E13, HMS2097A19, HMS3714A19, ZINC1873938, Tox21_110599, CCG-39747, AKOS028109842, Tox21_110599_1, API0002614, DB12736, SP-2508, IDI1_000305, NCGC00016767-01, NCGC00016767-05, NCGC00095848-01, LS-77976, NCI60_002528, QC-10761, SMR001233273, SBI-0051823.P002, AB00052354, D04075, 33815-EP2275420A1, 33815-EP2295055A2, 33815-EP2295416A2, 33815-EP2298748A2, 33815-EP2298764A1, 33815-EP2298765A1, 33815-EP2305642A2, 33815-EP2311453A1, 33815-EP2311808A1, 33815-EP2311829A1, 2-Nitroimidazole-1-acetamide, N-(2-hydroxyethyl)-, SR-05000001859-1, SR-05000001859-2, 2-(2-Nitro-imidazol-1-yl)-N-2-hydroxyethylacetamide, Imidazole-1-acetamide, N-(2-hydroxyethyl)-2-nitro-, N-(2-hydroxyethyl)-2-(2-nitro-1-imidazolyl)acetamide, 74083-16-2


ID: 2430

chemical graph of compound 2430



InChIKey: WCGUUGGRBIKTOS-GPOJBZKASA-N
SMILES: C[C@@H]1CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H](C5(C)C)O)C)C)[C@@H]2[C@H]1C)C)C(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 64945
synonyms found at PubChem are:
Ursolic acid, Malol, Prunol, Urson, 77-52-1, 3beta-Hydroxyurs-12-en-28-oic acid, (3beta)-3-Hydroxyurs-12-en-28-oic acid, 3beta-Hydroxy-12-ursen-28-ic acid, UNII-P3M2575F3F, CCRIS 7123, CHEBI:9908, EINECS 201-034-0, CHEMBL169, Merotaine, AI3-03109, NSC4060, P3M2575F3F, NSC-4060, Urs-12-en-28-oic acid, 3-hydroxy-, (3beta)-, 3-epi-ursolic acid, HNMR, .beta.-Ursolic acid, NSC 4060, NSC 167406, (1S,2R,4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid, Bungeolic acid, (+)-Ursolic acid, SMR000445681, SR-01000779684, ursolate, ursolic-acid, TNP00103, Uosolic acid, HSDB 7685, beta-Ursolic acid, beta-Ursolic acil, NSC-167406, 6Q5, 3B-HYDROXYURS-12-EN-28-OIC ACID, PubChem5861, Prestwick3_000089, (3 beta)-3-hydroxyurs-12-en-28-oic acid, Ursolic acid, >=90%, D07LUJ, SCHEMBL70205, BSPBio_000018, MLS000728569, MLS002154196, MLS002207073, AC1L229Q, BPBio1_000020, CTK8B2901, TOS-BB-0966, Ursolic acid, analytical standard, MolPort-003-939-637, WCGUUGGRBIKTOS-GPOJBZKASA-N, 3beta-Hydroxyurs-12-en-28-oate, HMS2095A20, HMS2231P19, 3beta-hydroxy-Urs-12-en-28-oate, HY-N0140, ZINC3978827, AN-321, ANW-41290, BDBM50148911, CU0013, MFCD00009621, 3beta-Hydroxy-12-ursen-28-oic Acid, AKOS005228010, AKOS016023773, 3.beta.-hydroxy-Urs-12-en-28-oate, CCG-208282, CS-3799, LMPR0106180007, (3beta)-3-Hydroxyurs-12-en-28-oate, 3beta-hydroxy-Urs-12-en-28-oic acid, (3beta)-3-hydroxy-Urs-12-en-28-oate, AJ-47576, AS-35119, ST056289, 3.beta.-hydroxy-Urs-12-en-28-oic acid, Urs-12-en-28-oic acid, 3beta-hydroxy-, LS-160850, TL8005322, TR-024765, (3beta)-3-hydroxy-Urs-12-en-28-oic acid, AB00513802, N1823, ST24050337, U0065, C08988, 33490-EP2272826A1, 33490-EP2275414A1, 33490-EP2281563A1, 33490-EP2281810A1, 33490-EP2292628A2, 33490-EP2298776A1, 33490-EP2305682A1, 33490-EP2308479A2, 33490-EP2308879A1, 33490-EP2311815A1, 009U621, 3-oC>>u-(3|A)-IUE/-12-I(c)-28-Ea, Urs-12-en-28-oic acid, 3beta-hydroxy- (8CI), Q-201916, SR-01000779684-4, SR-01000779684-5, BRD-K68185022-001-02-3, BRD-K68185022-001-14-8, Ursolic acid, primary pharmaceutical reference standard, AF479D19-631E-48F1-8ABA-FB2A806046FA, Ursolic acid, European Pharmacopoeia (EP) Reference Standard, Ursolic acid, United States Pharmacopeia (USP) Reference Standard, NSC4060, CCRIS 7123, TOS-BB-0966, 3-beta-hydroxyurs-12-en-28-oic acid, (1S,2R,4aS,6aS,6bR,8aR,10S,12aR,12bR,14bS)-10-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydropicene-4a(2H)-carboxylic acid, (2S,5S,9S,10S,18S,1R,8R,14R,15R,20R)-18-hydroxy-1,2,8,9,15,19,19-heptamethylpe ntacyclo[12.8.0.0<2,11>.0<5,10>.0<15,20>]docos-11-ene-5-carboxylic acid, 209545-05-1


ID: 2431

chemical graph of compound 2431



InChIKey: WCNLFPKXBGWWDS-UHFFFAOYSA-N
SMILES: C1=CC=C(C(=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5281610
synonyms found at PubChem are:
Datiscetin, 480-15-9, 3,5,7,2'-Tetrahydroxyflavone, UNII-M8C5EH705I, 4H-1-Benzopyran-4-one, 3,5,7-trihydroxy-2-(2-hydroxyphenyl)-, 3,5,7-trihydroxy-2-(2-hydroxyphenyl)chromen-4-one, M8C5EH705I, 2',3,5,7-Tetrahydroxyflavone, CHEBI:75107, 3,5,7-Trihydroxy-2-(2-hydroxyphenyl)-4-benzopyrone, 3,5,7-trihydroxy-2-(2-hydroxyphenyl)-4H-chromen-4-one, 2-(2-hydroxyphenyl)-3,5,7-tris(oxidanyl)chromen-4-one, Datiscetin (16), EINECS 207-541-3, AC1NQYQ4, SCHEMBL43916, CHEMBL503168, DTXSID50197378, WCNLFPKXBGWWDS-UHFFFAOYSA-N, BDBM153270, ZINC6095498, ACM480159, LMPK12111622, AKOS028111775, API0002222, CCG-208384, VA10670, NCGC00163533-01, CC-26266, LS-193901, FT-0603128, ST50309298, C10036, A827421, C-18022, SR-05000002281, SR-05000002281-2, 2 inverted exclamation marka,3,5,7-Tetrahydroxyflavone, 3,5,7-Trihydroxy-2-(2-hydroxy-phenyl)-chromen-4-one, 3,5,7-trihydroxy-2-(2-hydroxyphenyl)-1-benzopyran-4-one, 4H-1-Benzopyran-4-one,3,5,7-trihydroxy-2-(2-hydroxyphenyl)-


ID: 2432

chemical graph of compound 2432



InChIKey: WCPXLMIPGMFZMY-MERQFXBCSA-N
SMILES: CCN1CCC[C@H]1CNC(=O)C2=C(C=CC(=C2OC)Br)OC.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 15565709
synonyms found at PubChem are:
REMOXIPRIDE HYDROCHLORIDE, Roxiam, 73220-03-8, A 33547 hydrochloride, UNII-QS4S72U30K, Remoxipride HCl, (-)-FLA 731, QS4S72U30K, 80125-14-0 (Parent), SR-01000597869, Remoxipride Hydrochloride Anhydrous, (S)-(-)-2-((3-Bromo-2,6-dimethoxybenzamido)methyl)-1-ethylpyrrolidine hydrochloride, (S)-(-)-3-Bromo-2,6-dimethoxy-N-(1-ethyl-2-pyrrolidinylmethyl)benzamide hydrochloride, Benzamide, 3-bromo-2,6-dimethoxy-N-(1-ethyl-2-pyrrolidinylmethyl)-, hydrochloride, (S)-(-)-, MLS002154079, (S)-Remoxipride Hydrochloride, SCHEMBL122729, (-)-Remoxipride Hydrochloride, CHEMBL1899328, MolPort-003-983-422, HMS1571C03, BG0386, AKOS024458693, (-)-FLA 73, API0016890, CCG-220971, SMR001233389, B6501, SR-01000597869-1, SR-01000597869-3, (S)-(-)-3-Bromo-N-[(1-ethyl-2-pyrrolidinylmethyl]2,6-dimethoxybenzamide hydrochloride, (S)-3-bromo-N-((1-ethylpyrrolidin-2-yl)methyl)-2,6-dimethoxybenzamide hydrochloride, 3-Bromo-N-[[(2S)-1-ethyl-2-pyrrolidinyl]methyl]-2,6-dimethoxybenzamide Hydrochloride, 3-bromo-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-2,6-dimethoxybenzamide;hydrochloride


ID: 2433

chemical graph of compound 2433



InChIKey: WDEABJKSGGRCQA-UHFFFAOYSA-N
SMILES: CC1=C(C(=O)C(=C(C1=O)C)CCCCC#CCCCC#CCO)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 1967
synonyms found at PubChem are:
aa-861, DOCEBENONE, 80809-81-0, Docebenonum, Docebenona, AA861, Docebenone [USAN:INN], Docebenonum [INN-Latin], Docebenona [INN-Spanish], UNII-2XRX3BD53M, CHEBI:2340, 2-(12-Hydroxy-5,10-dodecadiynyl)-3,5,6-trimethyl-p-benzoquinone, 2,3,5-trimethyl-6-(12-hydroxy-5,10-dodecadiynyl)-1,4-benzoquinone, 2-(12-hydroxydodeca-5,10-diyn-1-yl)-3,5,6-trimethylcyclohexa-2,5-diene-1,4-dione, A-61589, 2XRX3BD53M, MLS000028467, 2-(12-hydroxydodeca-5,10-diynyl)-3,5,6-trimethyl-1,4-benzoquinone, A 61589, NCGC00015053-05, SMR000058412, 6-(12-hydroxydodeca-5,10-diyn-1-yl)-2,3,5-trimethyl-1,4-benzoquinone, 2-(12-hydroxydodeca-5,10-diynyl)-3,5,6-trimethylcyclohexa-2,5-diene-1,4-dione, DSSTox_CID_25125, DSSTox_RID_80689, DSSTox_GSID_45125, 2-(12-Hydroxydodeca-5,10-divinyl)-3,5,6-trimethyl-1,4-benzoquinone, 2-(12-Hydroxydodeca-5,10-diynyl)-3,5,6-trimethyl-p-benzoquinone, 2-[12-Hydroxydodeca-5,10-diynyl]-3,5,6-trimethyl-p-benzoquinone, 2,5-Cyclohexadiene-1,4-dione, 2-(12-hydroxy-5,10-dodecadiynyl)-3,5,6-trimethyl-, CAS-80809-81-0, AA 861, AC1L1CMN, Docebenone (USAN/INN), Opera_ID_1818, Lopac-A-3711, D06XRQ, Lopac0_000026, BSPBio_001266, KBioGR_000606, KBioSS_000606, SCHEMBL522781, AC1Q691N, DTXSID0045125, CTK5E8167, KBio2_000606, KBio2_003174, KBio2_005742, KBio3_001071, KBio3_001072, Bio2_000473, Bio2_000953, HMS1362P07, HMS1792P07, HMS1990P07, HMS2089P21, HMS2232L19, HMS3260E13, HMS3403P07, ZINC1529186, Tox21_110072, Tox21_500026, 2566AC, BDBM50103621, EI-216, LMFA05000652, 2-(12-hydroxydodeca-5,10-diyn-1-yl)-3,5,6-trimethyl-1,4-benzoquinone, AKOS016009886, Tox21_110072_1, CCG-204122, LP00026, IDI1_002228, NCGC00015053-01, NCGC00015053-02, NCGC00015053-03, NCGC00015053-04, NCGC00015053-06, NCGC00015053-07, NCGC00015053-08, NCGC00015053-09, NCGC00015053-10, NCGC00024221-03, NCGC00024221-04, NCGC00024221-05, NCGC00024221-06, NCGC00260711-01, AN-25107, DB-056462, KB-220123, LS-177589, EU-0100026, FT-0641779, A 3711, C01349, D03882, AB00382986-12, C-19877, SR-01000000084, SR-01000000084-2, 2-[12-Hydroxydodeca-5,10-diynyl]-3,5,6-trimethyl-pbenzoquinone, 2,5-Cyclohexadiene-1,4-dione,2-(12-hydroxy-5,10-dodecadiyn-1-yl)-3,5,6-trimethyl-


ID: 2434

chemical graph of compound 2434



InChIKey: WDEMLQIGYYLRRX-OWVUFADGSA-N
SMILES: CCCN1CCC[C@H]2[C@H]1CC3=CN=C(N=C3C2)N.Cl.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 68728
synonyms found at PubChem are:
Quinelorane hydrochloride, Quinelorane dihydrochloride, Quinelorane HCl, 97548-97-5, UNII-JT5527J55O, Quinelorane hydrochloride [USAN], JT5527J55O, LY-163,502, LY 163502, Quinelorane hydrochloride (USAN), (5aR,9aR)-5,5a,6,7,8,9,9a,10-Octahydro-6-propylpyrido[2,3-g]quinazolin-2-amine dihydrochloride, (5ar,9ar)-6-propyl-5,5a,6,7,8,9,9a,10-octahydropyrido[2,3-g]quinazolin-2-amine dihydrochloride, AC1L2ABV, SCHEMBL1321195, CHEMBL1486918, CTK5H9391, MolPort-003-666-735, Tox21_501020, AKOS024456645, API0007821, CCG-222324, LP01020, Quinelorane dihydrochloride, crystalline, NCGC00261705-01, (-)-(5aR,9aR)-2-Amino-5,5a,6,7,8,9,9a,10-octahydro-6-propylpyrido(2,3-g)quinazoline dihydrochloride, (5aR-trans)-5,5a,6,7,8,9,9a,10-Octahydro-6-propylpyrido[2,3-g]quinazolin-2-amine dihydrochloride, LY163502, LS-192606, EU-0101020, Q-110, D05677, SR-01000075398, SR-01000075398-1, (5aR,9aR)-6-propyl-5a,7,8,9,9a,10-hexahydro-5H-pyrido[2,3-g]quinazolin-2-amine dihydrochloride, Pyrido(2,3-g)quinazolin-2-amine, 5,5a,6,7,8,9,9a,10-octahydro-6-propyl-, dihydrochloride, (5aR-trans)-


ID: 2435

chemical graph of compound 2435



InChIKey: WDFKMLRRRCGAKS-UHFFFAOYSA-N
SMILES: C1=CC2=C(C(=C(C=C2Cl)Cl)O)N=C1

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 2722
synonyms found at PubChem are:
chloroxine, 5,7-Dichloroquinolin-8-ol, 773-76-2, 5,7-Dichloro-8-hydroxyquinoline, Chlorquinol, Capitrol, Dichloroxin, Quixalin, Chloroxyquinoline, Dichloroquinolinol, Dikhloroskin, 5,7-Dichloro-8-quinolinol, Clofuzid, Endiaron, Quinolor, Dichlorohydroxyquinoline, Chlofucid, Quesyl, 5,7-Dichloroxine, 5,7-Dichlorooxine, Chlorohydroxyquinoline, 8-QUINOLINOL, 5,7-DICHLORO-, 5,7-Dichloro-8-oxyquinoline, Chloroxine [USAN], 5,7-Dichlor-8-hydroxychinolin, C9H5Cl2NO, NSC 3904, UNII-2I8BD50I8B, CCRIS 5751, CHQ, Capitrol Cream Shampoo, EINECS 212-258-3, BRN 0153606, 5,7-Dichlor-8-hydroxychinolin [German], SQ 16401, 2I8BD50I8B, 5,7-Dichloro-8-hydroquinoline, CHEBI:59477, NSC3904, WDFKMLRRRCGAKS-UHFFFAOYSA-N, Chloroxine (USAN), AS-229, NCGC00095264-01, DSSTox_CID_2801, DSSTox_RID_76734, DSSTox_GSID_22801, dichloroquine, CAS-773-76-2, SR-01000747474, 5,7-dichlorchinolin-8-ol, 5,7-Dichloro-8-hydroxy-quinoline, Capitrol (TN), PubChem21919, Spectrum_001434, 5,7-Dichloro-8-oxine, AC1L1EBH, AC1Q3LCR, Spectrum2_000687, Spectrum3_001156, Spectrum4_000744, Spectrum5_001444, Clioquinol EP Impurity B, 8-Quinolinol,7-dichloro-, ACMC-209p9h, D02HWP, cid_2722, SCHEMBL3350, Oprea1_486275, REGID_for_CID_2722, BSPBio_002711, KBioGR_001068, KBioSS_001914, 5-21-03-00286 (Beilstein Handbook Reference), KSC495K7R, MLS000681736, BIDD:GT0763, DivK1c_000578, SPECTRUM1503202, SPBio_000813, AC1Q78C4, ZINC1131, CHEMBL1200596, DTXSID5022801, BDBM32147, CTK3J5578, HMS501M20, KBio1_000578, KBio2_001914, KBio2_004482, KBio2_007050, KBio3_002211, KS-00000FNW, MolPort-000-510-505, NINDS_000578, 5,7-Dichloro-8-hydroxy gminoline, HMS1923K05, HMS2092N04, HMS2609A16, HMS3259E17, HMS3655G16, HMS3712O06, Pharmakon1600-01503202, Capitrol Cream Shampoo (Salt/Mix), component of Capitrol Cream Shampoo, HY-B0295, NSC-3904, 5,7-Dichloro-8-quinolinol, 99%, Tox21_111494, ANW-37011, CCG-40039, NSC758398, s1839, SBB039926, STK075368, AKOS000271338, Tox21_111494_1, AC-4820, CS-2324, DB01243, MCULE-3987057340, NC00505, NSC-758398, RTR-024734, TRA0059012, IDI1_000578, UPCMLD0ENAT5752182:001, NCGC00095264-02, NCGC00095264-03, NCGC00095264-04, NCGC00095264-05, AJ-07968, AN-11572, CJ-00031, CPD000312779, SAM002554895, SC-75357, SMR000312779, TG2-36-1, ZB000256, SBI-0051782.P002, AB2000325, LS-142531, TR-024734, A9795, D0412, FT-0623709, ST24029249, ST50160577, D03472, AB00052323-08, AB00052323_09, AB00052323_10, I01-1897, SR-01000747474-2, SR-01000747474-3, W-104320, BRD-K17075857-001-06-9, F0918-0943, UNII-Z7Z4BX535U component WDFKMLRRRCGAKS-UHFFFAOYSA-N


ID: 2436

chemical graph of compound 2436



InChIKey: WDGFFVCWBZVLCE-UHFFFAOYSA-N
SMILES: C1=CC(=O)C(=C2C(=C1)C=C(C(=C2O)O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5281571
synonyms found at PubChem are:
purpurogallin, 569-77-7, Purpurogalline, 2,3,4,6-tetrahydroxy-5H-benzo[7]annulen-5-one, 2,3,4,6-Tetrahydroxybenzocyclohepten-5-one, MLS000738105, UNII-L3Z7U4N28P, 2,3,4,6-Tetrahydroxy-5H-benzocycloheptene-5-one, SMR000393869, CHEMBL66953, CHEBI:8647, L3Z7U4N28P, WDGFFVCWBZVLCE-UHFFFAOYSA-N, NSC35676, NSC646653, 2,3,4,5-tetrahydroxy-6-benzo[7]annulenone, 2,3,4,5-tetrahydroxybenzo[7]annulen-6-one, 2,3,4,5-tetrakis(oxidanyl)benzo[7]annulen-6-one, 2,3,4,6-Tetrahydroxy-5H-benzo[a]cyclohepten-5-one, 5H-Benzocyclohepten-5-one, 2,3,4,6-tetrahydroxy-, 5H-BENZOCYCLOHEPTENE-5-ONE, 2,3,4,6-TETRAHYDROXY-, SR-01000759730, CCRIS 8139, 3tiy, Hit compound, 2, TIY, AC1NQYND, Spectrum_000348, SpecPlus_000311, Spectrum2_000582, Spectrum3_000692, Spectrum4_001547, Spectrum5_000114, D0R7MJ, Oprea1_685478, SCHEMBL33853, BSPBio_002443, KBioGR_002014, KBioSS_000828, SPECTRUM210505, 4-08-00-03456 (Beilstein Handbook Reference), BIDD:ER0545, DivK1c_006407, SPBio_000424, BDBM50647, cid_5281571, KBio1_001351, KBio2_000828, KBio2_003396, KBio2_005964, KBio3_001663, DTXSID40205436, MolPort-000-860-961, HMS1923C07, HMS2764L19, KUC106430N, ALBB-023660, BB_NC-00241, ZX-AN022174, BBL027451, BDBM50088360, CCG-38505, NSC-35676, STL372771, ZINC13132551, AKOS000276797, HBL0000245, KSC-12-239, MCULE-5310309390, NSC-646653, SDCCGMLS-0066536.P001, NCGC00095229-01, NCGC00095229-02, NCGC00095229-03, NCGC00095229-04, NCGC00178652-01, CC-34071, AB0126399, 2,3,4,5-tetrahydroxybenzocyclohepten-6-one, 2,3,4,6-tetrahydroxybenzo[7]annulen-5-one, FT-0632410, R1092, ST45021944, C09964, 2,7,8,9-tetrahydroxybenzo[a][7]annulen-1-one, 5H-Benzocyclohepten-5-one,3,4,6-tetrahydroxy-, A831270, C-12145, SR-01000759730-2, SR-01000759730-3, BRD-K31023358-001-02-4, BRD-K31023358-001-06-5, BRD-K31023358-001-10-7, BRD-K31023358-001-16-4, I14-55770, 2,3,4,6-Tetrahydroxy-5H-benzo[a]cyclohepten-5-one #, (6E,8Z)-2,3,4,6-tetrahydroxy-5H-benzo[7]annulen-5-one, 5H-Benzocyclohepten-5-one, 2,3,4,6-tetrahydroxy- (8CI)(9CI)


ID: 2437

chemical graph of compound 2437



InChIKey: WDHLJEOPUWGKKG-UHFFFAOYSA-N
SMILES: COC1=C(C(=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3)O)OC)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6710647
synonyms found at PubChem are:
khrinone E, KOPARIN 2'-METHYL ETHER, KBio2_006341, Spectrum_000725, AC1O8JTX, Spectrum2_000813, Spectrum3_000178, Spectrum4_001609, Spectrum5_000337, BSPBio_001675, KBioGR_001957, KBioSS_001205, SPECTRUM200416, SPBio_000705, CHEMBL1079959, KBio2_001205, KBio2_003773, KBio3_001175, CHEBI:107658, CCG-39058, NCGC00095957-01, NCGC00095957-02, NCGC00095957-03, NCGC00179098-01, BRD-K43224838-001-02-4, 7-hydroxy-3-(3-hydroxy-2,4-dimethoxyphenyl)chromen-4-one


ID: 2438

chemical graph of compound 2438



InChIKey: WDISRLXRMMTXEV-UHFFFAOYSA-N
SMILES: COC1=C(C=CC(=C1)NS(=O)(=O)C)NC2=C3C=CC=CC3=NC4=CC=CC=C42.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 148673
synonyms found at PubChem are:
Amsacrine hydrochloride, 54301-15-4, m-Amsa hydrochloride, M-Amsacrine, Amsacrine (hydrochloride), UNII-U66HX4K4CO, NCI-C03190, U66HX4K4CO, NSC 141549, METHANESULFON-M-ANISIDIDE 4'-(9-ACRIDINYLAMINO)-,, NCGC00093644-01, 4'-(9-Acridinylamino)methanesulfon-m-aniside monohydrochloride, 4-(9-Acridinylamino)-N-(methanesulfonyl)-m-anisidine hydrochloride, Methanesulfon-m-anisidine, 4'-((9-acridinyl)amino)-, hydrochloride, Methanesulfone-m-anisidine-4'-((9-acridinyl)amino) hydrochloride, Methanesulfonyl-m-anisidine, 4'-(9-acridinylamino)-, monohydrochloride, N-(4-(9-Acridinylamino)-3-methoxyphenyl)-methanesulfonamide monohydrochloride, N-(4-(9-Acridinylamino)-3-methoxyphenyl)methanesulfonamidemonohydrochloride, MLS002153376, Methanesulfon-m-anisidide, 4'-(9-acridinylamino)-, monohydrochloride, SMR000875352, C21H19N3O3S.ClH, CCRIS 9342, Methanesulfone-m-anisidine-4'-[(9-acridinyl)amino] hydrochloride, Amsacrine HCl, AC1L3XLK, DSSTox_CID_17186, DSSTox_RID_79305, DSSTox_GSID_37186, SCHEMBL1320825, CHEMBL1256655, DTXSID2037186, AOB4198, Tox21_111212, Tox21_500154, 3442AH, HY-13551A, MFCD07799963, NSC141549, AKOS030526157, CCG-221458, CS-1943, INB0000947, LP00154, Methanesulfonamide, N-(4-(9-acridinylamino)-3-methoxyphenyl)-, monohydrochloride (9CI), Methansulfon-m-aniside, monohydrochloride, NCGC00260839-01, AN-40565, LS-90297, CAS-54301-15-4, EU-0100154, FT-0658261, A 9809, Amsacrine hydrochloride, >=98% (TLC), powder, SR-01000075699, SR-01000075699-1, N-[4-(acridin-9-ylamino)-3-methoxy-phenyl]methanesulfonamide hydrochloride, N-[4-(acridin-9-ylamino)-3-methoxyphenyl]methanesulfonamide hydrochloride, Methanesulfonamide, N-(4-(9-acridinylamino)-3-methoxyphenyl)-, monohydrochloride, N-(4-(9-ACRIDINYLAMINO)-3-METHOXYPHENYL)METHANESULFONAMIDE MONOHYDROCHLORIDE, AMSA hydrochloride;m-AMSA hydrochloride;CI-880 hydrochloride;SN-11841 hydrochloride;acridinyl anisidide hydrochloride, AKOS015896417, A830090, I06-2001, N-[4-(9-acridinylamino)-3-methoxyphenyl]methanesulfonamide; hydron; chloride, N-[4-(acridin-9-ylamino)-3-methoxy-phenyl]methanesulfonamide; hydron; chloride


ID: 2439

chemical graph of compound 2439



InChIKey: WDJHSQZCZGPGAA-UHFFFAOYSA-N
SMILES: CC(=NCC1=CC(=CC=C1)CN)N.Cl.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 2733515
synonyms found at PubChem are:
1400W dihydrochloride, 214358-33-5, 1400 W, 1400W (dihydrochloride), n-(3-(aminomethyl)benzyl)acetamidine dihydrochloride, N-(3-(Aminomethyl)Benzyl)Acetimidamide Dihydrochloride, N-(3-Aminomethyl)benzylacetamidine, 2HCl, N-[[3-(AMINOMETHYL)PHENYL]METHYL]-ETHANIMIDAMIDE DIHYDROCHLORIDE, CHEMBL544788, SR-01000076199, AC1MBZ2X, 1400W dihydrochloride, EU-0101258, SCHEMBL3115594, 1400 W DIHYDROCHLORIDE, 1400W 2HCl, CTK8E9562, MolPort-003-824-907, WDJHSQZCZGPGAA-UHFFFAOYSA-N, EX-A1262, 1204AH, BS0225, IN2004, s8337, AKOS024456584, CS-6983, TRA0076918, 1400W dihydrochloride, >98%, solid, NCGC00094497-01, HY-18731, RT-006548, B6730, FT-0661894, ST50825934, 1400-W, W 4262, J-014060, SR-01000076199-1, SR-01000076199-3, I14-90556, N-([3-(Aminomethyl)phenyl]methyl)ethanimidamide dihydrochloride, {[3-(aminomethyl)phenyl]methyl}(iminoethyl)amine, chloride, chloride, N'-[[3-(aminomethyl)phenyl]methyl]ethanimidamide dihydrochloride


ID: 2440

chemical graph of compound 2440



InChIKey: WDQPAMHFFCXSNU-UHFFFAOYSA-N
SMILES: CC(C)N=C1C=C2C(=NC3=CC=CC=C3N2C4=CC=C(C=C4)Cl)C=C1NC5=CC=C(C=C5)Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 2794
synonyms found at PubChem are:
clofazimine, 2030-63-9, Lamprene, Lampren, Chlofazimine, Clofazimina, Clofaziminum, B 663 (Pharmaceutical), Clofaziminum [INN-Latin], Clofazimina [INN-Spanish], B-663, NSC-141046, G 30320, Riminophenazine, UNII-D959AE5USF, B 663 (VAN), Lamprene (TN), C27H22Cl2N4, 3-(p-Chloranilino)-10-(p-chlorphenyl)-2,10-dihydro-2-(isopropylimino)-phenazin, Clofazimine [USAN:INN:BAN], B 663, 3-(p-Chloranilino)-10-(p-chlorophenyl)-2,10-dihydro-2-(isopropylimino)-phenazine, 3-(p-Chloroanilino)-10-(p-chlorophenyl)-2,10-dihydro-2-(isopropylimino)phenazine, B 663, pharmaceutical, EINECS 217-980-2, NSC 141046, BRN 0060420, D959AE5USF, Clofazimine (JAN/USP/INN), CHEBI:3749, N,5-bis(4-chlorophenyl)-3-propan-2-yliminophenazin-2-amine, CHEMBL1083384, Liposome-encapsulated clofazimine, G-30320, G-30,320, 2-Phenazinamine, 3,5-dihydro-N,5-bis(4-chlorophenyl)-3-((1-methylethyl)imino)-, 2-Phenazinamine, N,5-bis(4-chlorophenyl)-3,5-dihydro-3-((1-methylethyl)imino)-, N,5-Bis(4-chlorophenyl)-3,5-dihydro-3-[(1-methylethyl)imino]-2-phenazinamine, NSC141046, 3-(p-Chloranilino)-10-(p-chlorphenyl)-2,10-dihydro-2-(isopropylimino)-phenazin [German], Phenazine, 2,10-dihydro-3-(p-chloroanilino)-10-(p-chlorophenyl)-2-(isopropylimino)-, Phenazine, 3-(p-chloroanilino)-10-(p-chlorophenyl)-2,10-dihydro-2-(isopropylimino)-, SMP2_000339, NCGC00016600-01, CPD000058704, CAS-2030-63-9, N,5-Bis(4-chlorophenyl)-3,5-dihydro-3-(isopropylimino)phenazin-2-amine, B. 663, N,5-bis(4-chlorophenyl)-3-(propan-2-ylimino)-3,5-dihydrophenazin-2-amine, 2-Phenazinamine, N,5-bis(4-chlorophenyl)-3,5-dihydro-3-[(1-methylethyl)imino]-, 3-(p-Chloranilino)-10-(p-chlorophenyl)-2,10-dihydro-2-(isopropylimino)phenazine, (E)-N,5-bis(4-chlorophenyl)-3-(isopropylimino)-3,5-dihydrophenazin-2-amine, N,5-Bis(4-chlorophenyl)-3,5-dihydro-3-(1-methylethyl)imino)-2-phenazinamine, N,5-Bis(4-chlorophenyl)-3,5-dihydro-3-(isopropyliaino)phenazin-2-amine, N,5-bis(4-chlorophenyl)-3-[(propan-2-yl)imino]-3,5-dihydrophenazin-2-amine, (3Z)-N,5-bis(4-chlorophenyl)-3-[(1-methylethyl)imino]-3,5-dihydrophenazin-2-amine, CFZ, SMR000058704, SR-05000001807, Clofazimin, (3E)-N,5-bis(4-chlorophenyl)-3-isopropylimino-phenazin-2-amine, Clofazimine [USAN:USP:INN:BAN], Prestwick_685, (non-d)Clofazimine-d7, B663, AC1L1EHE, Prestwick0_000376, Prestwick1_000376, Prestwick2_000376, Prestwick3_000376, DSSTox_CID_2839, D07NPR, D0S5UH, cid_2794, CHEMBL1292, DSSTox_RID_76752, BIDD:PXR0147, DSSTox_GSID_22839, SCHEMBL26757, SCHEMBL26758, BSPBio_000531, 4-25-00-03033 (Beilstein Handbook Reference), MLS000028617, MLS001424318, MLS006010789, SPBio_002452, BPBio1_000585, GTPL9184, SCHEMBL5663361, CHEMBL1369407, DTXSID7022839, CTK6H0611, MolPort-003-940-861, MolPort-042-621-745, WDQPAMHFFCXSNU-KRUMMXJUSA-N, HMS1569K13, HMS2052B05, HMS2093J10, HMS2096K13, HMS2231B04, HMS3370N05, HMS3394B05, HMS3652A16, HMS3713K13, KUC109573N, Pharmakon1600-01505974, BCP07792, HY-B1046, KS-00000XN9, KSC-27-052A, Tox21_110516, BDBM50318909, BDBM50378783, MFCD00056793, MMV687800, NSC759283, s4107, ZINC17953024, AKOS015896438, AKOS026749881, ZINC100037101, ZINC253916263, CCG-101159, CS-4567, DB00845, KS-1412, MCULE-1387160272, NC00409, NSC-759283, Riminophenazine (tuberculosis infection), NCGC00016600-02, NCGC00016600-03, NCGC00016600-04, NCGC00016600-05, NCGC00016600-07, NCGC00179529-01, AN-16626, SAM001246878, SC-47057, SMR004701474, Phenazine,10-dihydro-2-(isopropylimino)-, SBI-0206865.P001, LS-103014, FT-0657414, ST51014966, Z3118, C06915, D00278, 030C639, A814428, I06-1891, J-013203, SR-05000001807-1, SR-05000001807-2, BRD-K56614220-001-10-9, Z2037279473, Clofazimine, European Pharmacopoeia (EP) Reference Standard, N,5-bis(4-chlorophenyl)-3-isopropylimino-phenazin-2-amine, N,5-bis(4-chlorophenyl)-3-propan-2-ylimino-2-phenazinamine, N,5-bis(4-chlorophenyl)-3-propan-2-ylimino-phenazin-2-amine, Clofazimine, United States Pharmacopeia (USP) Reference Standard, 2-p-Chloranilino-5-p-chlorphenyl-3,5-dihydro-3-isopropylimino-phenazin, 2-p-chloroanilino-5-p-chlorophenyl-3,5-dihydro-3-isopropyliminophenazine, N,5-bis(4-chlorophenyl)-3-(isopropylimino)-3,5-dihydrophenazin-2-amine, (4-Chloro-phenyl)-[5-(4-chloro-phenyl)-3-isopropylimino-3,5-dihydro-phenazin-2-yl]-amine, 2-Phenazinamine,5-bis(4-chlorophenyl)-3,5-dihydro-3-[(1-methylethyl)imino]-, 2-Phenazinamine,5-dihydro-N,5-bis(4-chlorophenyl)-3-[(1-methylethyl)imino]-, Clofazimine for system suitability, European Pharmacopoeia (EP) Reference Standard, N,5-Bis(4-chlorophenyl)-3-([1-methylethyl]imino)-3,5-dihydro-2-phenazinamine #, Phenazine,10-dihydro-3-(p-chloroanilino)-10-(p-chlorophenyl)-2-(isopropylimino)-, Riminophenazine (tuberculosis infection), TB Alliance/IMM/BTTTRI/University of Illinois, (4-chlorophenyl)[5-(4-chlorophenyl)-3-(2-methyl-1-azapropylidene)(5-hydrophena zin-2-yl)]amine, Riminophenazines (Mycobacterium tuberculosis infection), The Global Alliance for TB Drug Development/Institute of Materia Medica


ID: 2441

chemical graph of compound 2441



InChIKey: WDRYRZXSPDWGEB-UHFFFAOYSA-N
SMILES: C1=CC=C2C(=C1)C(=NN2CC3=C(C=C(C=C3)Cl)Cl)C(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 39562
synonyms found at PubChem are:
lonidamine, 50264-69-2, Diclondazolic acid, 1-(2,4-Dichlorobenzyl)-1H-indazole-3-carboxylic acid, Doridamina, Lonidamina, Lonidaminum, Lonidamin, Lonidaminum [INN-Latin], AF 1890, Lonidamina [INN-Spanish], 1-[(2,4-dichlorophenyl)methyl]-1H-indazole-3-carboxylic acid, Lonidamine [BAN:INN], 1-(2,4-Dichlorbenzyl)-indazole-3-carboxylic acid, Doridamina (TN), Dichlondazolic acid, UNII-U78804BIDR, Lonidamine (INN), CCRIS 3516, 1-(2,4-dichlorobenzyl)indazole-3-carboxylic acid, 1-[(2,4-dichlorophenyl)methyl]indazole-3-carboxylic acid, EINECS 256-510-0, AF-1890, BRN 0894483, C15H10Cl2N2O2, MLS000028822, U78804BIDR, CHEBI:50138, KN-228, TH-070, NCGC00015609-03, SMR000058467, 1H-Indazole-3-carboxylic acid, 1-((2,4-dichlorophenyl)methyl)-, 1H-Indazole-3-carboxylic acid, 1-[(2,4-dichlorophenyl)methyl]-, DSSTox_CID_782, L 4900, DSSTox_RID_75787, DSSTox_GSID_20782, Q-201318, 1H-Indazole-3-carboxylic acid, 1-(2,4-dichlorobenzyl)-, 1H-Indazole-3-carboxylicacid, 1-[(2,4-dichlorophenyl)methyl]-, CAS-50264-69-2, Lonidamine [INN:BAN], SR-01000075961, Tocris-1646, Lopac-L-4900, D09SIR, AC1L21YG, SCHEMBL7134, Lopac0_000718, cid_39562, ZINC1632, CHEMBL1257030, DTXSID5020782, BDBM59775, CTK1H1686, KS-00000XLL, BIL0844, MolPort-003-957-796, WDRYRZXSPDWGEB-UHFFFAOYSA-N, ZX-AFC001293, HMS2234H24, HMS3262O17, HMS3268K09, HMS3369I01, HMS3651F09, Pharmakon1600-01503225, ACT02617, BCP06555, HY-B0486, Tox21_110181, Tox21_202306, Tox21_500718, MFCD00866285, NSC741419, NSC758419, s2610, AKOS012842739, Tox21_110181_1, AC-5626, API0003207, CCG-204803, CS-2602, LP00718, LS-7474, NSC-741419, NSC-758419, NCGC00015609-01, NCGC00015609-02, NCGC00015609-04, NCGC00015609-05, NCGC00015609-06, NCGC00015609-07, NCGC00015609-08, NCGC00015609-09, NCGC00025244-01, NCGC00025244-02, NCGC00025244-03, NCGC00259855-01, NCGC00261403-01, AJ-08062, AN-10756, AS-11653, BC213253, BR-73119, SC-75962, SBI-0050696.P002, AB0010495, AB2000699, AX8006155, ST2414921, TR-017970, 4CH-014644, AM20060642, EU-0100718, FT-0650359, Lonidamine, mitochondrial hexokinase inhibitor, D07257, J90044, S-4929, AB00597141_08, AB00597141_10, 264L692, I01-0912, SR-01000075961-1, SR-01000075961-3, SR-01000075961-6, BRD-K78513633-001-03-3, BRD-K78513633-001-06-6, 1-(2,4-dichlorobenzyl)-1-H-indazole-3-carboxylic acid, Z1741977188, 1-[(2,4-dichlorophenyl)methyl]-3-indazolecarboxylic acid, 1-[(2,4-DICHLOROPHENYL)METHYL]-1H-INDAZOLE-3-CARBO, 1H-Indazole-3-carboxylic acid, 1-((2,4-dichlorophenyl)methyl)- (9CI), 1H-Indazole-3-carboxylic acid, 1-((2,4-dichlorophenyl)methyl)-(9CI), 57571-43-4


ID: 2442

chemical graph of compound 2442



InChIKey: WDSCBUNMANHPFH-UHFFFAOYSA-N
SMILES: CC(=O)NCCCCCC(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 2005
synonyms found at PubChem are:
6-Acetamidohexanoic acid, acexamic acid, 57-08-9, 6-(Acetylamino)hexanoic acid, 6-Acetamidocaproic acid, Plastenan, Acetaminocaproic acid, Acide acexamique, Hexanoic acid, 6-(acetylamino)-, AEAH (base), Acemin, epsilon-Acetamidocaproic acid, CY 153, 6-Acetamidohexansaeure, N-Acetyl-.epsilon.-aminocaproic acid, NSC 12945, N-Acetyl-6-aminohexanoic acid, 6-Acetylaminohexansaeure, 6-Acetymidohexanoic acid, UNII-7IC4BO7D3R, zinc acexamate, .epsilon.-Acetamidocaproic acid, Acide acexamique [INN-French], Acido acexamico [INN-Spanish], Acidum acexamicum [INN-Latin], sodium acexamate, Calcium acexamate, 6-Acetylaminocaproic acid, EINECS 200-310-8, HEXANOIC ACID, 6-ACETAMIDO-, 6-Acetamino hexanoic acid, 7IC4BO7D3R, CY168E, WDSCBUNMANHPFH-UHFFFAOYSA-N, NCGC00094990-01, DSSTox_CID_25879, DSSTox_RID_81195, DSSTox_GSID_45879, 6-Acetaminocaproic acid, Acido acexamico, Acidum acexamicum, CAS-57-08-9, 36392-66-2, Acexamic acid [INN:DCF], Celuton, Acexamic acid [INN:BAN:DCF], AACA, Acexamic acid (INN), 6-Acetamidohexanoicacid, Spectrum_001280, AC1L1CPR, Spectrum2_000853, Spectrum3_000949, Spectrum4_001062, Spectrum5_001172, 6-acetamido hexanoic acid, 6-Acetylaminohexanoic acid, ACMC-1AOM0, AC1Q1L6J, AC1Q5P9U, WLN: QV5MV1, SCHEMBL24435, KBioGR_001384, KBioSS_001760, KSC223G9L, MLS002207271, DivK1c_000473, epsilon-acetylaminocaproic acid, N-acetylamino-6-hexanoic acid, SPECTRUM1503045, SPBio_000865, 6-Acetamidohexanoic acid, 99%, CHEMBL2105922, DTXSID1045879, CTK1C3395, epsilon-N-acetylaminocaproic acid, HMS501H15, KBio1_000473, KBio2_001760, KBio2_004328, KBio2_006896, KBio3_002018, KS-00000XFE, NAS-501, CHEBI:134808, MolPort-001-779-536, NINDS_000473, HMS1922A17, Pharmakon1600-01503045, 36392-66-2 (calcium salt), HY-B1259, NSC12945, ZINC1683177, Tox21_111377, CCG-40313, CY-153, MFCD00004424, NSC-12945, NSC758219, s4534, SBB065849, Hexanoic acid, 6-acetamido- (8CI), AKOS000263977, Tox21_111377_1, CS-4812, MCULE-2324288602, NE10315, NSC-758219, IDI1_000473, 7234-48-2 (mono-hydrochloride salt), NCGC00094990-02, NCGC00094990-04, AJ-29738, Hexanoic acid, 6-(acetylamino)- (9CI), KB-44547, R631, SMR000059014, 3,5-Dimethyl-4-hydroxybenzaldehyde, 98%, SBI-0051755.P002, DB-053005, LS-175794, RT-001353, EU-0033936, FT-0620890, ST50825044, D07074, AB00052304_02, SR-01000872742, I04-0531, SR-01000872742-1, W-105488, N-Acetyl-|A-aminocaproic | inverted exclamation markcid


ID: 2443

chemical graph of compound 2443



InChIKey: WDXRGPWQVHZTQJ-XCTJHIRPSA-N
SMILES: C/C=C/1\C(=O)CC2[C@@]1(CCC3C2CCC4=CC(=O)CC[C@]34C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6510278
synonyms found at PubChem are:
(Z)-Gugglesterone, GS, trans-, Z-Guggulsterone, trans-4,17(20)-Pregnadiene-3,16-dione, Cis-Guggulsterone, (17Z)-Guggulsterone, AC1O6WRG, Pregna-4,17(20)-diene-3,16-dione, (17Z)-, Lopac0_000433, SCHEMBL258031, CHEMBL372106, SCHEMBL12858540, WDXRGPWQVHZTQJ-XCTJHIRPSA-N, CCG-204525, 4,17(20)-cis-Pregnadiene-3,6-dione, NCGC00093854-01, NCGC00093854-02, NCGC00093854-03, EU-0100433, G 5168, SR-01000075837, SR-01000075837-1, (10R,13S,17Z)-17-ethylidene-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15-decahydrocyclopenta[a]phenanthrene-3,16-dione


ID: 2444

chemical graph of compound 2444



InChIKey: WEEFNMFMNMASJY-UHFFFAOYSA-M
SMILES: C[N+]1=C2C(=C3C=CC(=C(C3=C1)OC)OC)C=CC4=CC5=C(C=C42)OCO5.[Cl-]

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 72311
synonyms found at PubChem are:
Chelerythrine chloride, 3895-92-9, Chelerythrine hydrochloride, Chelerythrinechloride, UNII-7IC98TZ0PZ, 1,2-Dimethoxy-12-methyl-[1,3]dioxolo[4',5':4,5]benzo[1,2-c]phenanthridin-12-ium chloride, Chelerythrine, chloride, EINECS 223-444-9, NSC 36405, 7IC98TZ0PZ, CHEMBL258893, Q-100414, Q-200824, 1,2-Dimethoxy-N-methyl-[1,3]-benzodioxolo[5,6c]phenanthridinium, C21H18ClNO4, 1,2-Dimethoxy-12-methyl(1,3)benzodioxolo(5,6-c)phenanthridinium chloride, 1,2-Dimethoxy-12-methyl[1,3]benzodioxolo[5,6-c]phenanthridinium chloride, Chelerythrine HCl, 1,2-Dimethoxy-12-methyl-[1,3]dioxolo[4',5':4,5]-benzo[1,2-c]phenanthridin-12-ium chloride, C21H18NO4, chelerythrine chlorid, 34316-15-9 (Parent), NSC646662, 1,2-Dimethoxy-N-methyl(1,3)benzodioxolo(5,6-c)phenanthridinium chloride, SR-01000075750, Chelerythrine cloride, Chelerythrine, hydroxide, hydrochloride, Chelerythrine, hydrochloride, AC1L2HU4, AC1Q1SO4, SCHEMBL195109, KS-00001CVS, BIC1008, MolPort-003-983-741, ZX-AFC001509, BCPP000287, HMS3229C07, HMS3260B04, NSC36405, Tox21_500241, GP2808, MFCD00060717, NSC-36405, AKOS016010038, BCP9000516, CCG-206741, CS-0205, LP00241, NSC-646662, (1,3)Benzodioxolo(5,6-c)phenanthridinium, 1,2-dimethoxy-12-methyl-, chloride, (1,3)Benzodioxolo(5,6-c)phenanthridinium, 1,2-dimethoxy-12-methyl-, chloride (9CI), NCGC00093703-01, NCGC00260926-01, AK115162, AS-17480, HY-12048, LS-52942, SC-76777, BCP0726000282, AX8120561, KB-216331, 4CH-024642, EU-0100241, FT-0602998, ST24036719, V0358, Chelerythrine, hydroxide, hydrochloride (8CI), C 2932, W-5057, 1,2-Dimethoxy-12-methyl-[1,3]dioxolo[4',5', C-21392, Q-200825, SR-01000075750-1, [1,6-c]phenanthridinium, 1,2-dimethoxy-12-methyl-, chloride, 1,2-DIMETHOXY-N-METHYL-[1,3]BENZODIOXOLO[5,6-C]PHE, 1,2-dimethoxy-12-methyl[1,3]benzodioxolo[5,6-c]phenanthridiniumchloride, 1,2-dimethoxy-n-methyl-[1,3]benzodioxolo[5,6-c]phenanthridinium chloride, 1,2-dimethoxy-12-methyl-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium chloride, 1,2-Dimethoxy-12-methyl-[1,3]dioxolo[4\',5\':4,5]benzo[1,2-c]phenanthridin-12-ium chloride


ID: 2445

chemical graph of compound 2445



InChIKey: WEEGYLXZBRQIMU-UHFFFAOYSA-N
SMILES: CC1(C2CCC(O1)(CC2)C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 2758
synonyms found at PubChem are:
Eucalyptol, cineole, 1,8-Cineole, 1,8-Cineol, Cajeputol, 1,8-Epoxy-p-menthane, 470-82-6, Eucalyptole, Zineol, Eucapur, Terpan, p-Cineole, 1,8-Oxido-p-menthane, 1,3,3-Trimethyl-2-oxabicyclo[2.2.2]octane, Eukalyptol, CINEOL, Cucalyptol, Eukalyptol [Czech], Soledum, Eucalyptol (natural), Zedoary oil, p-Menthane, 1,8-epoxy-, Cineole (VAN), EUCALYPTUS OIL, 2-Oxabicyclo[2.2.2]octane, 1,3,3-trimethyl-, Eucalyptol [USAN], NCI-C56575, UNII-RV6J6604TK, FEMA No. 2465, NSC 6171, 1,3,3-Trimethyl-2-oxabicyclo(2.2.2)octane, 2-Oxa-1,3,3-trimethylbicyclo(2.2.2)octane, Eucalyptol (USAN), 2-Oxabicyclo(2.2.2)octane, 1,3,3-trimethyl-, CCRIS 3727, HSDB 991, Cineole (Eucalyptol), NSC6171, 2,2,4-trimethyl-3-oxabicyclo[2.2.2]octane, 2-Oxa-1,3,3-trimethylbicyclo[2.2.2]octane, EINECS 207-431-5, Cineolum, BIDD:ER0481, AI3-00578, RV6J6604TK, CNL, 4,7,7-trimethyl-8-oxabicyclo[2.2.2]octane, CHEBI:27961, WEEGYLXZBRQIMU-UHFFFAOYSA-N, 8000-48-4, NCGC00091666-01, NCGC00091666-04, WLN: T66 A B AOTJ B1 B1 F1, DSSTox_CID_616, DSSTox_RID_75692, DSSTox_GSID_20616, W-106080, CAS-470-82-6, SMR000471853, Eucalyptol [USAN:USP], (1s,4s)-1,3,3-trimethyl-2-oxabicyclo[2.2.2]octane, eucaliptol, eucalytol, Eucalyptol,(S), 1.8-cineole, Eucalyptol, 99%, Eucalyptol, Ph Helv, p-Menthane,8-epoxy-, 1,8-Cineol;, AC1L1EEE, Spectrum2_000221, Spectrum3_000683, Spectrum4_001747, Spectrum5_000704, 1,8-cineol (eucalyptol), bmse000523, D05YAR, EC 207-431-5, Casella-med brand of cineole, SCHEMBL19622, SCHEMBL41020, BSPBio_002405, KBioGR_002194, MLS001050089, MLS001066338, DivK1c_000333, SPECTRUM1500294, SPBio_000261, Eucalyptol, analytical standard, CHEMBL485259, GTPL2464, CHEMBL1231862, CHEMBL1397305, DTXSID4020616, SCHEMBL13554591, SCHEMBL17836873, CTK6B3326, HMS501A15, KBio1_000333, KBio3_001625, MolPort-039-339-173, NINDS_000333, HMS2271P04, Pharmakon1600-01500294, ZINC967566, p-Menthane, 1,8-epoxy- (VAN), HY-N0066, NSC-6171, Tox21_111161, Tox21_202090, Tox21_302902, 5750AF, CCG-36080, LS-128, MFCD00167977, NSC760388, SBB057535, Acylated oxime isatin derivative, 19, AKOS015903223, AKOS016034339, Tox21_111161_1, CS-8146, DB03852, FCH1679459, LMPR0102090019, NSC-760388, IDI1_000333, Eucalyptol, tested according to Ph.Eur., NCGC00091666-02, NCGC00091666-03, NCGC00091666-05, NCGC00095774-01, NCGC00178671-01, NCGC00256479-01, NCGC00259639-01, AC-20234, AN-23469, Eucalyptol, natural, >=99%, FCC, FG, KB-51836, NCI60_005108, SC-47256, ST096004, 1,3-Trimethyl-2-oxabicyclo[2.2.2]octane, 2-Oxa-1,3-trimethylbicyclo[2.2.2]octane, TR-017465, 2-Oxabicyclo[2.2.2]octane,3,3-trimethyl-, FT-0607033, FT-0626369, 1,3,3-Trimethyl-2-oxabicyclo[2,2,2]octan, 1,3,3-trimethyl-2-oxabicyclo[2,2,2]octane, 1,3,3-trimethyl-2-oxabicyclo[2.2.2]octan, A19469, C09844, D04115, {1,3,3-Trimethyl-2-oxabicyclo[2.2.2]octane}, {2-Oxa-1,3,3-trimethylbicyclo[2.2.2]octane}, AB01563262_01, SR-01000763816, {2-Oxabicyclo[2.2.2]octane,} 1,3,3-trimethyl-, SR-01000763816-2, 1,8-Cineole, primary pharmaceutical reference standard, I14-18994, Cineole, European Pharmacopoeia (EP) Reference Standard, Eucalyptol, certified reference material, TraceCERT(R), F0001-1260, Eucalyptol Solution, 1000 mg/L, (RM, ISO GUIDE 34), 1,3,3-trimethyl-2-oxabicyclo[2.2.2]octane (ACD/Name 4.0), Eucalyptol, United States Pharmacopeia (USP) Reference Standard, Eucalyptol (cineole), Pharmaceutical Secondary Standard; Certified Reference Material, InChI=1/C10H18O/c1-9(2)8-4-6-10(3,11-9)7-5-8/h8H,4-7H2,1-3H, 10458-11-4, 8024-52-0, 8024-53-1, 855347-23-8


ID: 2446

chemical graph of compound 2446



InChIKey: WEJZLJFKUYPPDV-UHFFFAOYSA-N
SMILES: COC1=CC2=C(C=C1)C=C3C4=CC(=C(C=C4OCC3(O2)O)OC)OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 4620898
synonyms found at PubChem are:
12a-HYDROXY-5-DEOXYDEHYDROMUNDUSERONE, KBio3_001768, Spectrum_001219, SpecPlus_000231, AC1NEP3H, Spectrum2_001717, Spectrum3_000884, Spectrum4_000976, Spectrum5_001825, KBioGR_001351, KBioSS_001699, SPECTRUM202175, DivK1c_006327, SPBio_001734, CHEMBL1513686, KBio1_001271, KBio2_001699, KBio2_004267, KBio2_006835, CCG-38788, SDCCGMLS-0066939.P001, QTL1_000058, NCGC00095825-01, SR-05000002604, SR-05000002604-1, 2,3,9-trimethoxy-6H-chromeno[3,4-b]chromen-6a-ol, BRD-A59471422-001-02-6


ID: 2447

chemical graph of compound 2447



InChIKey: WEQAYVWKMWHEJO-UHFFFAOYSA-N
SMILES: CN1C(S(=O)(=O)CCC1=O)C2=CC=C(C=C2)Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 2717
synonyms found at PubChem are:
chlormezanone, 80-77-3, Chlormethazanone, Trancopal, Chlormethazone, Chlormezanon, Clormetazanone, Clormetazon, Phenarol, dl-Chlormezanone, Clorilax, Miorilax, Myolespen, Rilansyl, Rilaquil, Rilassol, Supotran, Trancote, Alinam, Banabin, Bisina, Tanafol, Rexan, Rilax, Banabin-sintyal, Muskel-Trancopal, Mio-sed, Chlormezanonum, Banabil-sintyal, 2-(4-Chlorophenyl)-3-methyl-1,3-thiazinan-4-one 1,1-dioxide, Tranrilax, Dichloromezanone, Clormezanone [DCIT], Clormezanona, Clormezanone, Chlomedinon, Rillasol, Suprotan, Muskel, Lobak, (+-)-Chlormezanone, Chlormezanonum [INN-Latin], Clormezanona [INN-Spanish], Dichloromethazanone, Rilasol, Transanate, (+-)-Fenarol, WIN 4692, chlormezanona, Chlormezanone [BAN:INN:JAN], Chlormezanone [INN:BAN:JAN], Banabin-syntyal, Chlormezanone (Trancopal), 4H-1,3-Thiazin-4-one, 2-(4-chlorophenyl)tetrahydro-3-methyl-, 1,1-dioxide, 2-(4-Chlorophenyl)-3-methyl-4-metathiazanone-1,1-dioxide, HSDB 3300, 2-(p-Chlorophenyl)tetrahydro-3-methyl-4H-1,3-thiazin-4-one 1,1-dioxide, TRANCOPAL (TN), EINECS 201-307-4, 2-(4-chlorophenyl)-3-methyl-1,1-dioxo-1,3-thiazinan-4-one, Chlormezanone (JAN/INN), UNII-4BU37OM8KL, NSC 169108, 2-(p-Chlorphenyl)-3-methyl-1,3-perhydrothiazin-4-on-1,1-dioxide, 4BU37OM8KL, UNII-C14WB33Y0S, 4H-1,3-Thiazin-4-one, tetrahydro-2-(p-chlorophenyl)-3-methyl-, 1,1-dioxide, 2-(4-Chlorphenyl)-3-methyl-4-metathiazanon-1,1-dioxid, C14WB33Y0S, CHEBI:3619, 2-(4-Chlorophenyl)tetrahydro-3-methyl-4H-1,3-thiazin-4-one 1,1-dioxide, 4H-1,3-Thiazin-4-one, 2-(p-chlorophenyl)tetrahydro-3-methyl-1,1-dioxide, 2-(para-Chlorophenyl)tetrahydro-3-methyl-4H-1,3-thiazin-4-one, 1,1-dioxide, 4H-1,3-Thiazin-4-one, 2-(4-chlorophenyl)tetrahydro-3-methyl-1,1-dioxide, NCGC00015191-06, NCGC00015191-07, C-192, DSSTox_CID_2798, 2-(4-Chlorophenyl)tetrahydro-3-methyl-4H,1,3-thiazin-4-one 1,1-Dioxide, DSSTox_RID_76732, DSSTox_GSID_22798, 4H-1,3-Thiazin-4-one, 2-(p-chlorophenyl)tetrahydro-3-methyl-, 1,1,-dioxide, 4H-1,3-Thiazin-4-one, 2-(p-chlorophenyl)tetrahydro-3-methyl-, 1,1-dioxide, SMR001456219, SR-01000075208, Fenaprim, Trancopa, CAS-80-77-3, Prestwick_736, (+)-Chlormezanone, (-)-Chlormezanone, (+)-Fenarol, (-)-Fenarol, (+/-)-chlormezanone, Chlormezanone, (+)-, Chlormezanone, (-)-, Spectrum_000414, Chlormezanone(Trancopal), (.+/-.)-Fenarol, Prestwick0_000336, Prestwick1_000336, Prestwick2_000336, Prestwick3_000336, Spectrum2_001807, Spectrum3_001084, Spectrum4_001237, Spectrum5_001364, (.+/-.)-Chlormezanone, Biomol-NT_000277, D0S1OE, AC1L1EB2, Lopac0_000383, Oprea1_275911, BSPBio_000371, BSPBio_002728, KBioGR_001734, KBioSS_000894, MLS003876813, MLS004773972, DivK1c_000886, SCHEMBL217864, SPECTRUM2300062, SPBio_001793, SPBio_002292, BPBio1_000409, BPBio1_001189, GTPL7323, CHEMBL1200714, DTXSID3022798, CTK8B3394, HMS502M08, KBio1_000886, KBio2_000894, KBio2_003462, KBio2_006030, KBio3_001948, WEQAYVWKMWHEJO-UHFFFAOYSA-, MolPort-003-666-762, NINDS_000886, WEQAYVWKMWHEJO-UHFFFAOYSA-N, HMS1569C13, HMS2096C13, HMS3261M07, HMS3266A22, HMS3655N09, HMS3713C13, Pharmakon1600-02300062, BCP14385, HY-B0353, KS-000016RV, WLN: T6VN DSWTJ B1 CR DG, Tox21_110093, Tox21_113151, Tox21_302197, Tox21_500383, ANW-42456, CCG-39616, MFCD00143951, NSC169108, NSC759569, s2021, Chlormezanone 1.0 mg/ml in Methanol, AKOS000121464, Tox21_110093_1, CS-2399, DB01178, LP00383, NE32949, NSC-169108, NSC-759569, IDI1_000886, NCGC00015191-03, NCGC00015191-04, NCGC00015191-05, NCGC00015191-08, NCGC00015191-09, NCGC00015191-10, NCGC00015191-13, NCGC00024597-02, NCGC00024597-03, NCGC00024597-04, NCGC00024597-05, NCGC00024597-06, NCGC00255305-01, NCGC00261068-01, AN-42201, 2-(p-Chlorphenyl)-3-methyl-1,1-dioxide, SBI-0050370.P003, AB2000427, KB-222607, LS-150535, TR-025493, AB00052410, EU-0100383, FT-0623609, ST24027544, D00268, AB00052410_04, AB00052410_05, I01-1903, SR-01000075208-1, SR-01000075208-3, SR-01000075208-5, SR-01000075208-6, BRD-A20348246-001-05-9, BRD-A20348246-001-08-3, 2-(p-Chlorophenyl)tetrahydro-3-methyl-4H-1,1-dioxide, Z271004890, 2-(4-Chlorophenyl)-3-methyl-1,3-thiazinan-4-one1,1-dioxide, 2-(4-chlorophenyl)-3-methyl-1??,3-thiazinane-1,1,4-trione, 4H-1, 2-(4-chlorophenyl)tetrahydro-3-methyl-, 1,1-dioxide, 4H-1, 2-(p-chlorophenyl)tetrahydro-3-methyl-, 1,1-dioxide, 2-(4-chlorophenyl)-3-methyl-1$l;{6},3-thiazinane-1,1,4-trione, 2-(4-chlorophenyl)-3-methyl-1lambda,3-thiazinane-1,1,4-trione, 2-(4-chlorophenyl)-3-methyl-1lambda6,3-thiazinane-1,1,4-trione, 2-(p-Chlorphenyl)-3-methyl-1,3-perhydrothiazin-4-one, 1,1-dioxide, 2-(4-Chlorophenyl)tetrahydro-3-methyl-4H-1,3-thiazin-4-one-1,1-dioxide, 4H-1,3-Thiazin-4-one, 2-(4-chlorophenyl)tetrahydro-3-methyl-, 1,1-dioxide, (+)-, 4H-1,3-Thiazin-4-one, 2-(4-chlorophenyl)tetrahydro-3-methyl-, 1,1-dioxide, (-)-, 102818-65-5, 102818-66-6, 102818-67-7, InChI=1/C11H12ClNO3S/c1-13-10(14)6-7-17(15,16)11(13)8-2-4-9(12)5-3-8/h2-5,11H,6-7H2,1H3


ID: 2448

chemical graph of compound 2448



InChIKey: WEYVVCKOOFYHRW-UHFFFAOYSA-N
SMILES: CC1=C(C(=C2C(=C1O)C3(C(=CC(=C(C3=O)C(=O)C)O)O2)C)C(=O)C)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 24211
synonyms found at PubChem are:
Usnic acid, D-, (+)-Usnic acid, d-Usninic acid, NSC 5890, EINECS 231-456-0, CHEBI:38319, 7562-61-0, 3(9bH)-dibenzofuranone, 2,6-diacetyl-8,9b-dimethyl-1,7,9-trihydroxy-, D-, (9bR)-2,6-diacetyl-7,9-dihydroxy-8,9b-dimethyl-(2H,9bH)-dibenzofuran-1,3-dione, 1,3(2H,9bH)-dibenzofurandione, 2,6-diacetyl-7,9-dihydroxy-8,9b-dimethyl-, (9bR)-, UNII-663456969I, 2,6-diacetyl-3,7,9-trihydroxy-8,9b-dimethyldibenzo[b,d]furan-1(9bH)-one, 3(9bH)-DIBENZOFURANONE, 2,6-DIACETYL-1,7,9-TRIHYDROXY-8,9b-DIMETHYL-, D-, Usnic acid, (R)-, CHEMBL242022, Usninsaure, AC1L2NAC, 663456969I, SCHEMBL1767536, US9273021, Usnic Acid, Usnic acid, (R)- (8CI), CHEMBL1314537, ICTZCAHDGHPRQR-UHFFFAOYSA-N, MolPort-005-909-642, WEYVVCKOOFYHRW-UHFFFAOYSA-N, BDBM209638, AKOS000281081, AKOS030500799, MCULE-7220578322, VC30491, NCGC00160165-01, 4CN-1077, LS-61097, 2,6-diacetyl-3,7,9-trihydroxy-8,9b-dimethyldibenzofuran-1-one, (+)-2,6-Diacetyl-1,7,9-trihydroxy-8,9b-dimethyldibenzofuran-3(9bH)-one, 2,6-Diacetyl-3,7,9-trihydroxy-8,9b-dimethyl-9bH-dibenzofuran-1-one (Usnic acid), 4,10-Diacetyl-3,11,13-trihydroxy-2,12-dimethyl-8-oxatricyclo[7.4.0.0(2,7)]trideca-1(13),3,6,9,11-pentaen-5-one, 4,10-diacetyl-3,11,13-trihydroxy-2,12-dimethyl-8-oxatricyclo[7.4.0.0^{2,7}]trideca-1(9),3,6,10,12-pentaen-5-one


ID: 2449

chemical graph of compound 2449



InChIKey: WEYXYSUHILNIFY-UHFFFAOYSA-N
SMILES: CC1=CC(=C2C=C(C(=NC2=C1)NCCNC(=O)C3=CC=CS3)C#N)C

biological descriptors:

CFTR relevance: CFTR Corrector and Potentiator

Category:
Influence on CFTR function enhances CFTR function
Order of interaction binds to CFTR
subcellular compartment Apical membrane & subapical compartment

reference list:

"GL Lukacs" "PW Phuan" "AB Wood" "JM Knapp" "MJ Kurth" "B Yang" "AS Verkman"


CID is 3221675
synonyms found at PubChem are:
ASN 06539861, AC1MLL8L, SCHEMBL14235634, AKOS000680306, N-[2-[(3-cyano-5,7-dimethylquinolin-2-yl)amino]ethyl]thiophene-2-carboxamide


ID: 2450

chemical graph of compound 2450



InChIKey: WFGNJLMSYIJWII-FJXQXJEOSA-N
SMILES: COC(=O)[C@H](CC1=CC(=C(C=C1)O)O)N.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 10131132
synonyms found at PubChem are:
1421-65-4, (S)-Methyl 2-amino-3-(3,4-dihydroxyphenyl)propanoate hydrochloride, L-3,4-Dihydroxyphenylalanine methyl ester hydrochloride, Methyl L-DOPA hydrochloride, Melevodopa hydrochloride, UNII-JFU1A8866V, L-Dopa methyl ester hydrochloride, levodopa methyl ester hydrochloride, L-Tyrosine, 3-hydroxy-, methyl ester, hydrochloride, JFU1A8866V, NCGC00093792-01, L-Tyrosine, 3-hydroxy-, methyl ester, hydrochloride (1:1), DSSTox_CID_25763, DSSTox_RID_81105, DSSTox_GSID_45763, CAS-1421-65-4, L-Dopa Me ester hydrochloride, ST 41769, ST-41769, C10H14ClNO4, MLS002153271, SCHEMBL453411, 3,4-Dihydroxyphenyl-l-alanine methyl ester hydrochloride, CHEMBL1255756, DTXSID4045763, Methyl l-3-(3,4-dihydroxyphenyl)alaninate hydrochloride, CTK8B7691, KS-00000GGP, MolPort-003-983-850, WFGNJLMSYIJWII-FJXQXJEOSA-N, ACT09358, Alanine, 3-(3,4-dihydroxyphenyl)-, methyl ester, hydrochloride, Tox21_111221, Tox21_500356, 6937AA, Alanine, 3-(3,4-dihydroxyphenyl)-, methyl ester, hydrochloride, l-, ANW-58212, MFCD00038958, AKOS015912904, Tox21_111221_1, CCG-221660, CS-W012679, LP00356, NCGC00162132-03, NCGC00261041-01, AS-10467, SMR001230709, KB-211804, TC-146957, EU-0100356, FT-0633533, ST24036320, D 1507, L-3,4-Dihydroxyphenylalanine Methyl Ester HCl, SR-01000075804, J-007612, SR-01000075804-1, I14-49392, L-3?4-Dihydroxyphenylalanine methyl ester hydrochloride, 3-(3,4-Dihydroxyphenyl)-L-alanine methyl ester hydrochloride, L-3,4-Dihydroxyphenylalanine methyl ester hydrochloride, solid, methyl (2S)-2-amino-3-(3,4-dihydroxyphenyl)propanoate hydrochloride, methyl (2S)-2-amino-3-(3,4-dihydroxyphenyl)propanoate;hydrochloride


ID: 2451

chemical graph of compound 2451



InChIKey: WFJIVOKAWHGMBH-UHFFFAOYSA-N
SMILES: CCCCCCC1=C(C=C(C=C1)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3610
synonyms found at PubChem are:
hexylresorcinol, 4-Hexylresorcinol, 4-hexylbenzene-1,3-diol, 136-77-6, 4-Hexyl-1,3-benzenediol, Antascarin, Ascaricid, Ascarinol, p-Hexylresorcinol, 4-n-Hexylresorcinol, Adrover, Caprokol, Hidesol, Oxana, Crystoids, Prensol, 4-Hexylresorcine, 1,3-Benzenediol, 4-hexyl-, Sucrets, Gelovermin, Hexylresorcin, 4-Hexyl-1,3-dihydroxybenzene, Ascaryl, 4-(1-Hexyl)resorcinol, Cystoids anthelmintic, 1,3-Dihydroxy-4-hexylbenzene, Worm-agen, Resorcinol, 4-hexyl-, Hexylresorzin, Mycoderm, 1,3-Dihydroxy-4-n-hexylbenzene, NCI-C55787, ST-37, Hexylresorcinolum, 4-hexyl resorcinol, S.T. 37, Hexylresorcin [German], UNII-R9QTB5E82N, NSC 1570, CCRIS 888, HSDB 566, ST 37, EINECS 205-257-4, BRN 2048312, R9QTB5E82N, AI3-08055, CHEMBL443605, NSC1570, WFJIVOKAWHGMBH-UHFFFAOYSA-N, 1-(2',4'-Dihydroxyphenyl)hexane, C12H18O2, NCGC00091208-04, DSSTox_CID_699, DSSTox_RID_75743, DSSTox_GSID_20699, EverFresh, CAS-136-77-6, Hexylresorcinol [USP:INN:BAN], zlchem 16, 4-Hexyl-benzenediol, crystoids anthelmintic, Hexylresorcinol (USP), Spectrum_000869, Benzenediol, 4-hexyl-, 1, 4-hexyl-, 4-Hexylresorcinol, 8CI, AC1L1GBE, Spectrum2_000989, Spectrum3_000451, Spectrum4_000001, Spectrum5_000794, 4-Hexylresorcinol, 98%, ACMC-209c9r, D07EGB, WLN: QR CQ D6, Hexylresorcinol, BAN, USAN, SCHEMBL29107, BSPBio_002122, KBioGR_000341, KBioSS_001349, 4-06-00-06048 (Beilstein Handbook Reference), MLS002152930, DivK1c_000094, SPECTRUM1500330, SPBio_001057, AC1Q7A01, Jsp002214, 1-(2,4-Dihydroxyphenyl)hexane, 4-Hexyl-1,3-dihydroxy benzene, DTXSID1020699, BCBcMAP01_000093, CHEBI:93749, HMS500E16, KBio1_000094, KBio2_001349, KBio2_003917, KBio2_006485, KBio3_001342, ZLB0003, MolPort-002-507-681, NINDS_000094, 1, 3-Dihydroxy-4-n-hexylbenzene, HMS1920D09, HMS2091J15, Pharmakon1600-01500330, ACT05713, HY-B0986, NSC-1570, ZINC1576892, Tox21_111102, Tox21_202263, Tox21_300357, ANW-20173, BBL023042, BDBM50292636, CCG-40207, LS-794, MFCD00002284, NSC757056, s4571, SBB056777, STL008005, AKOS005683587, Tox21_111102_1, CS-4477, DB11254, MCULE-6006628559, NSC-757056, RTR-031025, BENZENE,1,3-DIHYDROXY,4-HEXYL, IDI1_000094, QTL1_000043, SMP1_000009, NCGC00091208-01, NCGC00091208-02, NCGC00091208-03, NCGC00091208-05, NCGC00091208-06, NCGC00091208-07, NCGC00091208-09, NCGC00254302-01, NCGC00259812-01, AC-12698, AJ-27346, AN-23121, AS-40438, BC205066, CJ-05428, CJ-24976, NCI60_001129, SC-79417, SMR000112060, ST092340, SBI-0051404.P003, KB-192105, TL8000851, TR-031025, FT-0618587, ST24032801, D04441, M-5357, AB00052011_05, SR-05000002054, Q-201203, S01-0171, SR-05000002054-1, BRD-K99946902-001-02-6, Z1259339944, Hexylresorcinol, European Pharmacopoeia (EP) Reference Standard, Hexylresorcinol, United States Pharmacopeia (USP) Reference Standard, Hexylresorcinol for system suitability, EuropePharmacopoeia (EP) Reference Standard, InChI=1/C12H18O2/c1-2-3-4-5-6-10-7-8-11(13)9-12(10)14/h7-9,13-14H,2-6H2,1H


ID: 2452

chemical graph of compound 2452



InChIKey: WFNASTYGEKUMIY-UHFFFAOYSA-N
SMILES: C1=C(NC=N1)CO.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 122926
synonyms found at PubChem are:
32673-41-9, 4-Imidazolemethanol hydrochloride, 4-(HYDROXYMETHYL)IMIDAZOLE HYDROCHLORIDE, (1H-Imidazol-4-yl)methanol hydrochloride, 4-Hydroxymethylimidazole hydrochloride, Imidazol-4-ylmethanol hydrochloride, 1H-imidazol-5-ylmethanol hydrochloride, 1H-Imidazole-4-ylmethanol hydrochloride, 1H-Imidazol-4-ylmethanol hydrochloride, 4-(HYDROXYMETHYL)IMIDAZOLE HCL, 4(5)-Hydroxymethylimidazole Hydrochloride, 1H-Imidazole-4-methanol, monohydrochloride, MLS000069480, 1H-Imidazole-4-ylmethanolhydrochloride, Akos 85, SMR000059084, (1H-Imidazol-4-yl)-methanol hydrochloride, 4-hydroxymethyl imidazole hydrochloride, Imidazol-4-ylmethanol HCl, EINECS 251-150-0, zlchem 230, PubChem9502, 4-Imidazolemethanol HCl, AC1L3VIT, Opera_ID_1778, 1h-imidazol-4-ylmethanol hydrochloride(1:1), Imidazole-4-methanol, HCl, AC1Q3F9B, KSC497K5F, SCHEMBL217185, CHEMBL1255967, CTK3J7552, 4-imidazolylcarbinol hydrochloride, DTXSID70186345, ZLC0038, imidazole-4-methanol hydrochloride, MolPort-000-139-336, WFNASTYGEKUMIY-UHFFFAOYSA-N, imidazol-5-ylmethanol hydrochloride, ACN-S003427, ACT02006, NSC26996, STR07347, imidazol-4-ylmethan-1-ol, chloride, Tox21_500603, 4(5)-Imidazolemethanol Hydrochloride, ANW-27402, CH-240, MFCD00012697, NSC-26996, SBB004207, AKOS000279315, AKOS015966704, 1H-imidazol-5-ylmethanol,hydrochloride, AC-2889, CCG-221907, CS-W013364, H2067G1, LP00603, LS20464, MCULE-7985661576, PS-9132, RP08246, RTR-013709, 4-Imidazolemethanol hydrochloride, 98%, TRA-0183619, NCGC00093979-01, NCGC00261288-01, (1H-imidazol-5-yl)methanol hydrochloride, 4-(hydroxy-methyl)imidazole hydrochloride, 4-(hydroxymethyl)-imidazole hydrochloride, BR-34700, KB-39253, SC-03480, SY003265, 4-hydroxymethyl-imidazole hydrochloride salt, AB0024221, DB-019205, TR-013709, 4CH-011736, EU-0100603, FT-0082598, FT-0607895, ST24023570, ST50408944, W5446, 4-(Hydroxymethyl)-1H-imidazole hydrochloride, 5-(Hydroxymethyl)-1H-imidazole hydrochloride, EN300-75984, KS-00001057, H 1877, S-1457, 673H419, SR-01000075904, I14-1641, SR-01000075904-1, AKOS015950597, AB1001569


ID: 2453

chemical graph of compound 2453



InChIKey: WFXFYZULCQKPIP-UHFFFAOYSA-N
SMILES: COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)C4=CC=CO4)N)OC.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 68546
synonyms found at PubChem are:
Prazosin hydrochloride, Prazosin HCl, 19237-84-4, Vasoflex, Minipress, Peripress, Furazosin hydrochloride, Deprazolin, Hypovase, Hypovasole, Pratsiol, Sinetens, Minipress Xl, 1-(4-Amino-6,7-dimethoxy-2-quinazolinyl)-4-(2-furanylcarbonyl)piperazine hydrochloride, Prazosin (hydrochloride), NSC 292810, Prazosin clorhidrato [Spanish], prazosine hydrochloride, UNII-X0Z7454B90, CP-12299-1, EINECS 242-903-4, C19H21N5O4.HCl, MLS000028454, 1-(4-Amino-6,7-dimethoxy-2-quinazolinyl)-4-(2-furoyl)piperazine monohydrochloride, X0Z7454B90, SMR000058384, CP-12,299-1, (4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl)(furan-2-yl)methanone hydrochloride, Piperazine, 1-(4-amino-6,7-dimethoxy-2-quinazolinyl)-4-(2-furanylcarbonyl)-, monohydrochloride, Piperazine, 1-(4-amino-6,7-dimethoxy-2-quinazolinyl)-4-(2-furoyl)-, monohydrochloride, W-107719, 2-(4-(2-Furoyl)piperazin-1-yl)-4-amino-6,7-dimethoxyquinazoline hydrochloride, CHEBI:8365, Quinazoline, 4-amino-6,7-dimethoxy-2-(4-(2-furoyl)piperazin-1-yl)-, hydrochloride, HSDB, SR-01000003052, Adversuten, Adverszuten, Alpress LP, Prazosin hydrochloride [USAN:JAN], [4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(furan-2-yl)methanone;hydrochloride, Pressin and Hypovase, Prazosin hydrochloride [USAN:USP:JAN], Prazosin hydrochloride;, PubChem19837, Opera_ID_370, AC1Q5KOO, AC1L29YV, CHEMBL1558, SCHEMBL41257, MLS001148201, MLS001333696, MLS002153280, MLS002222304, SPECTRUM1500495, Prazosin HCl (Furazosin HCl), piperazin-1-yl)(furan-2-yl), CTK3J2335, HY-B0193A, KS-00000ZMQ, AOB5346, BBC/839, DTXSID50172822, SYN3017, MolPort-001-684-488, WFXFYZULCQKPIP-UHFFFAOYSA-N, HMS1570N16, HMS1920J10, Pharmakon1600-01500495, BCP13643, ZX-AS005038, Prazosin hydrochloride (JP17/USP), Tox21_501002, AC-699, BG0291, CCG-39227, GP4454, MFCD00058177, NSC292810, NSC757286, s1424, AKOS015895394, AF-0012, API0003916, CS-2089, H37P844, LP01002, MCULE-7492026178, Minipress,Vasoflex,Pressin and Hypovase, NSC-292810, NSC-757286, RTR-008931, VA11573, 2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-6,7-dimethoxychinazolin-4-aminhydrochlorid, Prazosin hydrochloride, >=99% (TLC), NCGC00094296-01, NCGC00094296-02, NCGC00094296-03, NCGC00094296-04, NCGC00094296-05, NCGC00261687-01, BC205115, CC-33905, H764, ST057530, AB0013242, AB2000097, CP-122991, LS-140003, TL8001578, TR-008931, EU-0101002, P0938, D00609, 19237-84-4,19216-56-9(freebase), I06-0650, SR-01000003052-2, SR-01000003052-8, Piperazine,7-dimethoxy-2-quinazolinyl)-4-(2-furoyl)-, monohydrochloride, Prazosin hydrochloride, European Pharmacopoeia (EP) Reference Standard, Prazosin hydrochloride, United States Pharmacopeia (USP) Reference Standard, [4-(4-Amino-6,7-dimethoxy-2-quinazolinyl)-1-piperazinyl]-2-furanylmethanone Hydrochloride, 1-(4-Amino-6,7-dimethoxy-2-quinazolinyl)-4-(2-furanylcarbonxyl)piperazine Hydrochloride, 4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazinyl 2-furyl ketone, chloride, 4-Amino-6,7-dimethoxy-2-[4-(2-furoyl)piperazine-1-yl]quinazoline hydrochloride, Piperazine,7-dimethoxy-2-quinazolinyl)-4-(2-furanylcarbonyl)-, monohydrochloride, [4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(furan-2-yl)methanone hydrochloride, 86126-06-9, Methanone, [4-(4-amino-6,7-dimethoxy-2-quinazolinyl)-1-piperazinyl]-2-furanyl-, hydrochloride (1:1), Prazosin clorhidrato, 2-[4-(2-furoyl)piperazin-1-yl]-6,7-dimethoxyquinazolin-4-amine hydrochloride, Prazosin HCI, AC1LCWA6, AKOS026750015, FT-0630458, FT-0674002, 1-(4-Amino-6,7-dimethoxy-2-quinazolinyl)-4-(2-furoyl)piperazine HCl, [4-(4-amino-6,7-dimethoxyquinazolin-2-yl)piperazin-1-yl]-(furan-2-yl)methanone; hydron; chloride


ID: 2454

chemical graph of compound 2454



InChIKey: WGCVYBFPCUCTRY-UHFFFAOYSA-N
SMILES: C1=CC=C2C(=C1)C(=O)C=C(O2)C3=CC=CC=C3F

biological descriptors:

CFTR relevance: inactive

Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown

reference list:

"MH Nantz" "LJ Galietta" "K By" "EJ Niedzinski" "M Eda" "MF Springsteel" "MJ Haddadin" "MJ Kurth" "AS Verkman"


CID is 261400
synonyms found at PubChem are:
2-(2-fluorophenyl)-4H-chromen-4-one, 2-(2-fluorophenyl)chromen-4-one, 1645-20-1, NSC-93401, 2'-Fluoroflavone, NSC93401, AC1Q4OLJ, NCIOpen2_006065, Oprea1_441693, MLS000546795, CHEMBL452954, SCHEMBL8093194, CTK4D1836, DTXSID60294004, MolPort-000-695-728, WGCVYBFPCUCTRY-UHFFFAOYSA-N, HMS2351I24, ZINC482516, AC1L6587, AKOS002279677, MCULE-8681729520, 2-(2-fluorophenyl)-1-benzopyran-4-one, SMR000114711, 2-(2-fluorophenyl)-4H-1-benzopyran-4-one, ST50402141, 4H-1-Benzopyran-4-one,2-(2-fluorophenyl)-, A810631, AK-928/12490001


ID: 2455

chemical graph of compound 2455



InChIKey: WHBHBVVOGNECLV-OBQKJFGGSA-N
SMILES: C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@@]4(C(=O)CO)O)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 440707
synonyms found at PubChem are:
Cortexolone, CORTODOXONE, 11-Deoxycortisol, 152-58-9, 11-Desoxycortisol, Reichstein's substance S, Reichstein S, 11-Deoxyhydrocortisone, 11-Desoxyhydrocortisone, 17,21-Dihydroxyprogesterone, 17alpha-Hydroxycortexone, 11-Deoxy-17-hydroxycorticosterone, 17,21-Dihydroxypregn-4-ene-3,20-dione, Cortisol, 11-deoxy-, 11-Dioxycortisol, 17-Hydroxy-11-deoxycorticosterone, 11-Desoxy-17-hydroxycorticosterone, 4-Pregnene-17alpha,21-diol-3,20-dione, Substance S, Pregn-4-ene-3,20-dione, 17,21-dihydroxy-, UNII-WDT5SLP0HQ, Reichstein's compound S, 17-alpha-Hydroxycortexone, Cortodoxonum [INN-Latin], 17,21-Dihydroxy-4-pregnene-3,20-dione, Cortodoxona [INN-Spanish], SKF 3050, 11-deoxycortisone, SK&F 3050, Corticosterone, 11-deoxy-17-hydroxy-, WDT5SLP0HQ, MLS000069440, MLS001333071, 17,21-Dihydroxy-pregn-4-ene-3,20-dione, CHEBI:28324, 17alpha,21-Dihydroxy-4-pregnene-3,20-dione, WHBHBVVOGNECLV-OBQKJFGGSA-N, SK&F-3050, NCGC00021222-03, SMR000059123, NSC-18317, DSSTox_CID_25642, DSSTox_RID_81022, DSSTox_GSID_45642, 11-Desoxycortisone, Cortodoxone [USAN:INN:BAN], 17ALPHA,21-DIHYDROXYPREGNA-4-ENE-3,20-DIONE, Cortodoxona, Cortodoxonum, EINECS 205-805-2, 11 Deoxycortisol, BRN 2511358, (8R,9S,10R,13S,14S,17R)-17-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one, CAS-152-58-9, 17.alpha.-Hydroxycortexone, Substance S, Reichstein's, Cortoxelone, 17-hydroxydesoxycorticosterone, Cortodoxone (USAN), Reichsteins Compound S, 17|A-Hydroxycortexone, Opera_ID_1433, D0GW2Y, AC1L99SV, Lopac0_001040, SCHEMBL42590, 4-08-00-02913 (Beilstein Handbook Reference), MLS001333072, CHEMBL253144, GTPL5100, DTXSID8045642, CTK8A1111, MolPort-002-507-128, HMS2234L16, HMS3263O21, (8R,9S,10R,13S,14S,17R)-17-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3(2H)-one, Reichstein's substance S, >=98%, ZINC3860956, Tox21_110867, Tox21_501040, BDBM50423539, CMC_13429, LMST02030086, MFCD00003662, AKOS015969740, Tox21_110867_1, CCG-205117, CS-5182, LP01040, MCULE-8877595522, NCGC00021222-04, NCGC00021222-05, NCGC00021222-06, NCGC00261725-01, AJ-46092, HY-77839, N968, SC-25822, 11-Desoxy-17.alpha.-hydroxycorticosterone, 20-dione 17,21-Dihydroxypregn-4-ene-3, 4-Pregnene-17|A,21-diol-3,20-dione, EU-0101040, 17|A,21-Dihydroxy-4-pregnene-3,20-dione, 4-Pregnene-17.alpha.,21-diol-3,20-dione, C05488, D03595, R 0500, 17alpha,21-dihydroxy-pregna-4-ene-3,20-dione, Reichstein inverted exclamation mark s Compound S, 152C589, 17.alpha.,21-Dihydroxypregn-4-ene-3,20-dione, SR-01000076100, SR-01000076100-1, 33BB233B-CC8F-413B-8901-3A73030BBA68, 11-Deoxycortisol (17,21-Dihydroxypregn-4-ene-3,20-dione), 17,21-Dihydroxypregn-4-ene-3,20-dione (Reichstein's Substance S), 17-(1-keto-2-hydroxyethyl)-4-androsten-17alpha, 21-ol-3-one, 17|A inverted exclamation mark,21-Dihydroxypregna-4-ene-3,20-dione, 11-Deoxycortisol (17,21-Dihydroxypregn-4-ene-3,20-dione) 1.0 mg/ml in Methanol, (1S,2R,10R,11S,14R,15S)-14-hydroxy-14-(2-hydroxyacetyl)-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-6-en-5-one, 11-Deoxycortisol solution, 1.0 mg/mL in methanol, ampule of 1 mL, certified reference material, 37-60-5


ID: 2456

chemical graph of compound 2456



InChIKey: WHCVEOAUHDJGLW-UHFFFAOYSA-N
SMILES: C1CCN2CC3CC(C2C1)CNC3CCC(=O)O.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 16667725
synonyms found at PubChem are:
LUPANYL ACID HYDROCHLORIDE, SPECTRUM1505240, CHEMBL3039096, CCG-38775, NCGC00095700-01


ID: 2457

chemical graph of compound 2457



InChIKey: WHHHJDGNBVQNAU-UHFFFAOYSA-N
SMILES: CCN1C=C(C(=O)C2=C1N=C(C=C2)CC3=CC=CC=C3)C(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 2137
synonyms found at PubChem are:
Amfonelic acid, 15180-02-6, 7-benzyl-1-ethyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylic acid, Amfonelinsaeure, Win 25978, UNII-RR302AR19Y, 7-Benzyl-1-ethyl-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylic acid, Acide amfonelique [INN-French], Acido anfonelico [INN-Spanish], Acidum amfonelicum [INN-Latin], NSC 100638, CHEMBL35337, RR302AR19Y, Win 25,978, 1,8-Naphthyridine-3-carboxylic acid, 1-ethyl-1,4-dihydro-4-oxo-7-(phenylmethyl)-, 7-Benzyl-1-ethyl-1,4-dihydro-4-oxo-1,8-naphthyridin-3-carbonsaeure, 7-Benzyl-1-ethyl-4-oxo-1,8-naphthyridine-3-carboxylic acid, Acido anfonelico, Acide amfonelique, Acidum amfonelicum, Amfonelic acid [USAN:BAN:INN], Amfonelic acid [USAN:INN:BAN], Amfonelic acid (USAN), Lopac-D-044, AC1Q6BFT, Acidum amfonelicum (INN), Lopac0_000416, JSPY-st000267, ZINC911, SCHEMBL122096, AC1L1D03, CTK0H6443, AOB5287, DTXSID40164877, WHHHJDGNBVQNAU-UHFFFAOYSA-N, BDBM50021952, WIN-25978, 1,8-Naphthyridine-3-carboxylic acid, 7-benzyl-1-ethyl-1,4-dihydro-4-oxo-, AKOS016011070, API0000377, CCG-204508, NSC-100638, VZ35780, NCGC00015298-01, AJ-07934, AS-16838, CC-24055, LS-95958, AX8016848, KB-249470, D-044, EU-0100416, FT-0081197, FT-0637196, D02897, 180A026, C-19144, SR-01000075376, J-519581, SR-01000075376-1, 1-ethyl-4-oxo-7-(phenylmethyl)-1,8-naphthyridine-3-carboxylic acid, 7-Benzyl-1-ethyl-4-oxo-1,4-dihydro-[1,8]naphthyridine-3-carboxylic acid, 7-Benzyl-1-ethyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylicacid, 7-Benzyl-1-ethyl-4-oxo-1,4-dihydro[1,8]naphthyridine-3-carboxylic acid #, 1,8-Naphthyridine-3-carboxylicacid, 1-ethyl-1,4-dihydro-4-oxo-7-(phenylmethyl)-, AMFONELIC ACID (7-BENZYL-1-ETHYL-1,4-DIHYDRO-4-OXO-1,8-NAPHTHYRIDINE-3-CARBOXYLIC ACID)


ID: 2458

chemical graph of compound 2458



InChIKey: WHQCHUCQKNIQEC-UHFFFAOYSA-N
SMILES: CCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC(=C(C(=C3)Br)O)Br

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 2333
synonyms found at PubChem are:
benzbromarone, 3562-84-3, Benzbromaron, Desuric, Urinorm, Normurat, Uricovac, Minuric, Exurate, Hipurik, Azubromaron, Narcaricin, L 2214-Labaz, Uroleap (TN), Besuric, Harolan, MJ 10061, Benzbromaronum, Benzobromarona, Acifugan, Methanone, (3,5-dibromo-4-hydroxyphenyl)(2-ethyl-3-benzofuranyl)-, 3,5-Dibromo-4-hydroxyphenyl-2-ethyl-3-benzofuranyl ketone, 2-Ethyl-3-(3,5-dibrom-4-hydroxybenzoyl)benzofuran, L 2214, Benzbromaronum [INN-Latin], Benzobromarona [INN-Spanish], NSC 85433, (3,5-Dibromo-4-hydroxyphenyl)(2-ethyl-1-benzofuran-3-yl)methanone, Benzbromarone [USAN:INN:BAN], L-2214, L2214-Labaz, Max-uric, UNII-4POG0RL69O, NSC85433, KETONE, 3,5-DIBROMO-4-HYDROXYPHENYL 2-ETHYL-3-BENZOFURANYL, C17H12Br2O3, L2214, EINECS 222-630-7, BRN 0273668, 4POG0RL69O, 3-(3,5-Dibromo-4-hydroxybenzoyl)-2-ethylbenzofuran, CPD000058310, Benzofuran, 3-(3,5-dibromo-4-hydroxybenzoyl)-2-ethyl-, MLS000028522, MLS000737128, CHEBI:3023, CHEMBL388590, (2-Ethyl-3-benzofuranyl)-(3,5-dibrom-4-hydroxyphenyl)keton, (3,5-Dibromo-4-hydroxyphenyl)(2-ethylbenzofuran-3-yl)methanone, WHQCHUCQKNIQEC-UHFFFAOYSA-N, ML054, NCI85433, NSC-85433, NCGC00013895-08, 3, 5-Dibromo-4-hydroxyphenyl-2-ethyl-3-benzofuranyl ketone, 3,5-Dibromo-4-hydroxyphenyl 2-ethyl-3-benzofuranyl Ketone, 3-[3,5-DIBROMO-4-HYDROXYBENZOYL]-2-ETHYLBENZOFURAN, SMR000058310, (3,5-Dibromo-4-hydroxyphenyl)(2-ethyl-3-benzofuranyl)methanone, CAS-3562-84-3, (3,5-dibromo-4-hydroxyphenyl)-(2-ethyl-1-benzofuran-3-yl)methanone, DSSTox_CID_2652, DSSTox_RID_76675, DSSTox_GSID_22652, 2-Ethyl-3-(3,5-dibromo-4-hydroxybenzoyl)benzofuran, Benzbromaron AL, (3,5-dibromo-4-hydroxy-phenyl)-(2-ethylbenzofuran-3-yl)methanone, AL, Benzbromaron, Benzbromaron ratiopharm, Benzbromaron-ratiopharm, SR-01000003082, Uroleap, 3,5-dibromo-4-hydroxyphenyl 2-ethylbenzo[b]furan-3-yl ketone, Benzbromarone,(S), Methanone, (3, Prestwick_709, Benzbromaronratiopharm, Benzbromarone(USAN), TPDI, Benzbromarone Aliud Brand, Opera_ID_1282, Prestwick0_000370, Prestwick1_000370, Prestwick2_000370, Prestwick3_000370, Benzbromarone Sanfer Brand, Benzbromarone Heumann Brand, D0Z3DY, AC1L1DG0, cid_2333, NCIStruc1_001498, NCIStruc2_001681, Aliud Brand of Benzbromarone, Oprea1_140235, SCHEMBL48993, BSPBio_000499, Benzbromarone ratiopharm Brand, MLS001074105, MLS001424143, Sanfer Brand of Benzbromarone, Heumann Brand of Benzbromarone, SPBio_002420, BPBio1_000549, DTXSID4022652, CTK8F7960, ratiopharm Brand of Benzbromarone, AOB1168, Benzbromarone, analytical standard, MolPort-002-622-240, Benzbromarone (JP15/USAN/INN), Benzbromarone (JP17/USAN/INN), HMS1569I21, HMS2052K05, HMS2093J04, HMS2096I21, HMS2230D20, HMS3394K05, HMS3652H15, HMS3713I21, Pharmakon1600-01505971, ZINC608205, BCP07515, EX-A1131, HY-B1135, Tox21_110041, BDBM50158460, CCG-37198, MFCD00078962, NCGC00013895, NSC759281, s4221, SBB057006, Benzbromarone 1.0 mg/ml in Methanol, AKOS015895856, Sanofi Winthrop Brand of Benzbromarone, Tox21_110041_1, AC-6162, ACN-049975, API0001617, CS-4740, DB12319, KS-1292, MCULE-5907152599, NC00334, NSC-759281, KS-0000108Y, NCGC00013895-01, NCGC00013895-02, NCGC00013895-03, NCGC00013895-04, NCGC00013895-05, NCGC00013895-06, NCGC00013895-07, NCGC00013895-09, NCGC00022066-04, AN-10317, H503, KB-74973, LS-87131, MJ-10061, NCI60_041884, SAM001246877, SC-09288, SC-27292, SC-36260, SBI-0055383.P002, AM20040270, B4099, FT-0083530, FT-0602164, ST50993903, UNM000001228903, D01056, 562B843, A822914, I06-1261, SR-01000003082-5, SR-01000003082-6, BRD-K11717138-001-03-0, BRD-K11717138-001-16-2, Ketone,5-dibromo-4-hydroxyphenyl 2-ethyl-3-benzofuranyl, Benzbromarone, certified reference material, TraceCERT(R), 2,6-dibromo-4-[(2-ethyl-1-benzofuran-3-yl)carbonyl]phenol, Benzbromarone, European Pharmacopoeia (EP) Reference Standard, Methanone,5-dibromo-4-hydroxyphenyl)(2-ethyl-3-benzofuranyl)-, (3,5-dibromo-4-hydroxyphenyl)-(2-ethyl-3-benzofuranyl)methanone, (3,5-Dibromo-4-hydroxyphenyl)-(2-ethylbenzofuran-3-yl)methanone, (3,5-Dibromo-4-hydroxyphenyl)(2-ethyl-1-benzofuran-3-yl)methanone #, 5,10,15-Triphenyl-10,15-dihydro-5H -diindolo[3,2-a:3',2'-c]carbazole, Methanone, (3, 5-dibromo-4-hydroxyphenyl)(2-ethyl-3-benzofuranyl)-, [3,5-bis(bromanyl)-4-oxidanyl-phenyl]-(2-ethyl-1-benzofuran-3-yl)methanone, 879713-04-9


ID: 2459

chemical graph of compound 2459



InChIKey: WHSXTWFYRGOBGO-UHFFFAOYSA-N
SMILES: CC1=CC=CC(=C1O)C(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6738
synonyms found at PubChem are:
3-Methylsalicylic acid, 83-40-9, 2-Hydroxy-3-methylbenzoic acid, Hydroxytoluic acid, O-CRESOTIC ACID, o-Cresotinic acid, Cresotic acid, o-Homosalicylic acid, 2-Hydroxy-m-toluic acid, 2,3-Cresotinic acid, Cresotinic acid, Benzoic acid, 2-hydroxy-3-methyl-, 2,3-Cresotic acid, Homosalicylic acid, 3-Methyl-2-hydroxybenzoic acid, Hydroxytoluylsaeure, 3-cresotinic acid, 3-MS, 3-Methylsalicylsaeure, Acido hidroxitoluico, 2-Hydroxy-3-methyl-benzoic acid, Acide hydroxytoluique, Acido ortocresotinico, 3-Methylsalicylicacid, Acidum hydroxitoluicum, Acidum hydroxytoluicum, 3-Methylsalicylate, UNII-ZH3HEY032H, NSC 17561, beta-Cresotinic acid, Hydroxytoluic acid [INN:BAN], Acido 3-ossi-5-metil-benzoico, Acido ortocresotinico [Italian], .beta.-Cresotinic acid, Acide hydroxytoluique [INN-French], Acido hidroxitoluico [INN-Spanish], Acidum hydroxytoluicum [INN-Latin], EINECS 201-473-8, BRN 2086811, ZH3HEY032H, Acido 3-ossi-5-metil-benzoico [Italian], AI3-15025, 3 MS, CHEMBL448399, 2-hydroxy-3-methyl benzoic acid, CHEBI:20141, WHSXTWFYRGOBGO-UHFFFAOYSA-N, NCGC00095792-01, DSSTox_CID_18686, DSSTox_RID_79384, DSSTox_GSID_38686, CAS-83-40-9, o-Kresotinsaure, beta-cresotinate, 3-Cresotinate, 2,3-cresotinate, 2,3-cresotate, 2-hydroxy-m-toluate, 3-Metylsalicylic acid, 3-Methylsalycilic acid, 3-methylsalicyclic acid, Spectrum_000437, 3-methyl salicylic acid, 3-methyl-salicylic acid, SpecPlus_000905, Spectrum2_000151, Spectrum3_000757, Spectrum4_000789, Spectrum5_000741, bmse000620, 3-methyl-2-hydroxybenzoate, AC1Q5U3W, ACMC-1B7I6, 2-hydroxy-3-methyl-benzoate, Oprea1_525952, SCHEMBL25756, BSPBio_002374, KBioGR_001238, KBioSS_000917, SPECTRUM212064, 4-10-00-00601 (Beilstein Handbook Reference), KSC489O5F, MLS002207190, DivK1c_007001, SPBio_000282, 3-Methylsalicylic acid, 97%, AC1L1N71, ZINC1548, DTXSID9038686, CTK3I9752, KBio1_001945, KBio2_000917, KBio2_003485, KBio2_006053, KBio3_001594, KS-00000JPW, NSC1772, MolPort-000-872-076, HMS3264E18, Pharmakon1600-00212064, HY-B1399, NSC-1772, NSC17561, NSC50796, Tox21_111523, ANW-37682, BBL023681, BDBM50275341, CCG-38951, FC0775, NSC-17561, NSC-50796, NSC755829, SBB040914, STK426344, AKOS000119923, Tox21_111523_1, AC-7749, AN-8688, CS-4909, FS-3191, MCULE-7890756003, NSC-755829, RTR-020372, NCGC00095792-02, NCGC00095792-03, AJ-08045, BR-48894, KB-32869, LS-55452, SC-77386, SMR000112084, SBI-0052675.P002, ST2410811, TL8005478, TR-020372, AM20060736, FT-0616181, ST50214517, C14088, M-5979, AB00053143_02, SR-01000872738, I01-0399, SR-01000872738-1, W-104146, BRD-K75608666-001-02-6, BRD-K75608666-001-03-4, InChI=1/C8H8O3/c1-5-3-2-4-6(7(5)9)8(10)11/h2-4,9H,1H3,(H,10,11


ID: 2460

chemical graph of compound 2460



InChIKey: WHZDFFGNQINQSU-UHFFFAOYSA-N
SMILES: CC1=CC(=O)NC2=C1C=CC=C2OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 782123
synonyms found at PubChem are:
30198-01-7, 8-Methoxy-4-methylquinolin-2(1H)-one, 2-Hydroxy-4-methyl-8-methoxyquinoline, 8-Methoxy-4-methyl-1H-quinolin-2-one, 8-Methoxy-4-methylquinolin-2-ol, BAS 00898394, 2(1H)-Quinolinone, 8-methoxy-4-methyl-, casimiroin analogue, 1e, SpecPlus_000427, Enamine_005066, Spectrum5_000925, AC1LFQ41, Oprea1_088427, Oprea1_150018, DivK1c_006523, AC1Q6I11, CHEMBL453417, SCHEMBL5433980, BDBM29216, CTK4G4649, CTK8D9638, KBio1_001467, DTXSID40354791, MolPort-000-678-734, MolPort-005-976-279, WHZDFFGNQINQSU-UHFFFAOYSA-N, HMS1408G06, 2-HYDROXY-8-METHOXYLEPIDINE, ALBB-031722, FCH829418, STK856540, ZINC16284037, 8-methoxy-4-methylhydroquinolin-2-one, AKOS001072892, AKOS004119147, MCULE-9748555043, ACM30198017, IDI1_007653, 4-Methyl-8-methoxyquinoline-2(1H)-one, 2(1H)-Quinolinone,8-methoxy-4-methyl-, KB-24433, ST50209072, UX00005683, A7B, InChI=1/C11H11NO2/c1-7-6-10(13)12-11-8(7)4-3-5-9(11)14-2/h3-6H,1-2H3,(H,12,13


ID: 2461

chemical graph of compound 2461



InChIKey: WIELVDXKOYPANK-UHFFFAOYSA-N
SMILES: CCN(CC)CCOC(=O)C(C1CCCCC1)C2=CC=CC=C2.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 92806
synonyms found at PubChem are:
Drofenine hydrochloride, Cyclovegantine, 548-66-3, Trasentine-A, Trasentin H, Profenene hydrochloride, Trasentine A, Hexahydroadiphenine, Drofenine (hydrochloride), Adiphenine H hydrochloride, Cycloadiphenine hydrochloride, Hexahydroadiphenine hydrochloride, Cyclospasmol (tempelhof), IT-19, Drofenine HCl, EINECS 208-954-1, NSC 42559, Cyclohexylphenylacetyldiethylaminoethanol hydrochloride, 2-(Diethylamino)ethyl alpha-cyclohexylbenzeneacetate, NCGC00094882-01, 2-Diethylaminoethyl(alpha-phenylcyclohexane)acetate hydrochloride, Cyclospasmol [Tempelhof], (+)-alpha-Phenylcyclohexaneacetic acid 2-(diethylamino)ethyl ester hydrochloride, alpha-Cyclohexylbenzeneacetic acid 2-(diethylamino)ethyl ester hydrochloride, alpha-Phenylcyclohexaneacetic acid 2-(diethylamino)ethyl ester hydrochloride, alpha-Phenyl-cyclohexylessigsaeure-2-diaethylamino-aethylester-hydrochlorid [German], Benzeneacetic acid, alpha-cyclohexyl-, 2-(diethylamino)ethyl ester, hydrochloride, Benzeneacetic acid, alpha-cyclohexyl-, 2-(diethylamino)ethyl ester, hydrochloride, (+)-, C20H32ClNO2, Cyclohexaneacetic acid, alpha-phenyl-, 2-(diethylamino)ethyl ester, hydrochloride, (+)-, DSSTox_CID_25859, DSSTox_RID_81179, DSSTox_GSID_45859, (-)-alpha-Phenylcyclohexaneacetic acid 2-(diethylamino)ethyl ester hydrochloride, Benzeneacetic acid, alpha-cyclohexyl-, 2-(diethylamino)ethyl ester, hydrochloride, (-)-, Cyclohexaneacetic acid, alpha-phenyl-, 2-(diethylamino)ethyl ester, hydrochloride, Cyclohexaneacetic acid, alpha-phenyl-, 2-(diethylamino)ethyl ester, hydrochloride, (-)-, SMR001306793, SR-01000868870, Cyclovesantine, 2-(diethylamino)ethyl 2-cyclohexyl-2-phenylacetate;hydrochloride, Prestwick_234, 2-(diethylamino)ethyl 2-cyclohexyl-2-phenylacetate, chloride, AC1L3OVJ, Trasentine-a hydrochloride, CAS-548-66-3, Trasentine-6H hydrochloride, AC1Q67SP, MLS002207270, MLS002222187, SCHEMBL446912, SPECTRUM1500999, CHEMBL1368313, DTXSID3045859, 1679-76-1 (Parent), 2-diethylaminoethyl a-phenylcyclohexaneacetate hydrochloride, AuCa(1/2)a(3/4).EO, MolPort-003-666-339, HMS1570M20, HMS1921O20, Pharmakon1600-01500999, drofenine hydrochloride hydrochloride, HY-B1239, NSC42559, Tox21_111350, CCG-40193, NSC-42559, NSC757809, AKOS024287989, alpha-Phenyl-cyclohexylessigsaeure-2-diaethylamino-aethylester-hydrochlorid, Tox21_111350_1, API0012869, CS-4885, NSC-757809, WLN: L6TJ AYR&VO2N2&2 &GH, NCGC00094882-02, NCGC00178252-05, 3146-19-8, LS-56418, LS-56419, LS-56420, Drofenine hydrochloride, analytical standard, FT-0738242, ST50409558, VU0244449-2, C-45954, SR-01000868870-2, SR-01000868870-3, 2-diethylaminoethyl 2-cyclohexyl-2-phenylacetate hydrochloride, 2-(Diethylamino)ethyl .alpha.-cyclohexylbenzeneacetate hydrochloride, 2-(diethylamino)ethyl 2-cyclohexyl-2-phenylacetate hydrochloride, 2-(Diethylamino)ethyl(.alpha.-phenylcyclohexane)acetate hydrochloride, Cyclohexaneacetic acid, 2-(diethylamino)ethyl ester hydrochloride, .alpha.-Cyclohexylbenzeneacetic acid 2-(diethylamino)ethyl ester hydrochloride, .alpha.-Phenylcyclohexaneacetic acid 2-(diethylamino)ethyl ester hydrochloride, Benzeneacetic acid, alpha-cyclohexyl-, 2-(diethylamino)ethyl ester, hydrochloride (9CI), SBB057421, AKOS025116946, MCULE-1354012037, AKOS026749932


ID: 2462

chemical graph of compound 2462



InChIKey: WIGIZIANZCJQQY-UHFFFAOYSA-N
SMILES: CCC1=C(CN(C1=O)C(=O)NCCC2=CC=C(C=C2)S(=O)(=O)NC(=O)NC3CCC(CC3)C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3476
synonyms found at PubChem are:
glimepiride, 93479-97-1, Amaryl, Glimepiridum, Glimepirida, Amarel, Glimepirid, Endial, Glimepride, Hoe-490, Glista OD, Roname, Glimepiridum [Latin], Glimepirida [Spanish], HOE 490, GLIMPERIDE, Glymepirid, Glimer, Solosa, cis-Glimepiride, Novo-glimepiride, PMS-glimepiride, Ratio-glimepiride, UNII-24T6XIR2MZ, Sandoz glimepiride, Amaryl (TN), Glimepiride [USAN:BAN:INN], CCRIS 7083, 684286-46-2, UNII-6KY687524K, 1-((p-(2-(3-Ethyl-4-methyl-2-oxo-3-pyrroline-1-carboxamido)ethyl)phenyl)sulfonyl)-3-(trans-4-methylcyclohexyl)urea, BRN 5365754, 24T6XIR2MZ, CHEBI:5383, 6KY687524K, 4-ethyl-3-methyl-N-[2-[4-[(4-methylcyclohexyl)carbamoylsulfamoyl]phenyl]ethyl]-5-oxo-2H-pyrrole-1-carboxamide, NCGC00016960-03, CPD000466368, CAS-93479-97-1, DSSTox_CID_20675, DSSTox_RID_79534, DSSTox_GSID_40675, 3-ethyl-4-methyl-N-[2-(4-{[(trans-4-methylcyclohexyl)carbamoyl]sulfamoyl}phenyl)ethyl]-2-oxo-2,5-dihydro-1H-pyrrole-1-carboxamide, Glorion, Glemax, Glimepiride, cis-, 1-[[P-[2-(3-ETHYL-4-METHYL-2-OXO-3-PYRROLINE-1-CARBOXAMIDO)ETHYL]PHENYL]SULFONYL]-3-(TRANS-4-METHYLCYCLOHEXYL)UREA, 1-{[4-(2-{[(3-ethyl-4-methyl-2-oxo-2,5-dihydro-1H-pyrrol-1-yl)carbonyl]amino}ethyl)phenyl]sulfonyl}-3-(trans-4-methylcyclohexyl)urea, 1H-Pyrrole-1-carboxamide, 2,5-dihydro-3-ethyl-4-methyl-N-(2-(4-(((((4-methylcyclohexyl)amino)carbonyl)amino)sulfonyl)phenyl)ethyl)-2-oxo-, trans-, 1H-Pyrrole-1-carboxamide, 3-ethyl-2,5-dihydro-4-methyl-N-(2-(4-(((((4-methylcyclohexyl)amino)carbonyl)amino)sulfonyl)phenyl)ethyl)-2-oxo-, trans-, 3-ethyl-4-methyl-n-(4-(n-((1r,4r)-4-methylcyclohexylcarbamoyl)sulfamoyl)phenethyl)-2-oxo-2,5-dihydro, 3-ETHYL-4-METHYL-N-(4-(N-((1R,4R)-4-METHYLCYCLOHEXYLCARBAMOYL)SULFAMOYL)PHENETHYL)-2-OXO-2,5-DIHYDRO-1H-PYRROLE-1-CARBOXAMIDE, SMR000466368, SR-05000001508, diameprid, gimepiride, glimax, glirid, Sugral, Amary, HOE490, Vitaimin E, Glimepiride,(S), 3-ETHYL-4-METHYL-N-[2-(4-[[(TRANS-4-METHYLCYCLOHEXYL)CARBAMOYL]SULFAMOYL]PHENYL)ETHYL]-2-OXO-2,5-DIHYDRO-1H-PYRROLE-1-CARBOXAMIDE, 3-ethyl-4-methyl-N-[2-[4-[(4-methylcyclohexyl)carbamoylsulfamoyl]phenyl]ethyl]-2-oxo-5H-pyrrole-1-carboxamide, Glimepiride [USAN:USP:INN:BAN], Prestwick0_000651, Prestwick1_000651, Prestwick2_000651, Prestwick3_000651, Glimepiride EP Impurity A, D0B2GI, AC1L1G0T, CHEMBL1481, Oprea1_382896, SCHEMBL16084, SCHEMBL16086, BSPBio_000681, MLS000759495, MLS001076674, MLS001401419, MLS003915622, MLS006011260, Glimepiride (JAN/USP/INN), SPBio_002602, BPBio1_000751, CHEMBL149223, GTPL6820, SCHEMBL8738802, Glimepiride (JP17/USP/INN), Amaryl, Glista OD, Glimepiride, DTXSID5040675, SCHEMBL14371714, SCHEMBL14965363, CHEBI:92609, CTK8E7555, AOB5663, MolPort-003-847-587, MolPort-003-987-461, WIGIZIANZCJQQY-RUCARUNLSA-N, WIGIZIANZCJQQY-UHFFFAOYSA-N, HMS1570C03, HMS2052L03, HMS2090K18, HMS2097C03, HMS2235L07, HMS3269A09, HMS3372O07, HMS3394L03, HMS3654F17, HMS3714C03, Pharmakon1600-01504915, ZINC537791, BCP05331, HY-B0104, Tox21_110713, AC-476, MFCD00878417, NSC759809, s1344, STL451059, STL453194, AKOS015894919, AKOS015969663, Glimepiride, >=98% (HPLC), solid, Tox21_110713_1, ZINC100001976, ZINC100070954, AB07644, AN-1036, AT-6093, BCP9000728, CCG-101156, CS-1844, DB00222, KS-5238, NC00406, NSC-759809, NCGC00016960-01, NCGC00016960-02, NCGC00016960-04, NCGC00016960-05, NCGC00016960-07, NCGC00161404-01, NCGC00161404-02, NCGC00181757-01, NCGC00371061-06, BC204710, SAM001246710, SC-13775, SC-46287, SMR001550123, AB0073063, LS-136752, TL8005924, TX-017626, AB00513874, FT-0626713, FT-0668978, FT-0696605, G0395, 64598P, C07669, D00593, 46931-EP2269989A1, 46931-EP2270011A1, 46931-EP2272825A2, 46931-EP2272841A1, 46931-EP2275414A1, 46931-EP2287165A2, 46931-EP2287166A2, 46931-EP2292620A2, 46931-EP2295406A1, 46931-EP2295422A2, 46931-EP2298769A1, 46931-EP2298772A1, 46931-EP2298776A1, 46931-EP2301936A1, 46931-EP2305648A1, 46931-EP2308839A1, 46931-EP2308847A1, 46931-EP2308878A2, 46931-EP2311822A1, AB00513874-06, AB00513874-08, AB00513874-09, AB00513874_10, AB00513874_11, 479G971, I06-0029, Q-201158, SR-05000001508-1, SR-05000001508-2, SR-05000001508-3, BRD-K34776109-001-03-4, BRD-K42693031-001-01-8, Glimepiride, European Pharmacopoeia (EP) Reference Standard, 3-ethyl-4-methyl-N-(4-(N-((1r,4r)-4-methylcyclohexylcarbamoyl), Glimepiride, United States Pharmacopeia (USP) Reference Standard, sulfamoyl)phenethyl)-2-oxo-2,5-dihydro-1H-pyrrole-1-carboxamide, Glimepiride for system suitability, European Pharmacopoeia (EP) Reference Standard, 1-[[4-[2-[[(3-Ethyl-4-methyl-2-oxo-2,3-dihydro-1H-pyrrol-1-yl)carbonyl]amino]ethyl]phenyl]sulphonyl]-3-(cis-4-methylcyclohexyl)urea (cis-Glimepiride), 3-ETHYL-2,5-DIHYDRO-4-METHYL-N-[2-[4-[[[(TRANS-4-METHYLCYCLO-HEXYL)AMINO]CARBONYL]AMINO]SULFONYL]PHENYL]ETHYL-2-OXO-1H-PYRROLE-1-CARBOXAMIDE, 3-Ethyl-2,5-dihydro-4-methyl-N-[2-[4-[[[[(trans-4-methylcyclohexyl)amino]carbonyl]amino]sulfonyl]phenyl]ethyl]-2-oxo-1H-pyrrole-1-carboxamide, 3-ethyl-4-methyl-2-oxo-N-(2-{4-[({[(1r,4r)-4-methylcyclohexyl]carbamoyl}amino)sulfonyl]phenyl}ethyl)-2,5-dihydro-1H-pyrrole-1-carboxamide, 3-ethyl-4-methyl-N-(4-(N-(((1r,4r)-4-methylcyclohexyl)carbamoyl)sulfamoyl)phenethyl)-2-oxo-2,5-dihydro-1H-pyrrole-1-carboxamide, 3-ethyl-4-methyl-N-(4-(N-((4-methylcyclohexyl)carbamoyl)sulfamoyl)phenethyl)-2-oxo-2,5-dihydro-1H-pyrrole-1-carboxamide, 3-ethyl-4-methyl-N-(4-(N-((trans-4-methylcyclohexyl)carbamoyl)sulfamoyl)phenethyl)-2-oxo-2,5-dihydro-1H-pyrrole-1-carboxamide, 3-ethyl-4-methyl-N-[2-(4-{[(4-methylcyclohexyl)carbamoyl]sulfamoyl}phenyl)ethyl]-2-oxo-2,5-dihydro-1H-pyrrole-1-carboxamide, 3-Ethyl-4-Methyl-N-[2-(4-{[(Cis-4-Methylcyclohexyl)carbamoyl]sulfamoyl}phenyl)ethyl]-2-Oxo-2,5-Dihydro-1h-Pyrrole-1-Carboxamide, 3-ETHYL-4-METHYL-N-[2-[4-[(TRANS-4-METHYLCYCLOHEXYL) CARBAMOYLSULFAMOYL]PHENYL]ETHYL]-2-OXO-5H-PYRROL-1-CARBOXAMIDE, 3-Ethyl-4-methyl-N-[2-[4-[[3-(4-methylcyclohexyl)ureido]sulfonyl]phenyl]ethyl]-2-oxo-2,5-dihydro-1H-pyrrole-1-carboxamide, 3-ethyl-4-methyl-N-{2-[4-({[(4-methylcyclohexyl)carbamoyl]amino}sulfonyl)phenyl]ethyl}-2-oxo-2,5-dihydro-1H-pyrrole-1-carboxamide, cis-3-Ethyl-2,5-dihydro-4-methyl-N-[2-[4-[[[[(cis-4-methylcyclohexyl)amino]carbonyl]amino]sulfonyl]phenyl]ethyl]-2-oxo-1H-pyrrole-1-carboxamide, N'-{[4-(2-{[(3-ethyl-4-methyl-2-oxo-2,5-dihydro-1H-pyrrol-1-yl)carbonyl]amino}ethyl)phenyl]sulfonyl}-N-(4-methylcyclohexyl)carbamimidic acid, N-[4-[2-(3-ethyl-4-methyl-2-oxo-3-pyrroline-1-carboxamido)-ethyl]-benzenesulfonyl]-N'-4-methylcyclohexylurea, TRANS-1-(4-(2-(3-ETHYL-4-METHYL-2-OXO-2,5-DIHYDRO-1H-PYRROLE-1-CARBOXAMIDO)ETHYL)PHENYLSULFONYL)-3-(4-METHYLCYCLOHEXYL)UREA, trans-3-Ethyl-2,5-dihydro-4-methyl-N-[2-[4-[[[[(4-methyl cyclohexyl)amino]carbonyl]amino]sulfonyl]phenyl]ethyl]-2-oxo-1H-pyrrole-1-carboxamide, Trans-3-Ethyl-2,5-dihydro-4-methyl-N-[2-[4-[[[[(4-methylcyclohexyl)amino]carbonyl]amino]sulfonyl]phenyl]ethyl]-2-oxo-1H-pyrrole-1-carboxamide


ID: 2463

chemical graph of compound 2463



InChIKey: WIHMBLDNRMIGDW-UHFFFAOYSA-N
SMILES: CN(C)CCCC1(C2=C(CO1)C=C(C=C2)C#N)C3=CC=C(C=C3)F.Br

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 77995
synonyms found at PubChem are:
citalopram hydrobromide, 59729-32-7, Citalopram HBr, Cipramil, Celexa, 1-(3-(Dimethylamino)propyl)-1-(4-fluorophenyl)-1,3-dihydroisobenzofuran-5-carbonitrile hydrobromide, Elopram, Seropram, Citalopram (hydrobromide), Nitalapram HBr, Bonitrile HBr, Prepram HBr, HSDB 7042, EINECS 261-890-6, Lu 10-171-B, 1-[3-(Dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydro-5-isobenzofurancarbonitrile hydrobromide, Citalopram hydrobromide [USAN], Lu 10-171 HBr, CITALOPRAM, HYDROBROMIDE SALT, CPD000326936, Celexa (TN), Q-200865, W-105304, Citalopram hydrobromide (USAN), 1-(3-(dimethylamino)propyl)-1-(p-fluorophenyl)-5-phthalancarbonitrile monohydrobromide, 1-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-3H-2-benzofuran-5-carbonitrile hydrobromide, 1-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-3H-isobenzofuran-5-carbonitrile hydrobromide, 1-(3-(Dimethylamino)propyl)-1-(4-fluorophenyl)-1,3-dihydroisobenzofuran-5-carbonitrile monohydrobromide, 1-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydro-2-benzofuran-5-carbonitrile hydrobromide, 5-Isobenzofurancarbonitrile, 1-(3-(dimethylamino)propyl)-1-(4-fluorophenyl)-1,3-dihydro-, monohydrobromide, SMR000326936, LU-10171B, SR-01000003129, Apertia, Prisdal, Lupram, Sepram, 1-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-3H-2-benzofuran-5-carbonitrile;hydrobromide, recital hydrobromide, 1-[3-(Dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydroisobenzofuran-5-carbonitrile Hydrobromide, Citalopram hydrobromide [USAN:USP], 1-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydro-5-isobenzofurancarbonitrile, AC1L2U9E, SCHEMBL1118, C20H21FN2O.HBr, CITALOPRAM BROMOHYDRATE, MLS000758293, MLS000860078, MLS001401376, MLS002222294, ARK092, CHEMBL1200781, CTK8B3679, KS-00000FXR, DTXSID40872344, MolPort-003-940-770, WIHMBLDNRMIGDW-UHFFFAOYSA-N, Pharmakon1600-01504172, NITALAPRAM HYDROBROMIDE SALT, HY-B1287, Lu-10-171B, Tox21_500258, ANW-42935, BG0143, MFCD02101306, NSC758684, s4749, ZD-211, AKOS005145738, AB10921, AC-1595, API0006328, BCP9000537, CCG-101022, CCG-213271, CS-4735, KS-1043, LP00258, LU-10-171 HYDROBROMIDE SALT, NC00272, NSC-758684, RP17855, NCGC00093717-01, NCGC00093717-02, NCGC00093717-03, NCGC00260943-01, AK-72795, AN-14765, BC207875, BR-72795, Citalopram hydrobromide, >=98% (HPLC), LS-84329, SAM001246599, SAM001247086, SC-18021, AB0107058, AB1010898, AX8121801, ST2403129, TL8003797, TR-020691, 4CH-017662, EU-0100258, FT-0600173, C 7861, D00822, J10477, 729C327, A832439, I06-0616, SR-01000003129-2, SR-01000003129-4, SR-01000003129-10, Z1550648760, Citalopram Hydrobromide 0.1 mg/ml in Methanol (as free base), Citalopram Hydrobromide 1.0 mg/ml in Methanol (as free base), Citalopram hydrobromide, European Pharmacopoeia (EP) Reference Standard, Citalopram hydrobromide, United States Pharmacopeia (USP) Reference Standard, Citalopram for system suitability, European Pharmacopoeia (EP) Reference Standard, Citalopram Hydrobromide, Pharmaceutical Secondary Standard; Certified Reference Material, (S)-1-(3-(dimethylamino)propyl)-1-(4-fluorophenyl)-1,3-dihydroisobenzofuran-5-carbonitrile hydrobromide, 1-(3-(Dimethylamino)propyl)-1,-(4-fluorophenyl)-1,3-dihydroisobenzofuran-5-carbonitrile monohydrobromide, 1-[3-(DIMETHYLAMINO)PROPYL]-1-(4-FLUOROPHENYL)-1,3-DIZOHYDRO-5-ISOBENZOFURANCARBONITRILE HYDROBROMIDE SALT, 5-Isobenzofurancarbonitrile, 1-(3-(dimethylamino)propyl)-1-(4-fluorophenyl)-1,3-dihydro-,monohydrobromide, 5-ISOBENZOFURANCARBONITRILE, 1-[3-(DIMETHYLAMINO)PROPYL]-1-(4-FLUOROPHENYL)-1,3-DIHYDRO-, HYDROBROMIDE (1:1), MolPort-005-973-306, MCULE-1202550254, Q-200866, 1-(3-(dimethylamino)propyl)-1-(4-fluorophenyl)-1,3-dihydro-5-isobenzofurancarbonitrile monohydrobromide, 3-[5-cyano-1-(4-fluorophenyl)-1,3-dihydro-2-benzofuran-1-yl]-N,N-dimethylpropan-1-aminium bromide, AKOS026750117


ID: 2464

chemical graph of compound 2464



InChIKey: WIIZEEPFHXAUND-UHFFFAOYSA-N
SMILES: CN(C)CCOC1=CC=C(C=C1)CNC(=O)C2=CC(=C(C(=C2)OC)OC)OC.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 68385
synonyms found at PubChem are:
Trimethobenzamide hydrochloride, 554-92-7, Tigan, Nauseton, Trimethobenzamide HCL, Ametik hydrochloride, Poligerim, Ibikin, Anaus, Tebamide, N-(4-(2-(Dimethylamino)ethoxy)benzyl)-3,4,5-trimethoxybenzamide hydrochloride, UNII-WDQ5P1SX7Q, EINECS 209-075-6, NSC 37882, WDQ5P1SX7Q, Trimethobenzamide hydrochloride [USP], Ro 2-9578, Ticon, 4-(2-Dimethylaminoethoxy)-N-(3,4,5-trimethoxybenzoyl)benzylamine hydrochloride, N-(p-(2-(Dimethylamino)ethoxy)benzyl)-3,4,5-trimethoxybenzamide hydrochloride, Benzamide, N-((4-(2-(dimethylamino)ethoxy)phenyl)methyl)-3,4,5-trimethoxy-, monohydrochloride, DSSTox_CID_27754, DSSTox_RID_82531, N-(p-(2-(Dimethylamino)ethoxy)benzyl)-3,4,5-trimethoxybenzamide monohydrochloride, DSSTox_GSID_47774, T-Gen, Trimethobenzamide hydrochloride (USP), Benzamide, N-(p-(2-(dimethylamino)ethoxy)benzyl)-3,4,5-trimethoxy-, hydrochloride, NCGC00016509-01, CAS-554-92-7, N-[[4-[2-(dimethylamino)ethoxy]phenyl]methyl]-3,4,5-trimethoxybenzamide;hydrochloride, N-[4-[2-(Dimethylamino)ethoxy]benzyl]-3,4,5-trimethoxybenzamide Hydrochloride, trimethobenzamide monohydrochloride, N-({4-[2-(dimethylamino)ethoxy]phenyl}methyl)(3,4,5-trimethoxyphenyl)carboxami de, chloride, TRIMETHOBENZAMIDEHYDROCHLORIDE, Prestwick_526, AC1Q3DTA, AC1L29MV, SCHEMBL41339, MLS002154193, C21H28N2O5.HCl, SPECTRUM1500594, 138-56-7 (Parent), CHEMBL1200887, DTXSID7047774, HMS1568O21, HMS1921G21, Pharmakon1600-01500594, NSC37882, Tox21_110465, CCG-40276, HY-12751A, NSC-37882, NSC757359, SBB058189, AKOS022172835, Tox21_110465_1, CS-7696, MCULE-6632962832, NSC-757359, NCGC00016509-06, NCGC00094803-01, NCGC00094803-02, AK140655, Benzamide,4,5-trimethoxy-, hydrochloride, LS-26624, SMR001233483, AX8155412, Benzamide,4,5-trimethoxy-, monohydrochloride, FT-0736653, ST24048359, ST51015132, V1615, D02733, WLN: 1OR BO1 CO1 EVM1R DO2N1&1 &GH, 554T927, C-46072, SR-05000001733-3, N-[p-[2-(Dimethylamino)ethoxy]benzyl]-3,5-trimethoxybenzamide hydrochloride, 4-[(2-Dimethylamino)ethoxy]-N-(3,5-trimethoxybenzoyl)benzylamine hydrochloride, Benzamide, N-(p-(2-(dimethylamino)ethoxy)benzyl)-3,4,5-trimethoxy-, monohydrochloride, N-[[4-(2-dimethylaminoethyloxy)phenyl]methyl]-3,4,5-trimethoxybenzamide hydrochloride, n-{4-[2-(dim |thylamino) |thoxy]benzyl}-3,4,5-trim |thoxybenzamide chlorhydrate, Benzamide, N-(p-(2-(dimethylamino)ethoxy)benzyl)-3,4,5-trimethoxy-, monohydrochloride (8CI)


ID: 2465

chemical graph of compound 2465



InChIKey: WIMWMKZEIBHDTH-UHFFFAOYSA-N
SMILES: CN(C)CCCN1C2=CC=CC=C2CCC3=C1C=C(C=C3)Cl.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 68539
synonyms found at PubChem are:
Clomipramine hydrochloride, 17321-77-6, Anafranil, Clomipramine HCL, 3-(3-chloro-10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-N,N-dimethylpropan-1-amine hydrochloride, Anaphranil, 3-Chloroimipramine hydrochloride, Chloroimipramine monohydrochloride, Chlorimipramine hydrochloride, UNII-2LXW0L6GWJ, Clomipramine (hydrochloride), Clomipramine Monohydrochloride, Clomicalm, EINECS 241-344-3, 2LXW0L6GWJ, MLS000028511, CHEBI:3755, VR-776, CPD000058295, I615, SMR000058295, C19H23ClN2.HCl, 3-Chloro-5-(3-(dimethylamino)propyl)-10,11-dihydro-5H-dibenz(b,f)azepine monohydrochloride, 5H-Dibenz(b,f)azepine-5-propanamine, 3-chloro-10,11-dihydro-N,N-dimethyl-, monohydrochloride, C19H24Cl2N2, G-34586, 3-(3-chloro-10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)-N,N-dimethylpropan-1-aminium chloride, 3-chloro-5-[3-(dimethylamino)propyl]-10,11-dihydro-5H-dibenz[b,f]azepine monohydrochloride, 5H-Dibenz(b,f)azepine, 10,11-dihydro-3-chloro-5-(3-(dimethylamino)propyl)-, monohydrochloride, SR-01000003088, CAS-17321-77-6, Clomipramine, HCl, Prestwick_72, Clomipramine hydrochloride [USAN:JAN], Anafranil hydrochloride, PubChem21396, Opera_ID_368, Clomipramine Hydochloride, Clomipramine hydrochloride [USAN:USP:JAN], 3-(2-chloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N,N-dimethylpropan-1-amine;hydrochloride, D05AAW, AC1L29YA, AC1Q3BC4, DSSTox_CID_22633, DSSTox_RID_80064, DSSTox_GSID_42633, SCHEMBL41747, MLS001074205, MLS002222159, MLS002548879, SPECTRUM2300061, REGID_for_CID_68539, 303-49-1 (Parent), CHEMBL1200710, DTXSID3042633, CTK8C1351, MolPort-000-917-725, HMS1568F20, Pharmakon1600-02300061, BCP28468, HY-B0457, KS-00000XL9, KS-00002WV3, Tox21_301819, Tox21_500307, ANW-66321, CCG-39492, MFCD00069234, NSC759323, s2541, Anafranil hydrochloride; Chloripramine, AKOS015895084, Clomipramine hydrochloride (Anafranil), AC-8082, AN-8372, API0002068, Clomipramine hydrochloride (JP17/USP), CS-2568, KS-1044, LP00307, NC00678, NSC-759323, (non-labelled)Clomipramine-13C-d3 HCl, NCGC00093756-01, NCGC00093756-02, NCGC00093756-03, NCGC00093756-04, NCGC00178275-01, NCGC00178275-02, NCGC00255897-01, NCGC00260992-01, BC251905, LS-60387, SAM002264601, SC-18841, AB0013787, AB1009567, AX8041370, LS-173091, TC-155066, EU-0100307, FT-0623989, ST24041426, ST51014962, C 7291, D00811, J10410, MLS-0090819.0001, 321C776, Clomipramine hydrochloride, >=98% (HPLC), powder, I06-0497, SR-01000003088-2, SR-01000003088-4, SR-01000003088-5, SR-01000003088-9, Premature ejaculation therapy (inhaled, PowerHale), Vectura, 1-(2,4-Dichloro-|A-[(2,4-dichlorobenzyl)oxy]phenethyl)imidazole, Clomipramine Hydrochloride 1.0 mg/ml in Methanol (as free base), 3-Chloro-10,11-dihydro-N,N-di- methyl-5H-dibenz[b,f]azepine-5-propanamine hydrochloride, 3-Chloro-10,11-dihydro-N,N-di-methyl-5H-dibenz[b,f]azepine-5-propanamine hydrochloride, 3-Chloro-10,11-dihydro-N,N-dimethyl-5H-dibenz(Z)[b,f]azepine-5-propanamine hydrochloride, Clomipramine hydrochloride, Pharmaceutical Secondary Standard; Certified Reference Material, Clomipramine hydrochloride, United States Pharmacopeia (USP) Reference Standard, (3-{5-chloro-2-azatricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaen-2-yl}propyl)dimethylamine hydrochloride, 3-(2-chloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N,N-dimethyl-propan-1-amine hydrochloride, 3-(2-chloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N,N-dimethylpropan-1-amine hydrochloride, 3-(3-CHLORO-10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN-5-YL)-N,N-DIMETHYLPROPAN-1-AMINE HCL, 5H-Dibenz(b,f)azepine, 10,11-dihydro-3-chloro-5-(3-(dimethylamino)propyl)-,monohydrochloride, 5H-Dibenz[b,f]azepine-5-propanamine, 3-chloro-10,11-dihydro-N,N-dimethyl-, hydrochloride (1:1), Clomipramine hydrochloride, for microbiological assay, European Pharmacopoeia (EP) Reference Standard, AC1LCWBD, AKOS026749844, 3-Chloro-5-[3-(dimethylamino)propyl]-10,11-dihydro-5 H-dibenzazepine HCl, 3-(2-chloro-5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N,N-dimethylpropan-1-amine; hydron; chloride, MolPort-000-731-151, MCULE-6495409435


ID: 2466

chemical graph of compound 2466



InChIKey: WIONIXOBNMDJFJ-UHFFFAOYSA-N
SMILES: COC1=C2C=COC2=NC3=CC=CC=C31

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 68085
synonyms found at PubChem are:
Dictamnine, Dictamine, 484-29-7, 4-Methoxyfuro[2,3-b]quinoline, CCRIS 1583, UNII-HQZ3798D0A, Furo(2,3-b)quinoline, 4-methoxy-, Furo[2,3-b]quinoline, 4-methoxy-, BRN 0176932, C12H9NO2, CHEBI:4512, HQZ3798D0A, WIONIXOBNMDJFJ-UHFFFAOYSA-N, Furo[2,3-b]quinoline,4-methoxy-, Q-100537, Diktaminin, Dictamnine,(S), Spectrum_000597, SpecPlus_000044, AC1Q4FDA, Spectrum2_000349, Spectrum3_000101, Spectrum4_001383, Spectrum5_000086, Oprea1_134081, Oprea1_294767, BSPBio_001682, KBioGR_001706, KBioSS_001077, SPECTRUM100541, 4-27-00-02030 (Beilstein Handbook Reference), CHEMBL22533, DivK1c_006140, SPBio_000417, SCHEMBL1760700, DTXSID0041012, CTK4J0807, KBio1_001084, KBio2_001077, KBio2_003645, KBio2_006213, KBio3_000802, 4-Methoxy-furo[2,3-b]quinoline, MolPort-003-665-620, HMS3561L11, ZINC265517, 4-Methoxyfuro[2,3-b]quinoline #, AC1L2901, HY-N0849, CCG-38624, AKOS006274709, CS-3267, MCULE-6817939774, SDCCGMLS-0066336.P001, NCGC00095429-01, NCGC00095429-02, AN-45222, LS-70926, FT-0686595, N2224, V0176, VU0243862-3, C10660, 484D297, SR-05000002442, SR-05000002442-1, BRD-K29178788-001-01-2


ID: 2467

chemical graph of compound 2467



InChIKey: WJCNZQLZVWNLKY-UHFFFAOYSA-N
SMILES: C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5430
synonyms found at PubChem are:
thiabendazole, 148-79-8, Tiabendazole, Mintezol, Equizole, Tiabendazol, Mintesol, Omnizole, Thibenzole, Thiabendazol, Bovizole, Minzolum, Thiabenzole, Thibenzol, 2-(4-Thiazolyl)benzimidazole, Lombristop, Bioguard, Eprofil, Mertect, Mycozol, Nemapan, Polival, Tebuzate, Thiaben, Tiabenda, Triasox, Mertec, Testo, Tobaz, Tbdz, Thibenzole att, APL-luster, Top Form Wormer, Cropasal, Sistesan, Thibendole, Ormogal, Storite, Thibenzole 200, Tecto rph, Hokustar HP, 4-(1H-Benzo[d]imidazol-2-yl)thiazole, Mertect 160, Tecto 10P, Tecto 40F, Tecto 60, Pitrizet, Sanaizol 100, Chemviron TK 100, Thiabendazolum, Thiabendole, Tiabendazolum, Biogard, Drawipas, Mintezole, 1H-Benzimidazole, 2-(4-thiazolyl)-, Tecto, 2-(1,3-Thiazol-4-yl)-1H-benzimidazole, Mertect lsp, E-Z-Ex, Equizole A, TBZ 60W, Captan T, Metasol TK 100, Helmindrax octelmin, Thiabenzazole, Arbotect, Thiprazole, Tresaderm, Tubazole, 2-Thiazole-4-ylbenzimidazole, Hymush, Nemacin, Mertect 340f, 4-(2-Benzimidazolyl)thiazole, 2-(4-Thiazolyl)-1H-benzimidazole, Metasol TK-100, Syntol M100, MK 360, Equivet TZ, Tecto B, Tibimix 20, 2-(Thiazol-4-yl)benzimidazole, 2-(1,3-Thiazol-4-yl)benzimidazole, Thiabendazole [BSI:ISO], TBZ 6, Benzimidazole, 2-(4-thiazolyl)-, RTU Flowable Fungicide, 2-(4'-Thiazolyl)benzimidazole, Mintezol (TN), Metasol tk 10, Thiabendazole [USAN:BAN], Tiabendazolum [INN-Latin], TBZ-6, Thiabendazole (USP), 2-[4-Thiazoly]benzimidazole, MK-360, Caswell No. 849A, Tiabendazole (JAN/INN), 4-(1H-benzimidazol-2-yl)thiazole, 1yvm, Tiabendazol [INN-Spanish, French], G 491, UNII-N1Q45E87DT, 2-(1,3-thiazol-4-yl)-1H-1,3-benzodiazole, 5-(4-Thiazolyl)benzimidazole, CCRIS 4510, RPH, HSDB 2027, 2-Thiazol-4-yl-1H-benzoimidazole, EINECS 205-725-8, NSC 90507, CHEMBL625, EPA Pesticide Chemical Code 060101, NSC 525040, BRN 0611403, 4-(1H-benzimidazol-2-yl)-1,3-thiazole, AI3-50598, MLS000053094, N1Q45E87DT, CHEBI:45979, WJCNZQLZVWNLKY-UHFFFAOYSA-N, NSC90507, NSC525040, 2-(4-THIAZOLYL)-BENZIMIDAZOLE, NCGC00016410-06, NCGC00016410-13, CAS-148-79-8, CPD000058170, E233, SMR000058170, 2-(1,3-thiazol-4-yl)-1H-benzoimidazole, DSSTox_CID_1337, DSSTox_RID_76091, DSSTox_GSID_21337, 98002-42-7, 4-benzimidazol-2-yl-1,3-thiazole, WLN: T56 BM DNJ C-ET5N CSJ, Metasol TK 25, 2-[35S]thiazol-4-yl-1H-benzoimidazole, SR-01000000188, Thiabendazole [USAN:USP], Tiabendazolo, 2-(4-Thiazoly)-benzimidazole, Mintezol;Equizole, Tresaderm (TN), Tiabendazole, INN, Arbotect (TN), 2-(4-thiazolyl)-1h-benzoimidazole, Thiabendazole(usan), Prestwick_813, Thiabendazole W.P., Tiabendazole [INN], Thiabendazole, 98%, 93030-56-9, Spectrum_000039, Opera_ID_336, AC1L1KCB, Prestwick0_000524, Prestwick1_000524, Prestwick2_000524, Prestwick3_000524, Spectrum2_001331, Spectrum3_001407, Spectrum4_000354, Spectrum5_001009, D08QCJ, PS1057_SUPELCO, AC1Q4W1V, NCIOpen2_005709, SCHEMBL19842, BSPBio_000507, BSPBio_003054, KBioGR_000787, KBioSS_000399, 2(4-thiazolyl)-benzimidazole, MLS000069718, BIDD:ER0372, DivK1c_000072, SPECTRUM1500570, SPBio_001481, SPBio_002428, ACMC-209d18, BPBio1_000559, GTPL7304, DTXSID0021337, Thiabendazole, >=99%, powder, CTK5H6812, HMS500D14, KBio1_000072, KBio2_000399, KBio2_002967, KBio2_005535, KBio3_002274, KS-00000ZCK, ZINC73711, Mintezol, Equizole, Thiabendazole, MolPort-001-002-054, NINDS_000072, HMS1569J09, HMS1921E05, HMS2092M07, HMS2096J09, HMS2230F20, HMS3259E20, HMS3372E11, HMS3655E08, HMS3713J09, Pharmakon1600-01500570, ALBB-023635, BCP19179, HY-B0263, Tox21_110427, Tox21_202397, Tox21_300970, ANW-21162, BDBM50121347, CCG-39633, LS-864, MFCD00005587, NSC-90507, NSC757347, s1739, SBB007366, STK394289, AKOS000120940, Tox21_110427_1, CS-2250, DB00730, MCULE-3720823189, NC00593, NSC-525040, NSC-757347, RL01881, RTR-035755, SDCCGMLS-0002984.P003, IDI1_000072, Thiabendazole 10 microg/mL in Methanol, NCGC00016410-01, NCGC00016410-02, NCGC00016410-03, NCGC00016410-04, NCGC00016410-05, NCGC00016410-07, NCGC00016410-08, NCGC00016410-09, NCGC00016410-10, NCGC00016410-11, NCGC00016410-12, NCGC00016410-14, NCGC00016410-15, NCGC00016410-18, NCGC00021671-04, NCGC00021671-05, NCGC00021671-06, NCGC00021671-07, NCGC00021671-08, NCGC00021671-09, NCGC00021671-10, NCGC00254873-01, NCGC00259946-01, Thiabendazole 100 microg/mL in Methanol, AC-10139, AJ-10296, AN-43996, BAS 00600238, KB-61578, NCI60_004280, NCI60_042006, SAM002564239, SC-80172, ST023311, ZB002645, MLS-0002984.P004, SBI-0051531.P003, AB2000263, Thiabendazole 10 microg/mL in Acetonitrile, TL8001064, TR-035755, AB00052107, FT-0608694, R1124, ST24028725, 2-(1,3-Thiazol-4-yl)-1H-benzimidazole #, Thiabendazole, BAN, BSI, ISO, JMAF, USAN, 48T798, C07131, D00372, AB00052107_17, AB00052107_18, Thiabendazole, PESTANAL(R), analytical standard, I06-0809, SR-01000000188-2, SR-01000000188-4, SR-01000000188-5, W-108097, BRD-K77695569-001-05-2, BRD-K77695569-001-16-9, BRD-K77695569-001-28-4, A0920/0043056, Thiabendazole, certified reference material, TraceCERT(R), Thiabendazole, BioReagent, plant cell culture tested, powder, Tiabendazole, European Pharmacopoeia (EP) Reference Standard, Thiabendazole, United States Pharmacopeia (USP) Reference Standard, Thiabendazole, Pharmaceutical Secondary Standard; Certified Reference Material, 1135441-27-8, 123242-33-1, 145316-67-2, 8018-04-0, 8027-10-9, 8028-27-1, 94977-06-7


ID: 2468

chemical graph of compound 2468



InChIKey: WJHQHAFOOMOTBJ-MSHADUKESA-N
SMILES: C[C@@]12CCC3C(=C1C=C(O[C@H]2C4=COC=C4)OC)C[C@H]5[C@@H](C([C@@H]([C@@]3(C5=O)C)CC(=O)OC)(C)C)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6708594
synonyms found at PubChem are:
3-DEOXO-3beta-HYDROXYMEXICANOLIDE 16-ENOL ETHER, KBio3_000987, Spectrum_000698, SpecPlus_000179, Spectrum2_000264, Spectrum3_000054, Spectrum4_001336, Spectrum5_000211, BSPBio_001807, KBioGR_001831, KBioSS_001178, DivK1c_006275, SPBio_000108, CHEMBL3039278, SCHEMBL12998318, KBio1_001219, KBio2_001178, KBio2_003746, KBio2_006314, NCGC00178992-01, SR-05000002718, SR-05000002718-1


ID: 2469

chemical graph of compound 2469



InChIKey: WJHZBTMHUNVIKC-UHFFFAOYSA-N
SMILES: CCCCC(=O)OC1=CC=CC=C1C(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 135269
synonyms found at PubChem are:
Valeryl Salicylate, 2-Valeryloxybenzoic acid, Salicylic acid, valerate, 64206-54-8, Valerylsalicylic acid, Valeroyl Salicylate, VALERYL SALYCILATE, 2-pentanoyloxybenzoic acid, Benzoic acid, 2-((1-oxopentyl)oxy)-, BRN 3292055, 2-(pentanoyloxy)benzoic acid, CHEBI:78250, valerylsalicylate, vsa, Pentanoylsalicylic acid, O-valerylsalicylic acid, O-pentanoylsalicylic acid, Spectrum2_000160, Spectrum3_001983, BSPBio_003583, SPECTRUM1505336, SPBio_000300, SCHEMBL6467137, CHEMBL1359634, BDBM85243, CTK5C0915, KBio3_002990, DTXSID40214422, MolPort-003-666-640, WJHZBTMHUNVIKC-UHFFFAOYSA-N, HMS3649A18, AC1L3645, ZINC2390211, 1370AH, CCG-38955, MFCD00041466, AKOS005359496, Benzoic acid,2-[(1-oxopentyl)oxy]-, Valeryl Salicylate, >=98% (HPLC), API0008394, NCGC00095350-01, NCGC00095350-02, NCGC00095350-03, CAS_64206-54-8, LS-144423, FT-0706082, SR-01000946594, SR-01000946594-1, BRD-K66089377-001-02-0


ID: 2470

chemical graph of compound 2470



InChIKey: WJMJXJYEGROEHH-UHFFFAOYSA-N
SMILES: CC1(CCC2=C(O1)C=C3C(=C2OC)C(=C(C(=O)O3)C4=CC=C(C=C4)OC)O)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 54686939
synonyms found at PubChem are:
DIHYDROROBUSTIC ACID, KBio3_002137, AC1LKRCC, Spectrum2_001923, Spectrum3_001139, Spectrum4_001986, BSPBio_002637, KBioGR_002518, SPECTRUM1401037, SPBio_001925, CHEMBL1438224, CHEBI:93652, ZINC5408229, CCG-38490, SDCCGMLS-0066853.P001, NCGC00095745-01, NCGC00095745-02, BRD-K94412972-001-01-1, 8-hydroxy-5-methoxy-7-(4-methoxyphenyl)-2,2-dimethyl-3,4-dihydropyrano[3,2-g]chromen-6-one


ID: 2471

chemical graph of compound 2471



InChIKey: WJOHZNCJWYWUJD-IUGZLZTKSA-N
SMILES: CC(=O)OCC(=O)[C@@]12[C@@H](C[C@@H]3[C@@]1(C[C@@H]([C@]4([C@H]3C[C@@H](C5=CC(=O)C=C[C@@]54C)F)F)O)C)OC(O2)(C)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 9642
synonyms found at PubChem are:
fluocinonide, 356-12-7, Fluocinolide, Lidex, Metosyn, Topsyn, Vanos, Fluocinolide acetate, Fluocinolone acetonide 21-acetate, Fluocinolone acetonide acetate, Bestasone, Biscosal, Cortalar, Fluonex, LIDEX-E, Straderm, Topsymin, Lonide, Lyderm, Synalar acetate, Lidex E, Fluocinonido, Fluocinonidum, Fluocinonidum [INN-Latin], Fluocinonide Emulsified Base, Fluocinonido [INN-Spanish], Fluocinonide FAPG, Fluzon, C26H32F2O7, UNII-2W4A77YPAN, Fluocinonide [USAN:BAN:INN:JAN], Vanos (TN), Fluocinonide, micronised, Fluocinonide [USAN:INN:BAN:JAN], EINECS 206-597-6, LIDEX (TN), NSC 101791, 2W4A77YPAN, MLS000028476, 6alpha,9-Difluoro-11beta,16alpha,17,21-tetrahydroxypregna-1,4-diene-3,20-dione, cyclic 16,17-acetal with acetone, 21-acetate, Pregna-1,4-diene-3,20-dione, 21-(acetyloxy)-6,9-difluoro-11-hydroxy-16,17-((1-methylethylidene)bis(oxy))-, (6alpha,11beta,16alpha)-, SMR000058331, DSSTox_CID_25307, DSSTox_RID_80793, DSSTox_GSID_45307, Fluocinomide, Pregna-1,4-diene-3,20-dione, 6-alpha, 9-difluoro-11-beta,16-alpha,17,21-tetrahydroxy-, cyclic17-acetal with acetone, 21-acetate, (6ALPHA,11BETA,16ALPHA)-21-(ACETYLOXY)-6,9-DIFLUORO-11-HYDROXY-16,17-[(1-METHYLETHYLIDENE)BIS(OXY)]-PREGNA-1,4-DIENE-3,20-DIONE, Pregna-1,4-diene-3,20-dione, 6alpha,9-difluoro-11beta,16alpha,17,21-tetrahydroxy-, cyclic 16,17-acetal with acetone, 21-acetate, Pregna-1,4-diene-3,20-dione, 6alpha,9-difluoro-11beta,16alpha,17,21-tetrahydroxy-, cyclic 16,17-acetal with acetone, 21-acetate (8CI), flucetonide, NCGC00016436-01, CAS-356-12-7, Fluocinonide(Vanos), Fluonex (TN), Lonide (TN), Lyderm (TN), Prestwick_1066, Fluocinonide (Vanos), Fluocinonide(Vanos)/, Lidex-E (TN), Fluocinonide [USAN:USP:INN:BAN:JAN], Opera_ID_1780, Prestwick0_000774, Prestwick1_000774, Prestwick2_000774, Prestwick3_000774, FLUOCINOMIDE ACETATE, D03ZZK, AC1L1TI1, SCHEMBL4262, CHEMBL1501, BSPBio_000848, SPBio_002787, BPBio1_000934, CHEBI:5109, GTPL7078, DTXSID8045307, Fluocinonide (JP15/USP/INN), Fluocinonide (JP17/USP/INN), Fluocinonide, >=98% (HPLC), MolPort-002-528-921, HMS1570K10, HMS2097K10, HMS2234H04, HMS3259N05, HMS3714K10, HY-B0485, ZINC3977978, Tox21_110438, ABP000638, MFCD00079302, s2608, AKOS015896516, Tox21_110438_1, AC-2071, API0002731, BCP9000697, CCG-220774, CS-2601, DB01047, NC00621, RL03345, YF10077, FLUOCINONIDE ACETONIDE 21-ACETATE, NCGC00022398-03, NCGC00022398-05, BC214760, SC-78862, Fluonex;Lidex;Lidex-E;Lonide;Lyderm;Vanos, AB2000697, LS-118446, C07007, D00325, 20527-EP2371811A2, 356F127, SR-01000003097, I06-2489, SR-01000003097-3, W-106660, BRD-K57886322-001-03-4, BRD-K57886322-001-12-5, Fluocinonide, United States Pharmacopeia (USP) Reference Standard, 1,4-PREGNADIEN-6ALPHA,9ALPHA-DIFLUORO-11BETA,16ALPHA,17,21-TETROL-3,20-DIONE 16,17-ACETONIDE 21-ACETATE, 2-((2S,6aS,6bR,7S,8aS,8bS,11aR,12aS,12bS)-2,6b-difluoro-7-hydroxy-6a,8a,10,10-tetramethyl-4-oxo-1,2,4,6a,6b,7,8,8a,11a,12,12a,12b-dodecahydro-8bH-naphtho[2',1':4,5]indeno[1,2-d][1,3]dioxol-8b-yl)-2-oxoethyl acetate, 2-[(1S,2S,4R,8S,9S,11S,12R,13S,19S)-12,19-difluoro-11-hydroxy-6,6,9,13-tetramethyl-16-oxo-5,7-dioxapentacyclo[10.8.0.0;{2,9}.0;{4,8}.0;{13,18}]icosa-14,17-dien-8-yl]-2-oxoethyl acetate


ID: 2472

chemical graph of compound 2472



InChIKey: WJPVTNJDDFIBKU-UHFFFAOYSA-N
SMILES: CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(C)C.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 83592
synonyms found at PubChem are:
Isopyrin hydrochloride, 18342-39-7, Ramifenazone Hydrochloride, Ramifenazone Hydrochloride Salt, UNII-182MZB7ZV8, 1,2-Dihydro-4-((isopropyl)amino)-1,5-dimethyl-2-phenyl-3H-pyrazol-3-one hydrochloride, 182MZB7ZV8, Isopyrin HCl, C14H20ClN3O, 13576-96-0, 3615-24-5 (Parent), ramiphenazone, 1,2-dihydro-4-[(isopropyl)amino]-1,5-dimethyl-2-phenyl-3H-pyrazol-3-one hydrochloride, SR-01000838870, NCGC00095073-01, Ramifenazon, EINECS 237-010-1, EINECS 242-222-2, Prestwick_1002, Isopirina Hydrochloride, Isopyrine Hydrochloride, AC1Q3EMV, AC1L35QU, MLS002153974, SPECTRUM1503822, CHEMBL1567296, CTK8D7677, MolPort-003-981-172, HMS1570A06, HMS1922I16, Pharmakon1600-01503822, Isopropylaminophenazone Hydrochloride, CCG-39370, NSC758621, AKOS015913905, NSC-758621, 1,2-Dihydro-4-(isopropylamino)-1,5-dimethyl-2-phenyl-3H-pyrazol-3-one monohydrochloride, ACM18342397, NCGC00095073-02, 4-(Isopropylamino)phenazone Hydrochloride, AS-13536, I619, M592, SMR001233311, 4-(Isopropylamino)antipyrine Hydrochloride, AB0013791, TC-030353, FT-0674315, 342R397, C-34527, J-011743, SR-01000838870-2, SR-01000838870-3, I14-43582, 1-Phenyl-2,3-dimethyl-4-isopropylaminopyrazolone Hydrochloride, 1,5-dimethyl-2-phenyl-4-(propan-2-ylamino)pyrazol-3-one hydrochloride, 4-Isopropylamino-2,3-dimethyl-1-phenyl-3-pyrazolin-5-one Hydrochloride, 4-Monoisopropylamino-1-phenyl-2,3-dimethyl-5-pyrazolone Hydrochloride, 1,2-Dihydro-1,5-dimethyl-4-[(1-methylethyl)amino]-2-phenyl-3H-pyrazol-3-one Hydrochloride, 4-(isopropylamino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one hydrochloride, SCHEMBL1652276


ID: 2473

chemical graph of compound 2473



InChIKey: WKEMJKQOLOHJLZ-UHFFFAOYSA-N
SMILES: CN(C)CCC1=CNC2=C1C=C(C=C2)CS(=O)(=O)N3CCCC3

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 123606
synonyms found at PubChem are:
Almotriptan, 154323-57-6, Axert, Almogran, LAS-31416, Almotriptan [USAN:INN:BAN], UNII-1O4XL5SN61, N,N-dimethyl-2-(5-((pyrrolidin-1-ylsulfonyl)methyl)-1H-indol-3-yl)ethanamine, Almotriptan (USAN), 1-(((3-(2-(Dimethylamino)ethyl)indol-5-yl)methyl)sulfonyl)pyrrolidine, 1O4XL5SN61, CHEBI:520985, WKEMJKQOLOHJLZ-UHFFFAOYSA-N, N,N-dimethyl-2-[5-(pyrrolidin-1-ylsulfonylmethyl)-1H-indol-3-yl]ethanamine, PNU-180638, NCGC00095135-01, N,N-dimethyl-5-[(1-pyrrolidinylsulfonyl)methyl]-1H-Indole-3-ethanamine, N,N-dimethyl-2-{5-[(pyrrolidin-1-ylsulfonyl)methyl]-1H-indol-3-yl}ethanamine, Axert (TN), DSSTox_CID_24289, DSSTox_RID_80142, DSSTox_GSID_44289, C17H27N3O2S, dimethyl(2-{5-[(pyrrolidine-1-sulfonyl)methyl]-1H-indol-3-yl}ethyl)amine, Pyrrolidine, 1-(((3-(2-(dimethylamino)ethyl)-1H-indol-5-yl)methyl)sulfonyl)-, Pyrrolidine, 1-[[[3-[2-(dimethylamino)ethyl]-1H-indol-5-yl]methyl]sulfonyl]-, CAS-154323-57-6, LAS 31416, Almotrintan, Almotriptan;, SR-05000001986, Spectrum_001884, AC1L3WYP, Spectrum2_000498, Spectrum3_001006, Spectrum4_001134, Spectrum5_001554, D0P0SM, SCHEMBL1957, CHEMBL1505, BSPBio_002731, KBioGR_001647, KBioSS_002414, BIDD:GT0048, SPECTRUM1505204, SPBio_000395, GTPL7110, DTXSID5044289, CTK8B4281, HY-B0383A, KBio2_002408, KBio2_004976, KBio2_007544, KBio3_001951, ZINC18087, HMS1922L13, Pharmakon1600-01505204, BCP06539, Tox21 111444, Tox21_111444, AN-689, ANW-44596, CCG-39569, FC0030, NSC760092, AKOS015895080, Tox21_111444_1, AC-8799, AM84500, API0000366, CS-4530, DB00918, EBD2201889, NSC-760092, NCGC00095135-02, NCGC00095135-03, NCGC00095135-04, NCGC00095135-05, AJ-08395, DB-064033, LS-173461, TC-133341, FT-0651595, 23A576, D02824, AB01563047_01, AB01563047_02, A809522, L000846, I06-0492, SR-05000001986-1, BRD-K67601717-001-02-0, 1-[[3-(2-dimethylaminoethyl)-5-indolyl]methanesulphonyl]pyrrolidine, 1H-Indole-3-ethanamine, N,N-dimethyl-5-[(1-pyrrolidinylsulfonyl)methyl]-, N,N-dimethyl-2-[5-(1-pyrrolidinylsulfonylmethyl)-1H-indol-3-yl]ethanamine, N,N-dimethyl-2-(5-((pyrrolidin-1-ylsulfonyl)methyl)-1H-indol-3-yl)ethan-1-amine, n,n-dimethyl-2-(5-(pyrrolidin-1-ylsulfonylmethyl)-1h-indol-3-yl)-ethanamine


ID: 2474

chemical graph of compound 2474



InChIKey: WKGXYQFOCVYPAC-UHFFFAOYSA-N
SMILES: C1=CC=C(C=C1)C(COC(=O)N)COC(=O)N

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3331
synonyms found at PubChem are:
felbamate, 25451-15-4, Felbatol, 2-Phenylpropane-1,3-diyl dicarbamate, 2-Phenyl-1,3-propanediol dicarbamate, Felbamyl, Taloxa, Felbamato, Felbamatum, W-554, Felbamatum [Latin], Felbamato [Spanish], Felbamate [USAN:INN], 1,3-Propanediol, 2-phenyl-, dicarbamate, W 554, UNII-X72RBB02N8, ADD-03055, Felbatol (TN), CHEBI:4995, Carbamic acid, 2-phenyltrimethylene ester, C11H14N2O4, Felbamate (USAN/INN), EINECS 247-001-4, BRN 3345236, carbamic acid 2-phenyltrimethylene ester, 3-(carbamoyloxy)-2-phenylpropyl carbamate, (3-carbamoyloxy-2-phenyl-propyl) carbamate, MLS000028465, X72RBB02N8, WKGXYQFOCVYPAC-UHFFFAOYSA-N, NCGC00015429-08, SMR000058448, (3-carbamoyloxy-2-phenylpropyl) carbamate, DSSTox_CID_3041, F 0778, DSSTox_RID_76847, DSSTox_GSID_23041, Q-100326, CAS-25451-15-4, SR-01000000089, HSDB 7525, Tocris-0869, Essex brand of felbamate, AC1L1FOW, Opera_ID_1738, Prestwick0_000919, Lopac-F-0778, Biomol-NT_000203, D05KON, Schering brand of felbamate, CHEMBL1094, Lopac0_000524, SCHEMBL34947, Wallace brand 1 of felbamate, Wallace brand 2 of felbamate, 4-06-00-05993 (Beilstein Handbook Reference), MLS001077299, BIDD:GT0463, BPBio1_001258, GTPL5473, DTXSID9023041, AOB5042, EX-A591, MolPort-003-666-873, HMS2093P19, HMS2234H06, HMS3261J09, HMS3266L12, HMS3370I06, HMS3657I11, HMS3715D20, Pharmakon1600-01505600, Schering-Plough brand of felbamate, BCP27941, HY-B0184, KS-00001F6O, ZINC1530803, Tox21_110145, Tox21_302368, Tox21_500524, 2-Phenyl-1,3-propanedioldicarbamate, ADD 03055, ANW-65602, BDBM50088430, BN0583, MFCD00865296, NSC759866, s1330, AKOS015895100, Tox21_110145_1, AC-8197, AN-4991, API0002680, CCG-204614, CS-2068, DB00949, KS-1171, LP00524, MCULE-2661497722, NSC-759866, NCGC00015429-01, NCGC00015429-02, NCGC00015429-03, NCGC00015429-04, NCGC00015429-05, NCGC00015429-06, NCGC00015429-07, NCGC00015429-09, NCGC00015429-10, NCGC00015429-11, NCGC00015429-14, NCGC00023092-02, NCGC00023092-04, NCGC00023092-05, NCGC00023092-06, NCGC00255275-01, NCGC00261209-01, AJ-26695, CC-28364, CJ-24035, SC-46002, SBI-0050507.P002, AB0011540, AB1008593, AX8130043, KB-232082, LS-120706, TC-154347, EU-0100524, FT-0630517, (3-aminocarbonyloxy-2-phenyl-propyl) carbamate, C07501, D00536, EN300-119542, J90036, K-6677, AB00382985-18, AB00382985_19, 451F154, A817858, C-14192, Carbamic acid 3-carbamoyloxy-2-phenyl-propyl ester, carbamic acid (3-carbamoyloxy-2-phenylpropyl) ester, I06-0353, SR-01000000089-2, SR-01000000089-4, SR-01000000089-7, BRD-K99107520-001-01-9, BRD-K99107520-001-09-2, BRD-K99107520-001-18-3, Z1541638522, Felbamate, United States Pharmacopeia (USP) Reference Standard, 2-?methyl-?4-?(4-?methyl-?1-?piperazinyl)-?10H-?thieno[2,?3-?b][1,?5]benzodiazepine


ID: 2475

chemical graph of compound 2475



InChIKey: WKRLQDKEXYKHJB-HFTRVMKXSA-N
SMILES: C[C@]12CC[C@H]3C(=CCC4=C3C=CC(=C4)O)[C@@H]1CCC2=O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 223368
synonyms found at PubChem are:
equilin, 7-Dehydroestrone, 474-86-2, Dihydroequilenin, 1,3,5,7-Estratetraen-3-ol-17-one, 3-HYDROXYESTRA-1,3,5(10),7-TETRAEN-17-ONE, Equilin [USP], UNII-08O86EX0J4, MLS000028624, CHEBI:42309, WKRLQDKEXYKHJB-HFTRVMKXSA-N, 08O86EX0J4, Equilin (USP), SMR000058656, 3-hydroxy-estra-1,3,5(10),7tetraen-17-one, Estra-1,3,5(10),7-tetraen-17-one,3-hydroxy-, CCRIS 9074, EINECS 207-488-6, NSC 10971, BRN 2624302, (9S,13S,14S)-3-hydroxy-13-methyl-9,11,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-17-one, 3-Hydroxyoestra-1,3,5(10),7-tetraen-17-one, CAS-474-86-2, Prestwick_219, Opera_ID_780, Prestwick0_000850, Prestwick1_000850, Prestwick2_000850, Prestwick3_000850, D0R6DT, AC1L5CI7, DSSTox_CID_27433, DSSTox_RID_82343, DSSTox_GSID_47433, BSPBio_000839, 4-08-00-01366 (Beilstein Handbook Reference), MLS001148117, SCHEMBL124758, SPBio_002760, BPBio1_000923, CHEMBL323533, DTXSID7047433, CTK4J0031, HMS1570J21, HMS2097J21, HMS2233A16, HMS3714J21, HY-B1176, NSC10971, Tox21_302641, 1,5,7-Estratetraen-3-ol-17-one, BDBM50423544, LMST02010026, NSC-10971, AKOS024285096, ZINC100031739, CCG-220850, CS-4786, DB02187, NCGC00179406-01, NCGC00256728-01, ST081365, ZB012993, Equilin, VETRANAL(TM), analytical standard, FT-0632181, 3-Hydroxyestra-1,5(10),7-tetraen-17-one, WLN: L E5 B666 FV JUTTT&J E1 OQ, C14392, D04041, S00287, 3-hydroxy-estra-1,3,5(10), 7-tetraen-17-one, 3-hydroxy-estra-1,3,5(10),7-tetraen-17-one, Estra-1,5(10),7-tetraen-17-one, 3-hydroxy-, SR-01000721841, SR-01000721841-2, BRD-K04046242-001-03-6, 3-Hydroxyestra-1,3,5(10),7-tetraen-17-one (9CI), Equilin, European Pharmacopoeia (EP) Reference Standard, Equilin, United States Pharmacopeia (USP) Reference Standard, (11aS,6bS,8aS)-4-hydroxy-8a-methyl-2,7,8,10,11,11a,6b,8a-octahydrocyclopenta[1 ,2-a]phenanthren-9-one, (9S,13S,14S)-3-hydroxy-13-methyl-9,11,12,13,15,16-hexahydro-6H-cyclopenta[a]phenanthren-17(14H)-one, Equilin; 7-Dehydroestrone; 3-Hydroxy-1,3,5(10),7-estratetraen-17-one; 1,3,5(10),7-Estratetraen-3-ol-17-one


ID: 2476

chemical graph of compound 2476



InChIKey: WKSAUQYGYAYLPV-UHFFFAOYSA-N
SMILES: CCC1=C(C(=NC(=N1)N)N)C2=CC=C(C=C2)Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 4993
synonyms found at PubChem are:
pyrimethamine, 58-14-0, Daraprim, Chloridine, Chloridin, Diaminopyritamin, 5-(4-chlorophenyl)-6-ethylpyrimidine-2,4-diamine, Ethylpyrimidine, Pirimetamina, Chloridyn, Malocide, Pirimecidan, Pirimetamin, Khloridin, Pyrimethamin, Primethamine, Darachlor, Erbaprelina, Tindurin, Malocid, Darapram, Daraprime, Malacid, Maloprim, 5-(4-CHLOROPHENYL)-6-ETHYL-2,4-PYRIMIDINEDIAMINE, Pyremethamine, Pyrimethaminum, Daraclor, 2,4-Pyrimidinediamine, 5-(4-chlorophenyl)-6-ethyl-, Tindurine, Tinduring, 2,4-Diamino-5-(p-chlorophenyl)-6-ethylpyrimidine, 2,4-Diamino-5-chlorophenyl-6-ethylpyrimidine, Pirimetamina [Spanish], BW 50-63, 2,4-Diamino-5-(4-chlorophenyl)-6-ethylpyrimidine, RP 4753, TCMDC-125860, NCI-C01683, Pirimetamina [INN-Spanish], Pyrimethaminum [INN-Latin], 5-(4'-Chlorophenyl)-2,4-diamino-6-ethylpyrimidine, Daraprin, WR 2978, m alocid, Pyrimethamine Hcl, UNII-Z3614QOX8W, Daraprim (TN), C12H13ClN4, CCRIS 546, GNF-Pf-5586, Pyrimethamine (Pyr), 5-(4-Chlorophenyl)-6-ethyl-2,4-diaminopyrimidine, 4753 R.P., TCMDC-123831, NSC 3061, CHEMBL36, EINECS 200-364-2, Pyrimethamine [USAN:INN:BAN:JAN], BRN 0219864, 2,4-Pyrimidinediamine, 5-(p-chlorophenyl)-6-ethyl-, CRL-8131 & Pyrimethamine, CRL-8142 & Pyrimethamine, Lactoferrin B & Pyrimethamine, Lactoferrin H & Pyrimethamine, AI3-25005, MLS000028606, MLS002701881, CHEBI:8673, Pyrimethamine (JAN/USP/INN), Z3614QOX8W, AZT + Pyrimethamine combination, EXR-101, NSC3061, WKSAUQYGYAYLPV-UHFFFAOYSA-N, NSC-3061, 5-[4-Chlorophenyl]-6-ethyl-2,4-pyrimidinediamine, Fansidar (Pyrimethamine/Sulfadoxine), 5-(4-chlorophenyl)-6-ethyl-pyrimidine-2,4-diamine, Pyrimidine, 2,4-diamino-5-(p-chlorophenyl)-6-ethyl-, BW 5063, CAS-58-14-0, NCGC00016256-08, 5-(4-CHLORO-PHENYL)-6-ETHYL-PYRIMIDINE-2,4-DIAMINE, CPD000058714, SMR000058714, DSSTox_CID_1217, DSSTox_RID_76016, DSSTox_GSID_21217, 5-(4-chlorophenyl)-2,4-diamino-6-ethylpyrimidine, 5-(p-chlorophenyl)-6-ethyl-2,4-diaminopyrimidine, CP6, 5-(4-Chlorophenyl)-6-ethyl-2,4-pyrimidi nediamine, Q-201648, BRD9204, BRD-9204, SR-01000003150, HSDB 8042, Pyrimethamine [USP:INN:BAN:JAN], Prestwick_504, PIRIMETMIN, PubChem9611, Daraclor (Salt/Mix), Spectrum_000906, 4km0, Pyrimethamine (Daraprim), AC1L1JDI, Opera_ID_1437, Prestwick0_000037, Prestwick1_000037, Prestwick2_000037, Prestwick3_000037, Spectrum2_000886, Spectrum3_001701, Spectrum4_000494, Spectrum5_001447, D0C0SK, cid_4993, NCIOpen2_008313, BIDD:PXR0173, SCHEMBL25129, BSPBio_000133, BSPBio_003282, KBioGR_001007, KBioSS_001386, MLS001148621, MLS002454446, BIDD:GT0149, DivK1c_000652, SPECTRUM1500520, Aventis Brand of Pyrimethamine, Daraprim;Malocide; Pirimecidan, SPBio_000672, SPBio_002054, BPBio1_000147, GTPL4800, Wellcome Brand of Pyrimethamine, DTXSID9021217, BDBM18512, CTK8B4350, HMS502A14, KBio1_000652, KBio2_001386, KBio2_003954, KBio2_006522, KBio3_002502, KS-00000JIP, ZINC57464, 4753 r.p, MolPort-001-783-655, NINDS_000652, HMS1568G15, HMS1920N12, HMS2092E13, HMS2095G15, HMS2235A17, HMS3259C04, HMS3371L07, HMS3655D09, HMS3712G15, Pharmakon1600-01500520, 2, 5-(p-chlorophenyl)-6-ethyl-, 2, 5-(4-chlorophenyl)-6-ethyl-, Tox21_110332, Tox21_201834, Tox21_300129, ANW-44788, CCG-39626, LS-238, NSC757306, Glaxo Wellcome Brand of Pyrimethamine, AKOS015892534, GlaxoSmithKline Brand of Pyrimethamine, Tox21_110332_1, AB02313, AC-7879, AN-8571, API0003994, CS-1717, DB00205, KS-5223, LS40239, NC00528, NSC-757306, IDI1_000652, NCGC00016256-01, NCGC00016256-02, NCGC00016256-03, NCGC00016256-04, NCGC00016256-05, NCGC00016256-06, NCGC00016256-07, NCGC00016256-09, NCGC00016256-10, NCGC00016256-11, NCGC00016256-12, NCGC00016256-13, NCGC00016256-14, NCGC00016256-16, NCGC00016256-17, NCGC00023188-03, NCGC00023188-04, NCGC00023188-05, NCGC00023188-06, NCGC00023188-07, NCGC00254199-01, NCGC00259383-01, WLN: T6N CNJ BZ DZ ER DG& F2, AK-35735, BC200953, HY-18062, NCI60_002604, SAM002554921, SC-05503, SBI-0051500.P003, AB0011152, AB2000417, AX8021591, ST2406007, TR-020233, 4CH-018330, AB00052084, FT-0631253, P2037, S2006, C07391, D00488, M-1612, MLS-0002822.0001, AB00052084-21, AB00052084_22, AB00052084_25, 057P350, A831755, C-36508, L000713, Pyrimethamine, VETRANAL(TM), analytical standard, Pyrimidine,4-diamino-5-(p-chlorophenyl)-6-ethyl-, 2,4,-Diamino-5-(4-chlorophenyl)-6-ethylpyrimidine, 2,4-diamino-5-(4-chloro-phenyl)-6-ethylpyrimidine, 2,4-diamino-6-ethyl-5-(4-chlorophenyl)pyrimidine, SR-01000003150-2, SR-01000003150-4, BRD-K88429204-001-05-4, BRD-K88429204-001-18-7, BRD-K88429204-001-21-1, BRD-K88429204-001-36-9, Z2065727768, 2,4-Diamino-5-(4-chlorophenyl)-6-ethylpyrimidine, 97%, Pyrimethamine, European Pharmacopoeia (EP) Reference Standard, Pyrimethamine, United States Pharmacopeia (USP) Reference Standard


ID: 2477

chemical graph of compound 2477



InChIKey: WLRMANUAADYWEA-NWASOUNVSA-N
SMILES: CC(C)(C)NC[C@@H](COC1=NSN=C1N2CCOCC2)O.C(=C\C(=O)O)\C(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5281056
synonyms found at PubChem are:
Timolol maleate, 26921-17-5, (S)-Timolol maleate, Timolol maleate salt, Timolol hydrogen maleate, Blocadren, Timacor, Betime, l-Timolol maleate, (S)-Timolol (Maleate), Timoptic in Ocudose, (S)-Timolol hydrogen maleate, UNII-P8Y54F701R, CCRIS 1057, C13H24N4O3S.C4H4O4, EINECS 248-111-5, MK 950, MLS000028539, CHEBI:9600, P8Y54F701R, (-)-1-(tert-Butylamino)-3-((4-morpholino-1,2,5-thiadiazol-3-yl)oxy)-2-propanol maleate, SMR000058305, Blocadren (TN), Timoptic (TN), Istalol (TN), (-)-1-(tert-Butylamino)-3-((4-morpholino-1,2,5-thiadiazol-3-yl)oxy)-2-propanol maleate (1:1) (salt), 2-Propanol, 1-((1,1-dimethylethyl)amino)-3-((4-(4-morpholinyl)-1,2,5-thiadiazol-3-yl)oxy)-, (S)-, (Z)-2-butenedioate (1:1) (salt), S(-)-Timolol maleate, Q-201836, S-(-)-1-(t-Butylamino)-3-[(4-morpholino-1,2,5-thiadiazol-3-yl)oxy]-2-propanol maleate salt, 2-Propanol, 1-(tert-butylamino)-3-((4-morpholino-1,2,5-thiadiazol-3-yl)oxy)-, (-)-, maleate (1:1) (salt), (S)-(-)-Timolol Maleate, (S)-3-(3-(tert-Butylamino)-2-hydroxypropoxy)-4-morpholino-1,2,5-thiadiazole monomaleate, CAS-26921-17-5, Timolol maleate [USAN:JAN], Timoptic?XE, Timolol maleate [USAN:USP:JAN], (Z)-but-2-enedioic acid;(2S)-1-(tert-butylamino)-3-[(4-morpholin-4-yl-1,2,5-thiadiazol-3-yl)oxy]propan-2-ol, EINECS 262-251-4, Bimatoprost / timolol, Timolol hydrogenmaleate, AC1NQXYE, Opera_ID_1256, DSSTox_CID_27504, DSSTox_RID_82384, DSSTox_GSID_47504, SCHEMBL26233, MLS001076135, Timolol maleate (JP17/USP), CHEMBL1200870, DTXSID3047504, 26921-17-5 (maleate), MolPort-002-545-241, WLRMANUAADYWEA-NWASOUNVSA-N, HMS1570N18, HMS2097N18, HMS2230N19, HMS2234F03, HMS3714N18, 26839-75-8 (Parent), Tox21_302468, BG0340, MFCD00058356, s4123, AKOS024458595, CCG-220948, CS-1028, (S)-3-(3-(tert-bUtylamino)-2-hydroxypropoxy)-4-morpholino-1,2,5-thiadiazole maleate, NCGC00256737-01, 60469-65-0, AS-18090, CPD000653470, HY-17380, KB-61736, SAM002564238, SMR000653470, AB0021275, LS-121851, FT-0082529, W0079, Timolol maleate salt, >=98% (TLC), powder, D00603, 921T175, SR-01000003102, SR-01000003102-3, Timolol Maleate 1.0 mg/ml in Methanol (as free base), Timolol maleate, British Pharmacopoeia (BP) Reference Standard, Timolol maleate, European Pharmacopoeia (EP) Reference Standard, Timolol maleate, United States Pharmacopeia (USP) Reference Standard, 1-( tert-Butylamino)-3-[(4-morpholino-1,2,5-thiadiazol-3-yl)oxy]-2-propanol maleate, Timolol for system suitability, European Pharmacopoeia (EP) Reference Standard, (2S)-1-(tert-butylamino)-3-{[4-(morpholin-4-yl)-1,2,5-thiadiazol-3-yl]oxy}propan-2-ol (2Z)-but-2-enedioate, (2S)-1-[(1,1-Dimethylethyl)amino]-3-[[4-(4-morpholinyl)-1,2,5-thiadiazol-3-yl]oxy]-2-propanol (2Z)-2-Butenedioate Salt, (S)-(-)-3-Morpholino-4-(3-tert-butylamino-2-hydroxypropoxy)-1,2,5-thiadiazole Hydrogen Maleate, (S)-1-[(1,1-Dimethylethyl)amino]-3-[[4-(4-morpholinyl)-1,2,5-thiadiazol-3-yl]oxy]-2-propanol maleate, (Z)-but-2-enedioic acid; (2S)-1-(tert-butylamino)-3-[(4-morpholin-4-yl-1,2,5-thiadiazol-3-yl)oxy]propan-2-ol, 2-Propanol, 1-(tert-butylamino)-3-((4-morpholino-1,2,5-thiadiazol-3-yl)oxy)-, (-)-,maleate (1:1) (salt), 30166-36-0


ID: 2478

chemical graph of compound 2478



InChIKey: WLWFNJKHKGIJNW-UHFFFAOYSA-N
SMILES: CN1C(=O)CC(C1=O)C2=CC=CC=C2

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6839
synonyms found at PubChem are:
Phensuximide, Milontin, Succitimal, Lifene, Phenylsuximide, Epimid, Fenosuccimide, Fensuccimide, Phensuximidum, 86-34-0, phensuccimide, Fensuximida, Phensuximid, Methylphenylsuccinimide, Fensuccimide [DCIT], Succinimide, N-methyl-2-phenyl-, Fensuximida [INN-Spanish], Phensuximidum [INN-Latin], Milonton, Mirontin, N-Methyl-alpha-phenylsuccinimide, 1-methyl-3-phenylpyrrolidine-2,5-dione, PM 334, Milontin (TN), N-Methyl-2-phenylsuccinimide, 1-Methyl-3-phenylpyrrolidin-2,5-dione, 1-Methyl-3-phenyl-2,5-pyrrolidinedione, (+-)-N-Methyl-2-phenylsuccinimide, EINECS 201-664-6, BRN 0155329, 1-Methyl-3-Phenylsuccinimide, 2,5-Pyrrolidinedione, 1-methyl-3-phenyl-, AI3-20372, CHEBI:8079, DSSTox_CID_3460, DSSTox_RID_77035, DSSTox_GSID_23460, 2,5-Pyrrolidinedione, 1-methyl-3-phenyl-, (+-)-, Phensuximide [BAN:INN], Phensuximide [INN:BAN], Mirotin, Lifen, Phensuximide [USP:INN:BAN], RS-Phensuximide, 7 Phenosuccimide, CAS-86-34-0, NCGC00016339-01, racemic phensuximide, Phensuximide (USP), 2,5-Pyrrolidinedione, 1-methyl-3-phenyl-, (3R)-, 2,5-Pyrrolidinedione, 1-methyl-3-phenyl-, (3S)-, Prestwick0_001061, Prestwick1_001061, Prestwick2_001061, Prestwick3_001061, Phensuximide (USP/INN), ACMC-20m1g5, ACMC-20m1g6, CHEMBL797, D06BYV, AC1L1NF1, SCHEMBL35333, BSPBio_001042, 5-21-11-00188 (Beilstein Handbook Reference), MLS002154134, SPBio_002961, BPBio1_001148, GTPL7612, N-Methyl-alpha-phenolsuccinimide, DTXSID4023460, WLWFNJKHKGIJNW-UHFFFAOYSA-N, HMS1571E04, HMS2098E04, HMS2235H10, HMS3264E08, HMS3369L21, HMS3715E04, Pharmakon1600-01505458, N-Methyl-.alpha.-phenylsuccinimide, 97233-03-9, 97233-04-0, Tox21_110382, NSC760079, (+/-)-N-Methyl-2-phenylsuccinimide, N-METHYL-2-PHENYL SUCCINIMIDE, AKOS006230701, Tox21_110382_1, API0009009, CCG-213454, DB00832, FCH2092775, NSC-760079, (.+/-.)-N-Methyl-2-phenylsuccinimide, NCGC00179333-01, NCGC00179333-03, AC-15962, SMR001233441, 1-Methyl-3-phenyl-2,5-pyrrolidinedione #, LS-147620, AB00514025, C07437, D00508, EN300-221563, AB00514025_07, 086P340, SR-01000842158, SR-01000842158-2, BRD-A18043272-001-03-2


ID: 2479

chemical graph of compound 2479



InChIKey: WLXGFAVTAAQOFH-UHFFFAOYSA-N
SMILES: C=CCN1CCC2=C(C(=C(C=C2C(C1)C3=CC=CC=C3)O)O)Cl.Br

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 9909521
synonyms found at PubChem are:
Chloro-APB hydrobromide, SKF-82958 (hydrobromide), SKF-82958 hydrobromide, 80751-65-1, (+/-)-Chloro-APB hydrobromide, 74115-01-8, WLXGFAVTAAQOFH-UHFFFAOYSA-N, (+/-)-6-Chloro-7,8-dihydroxy-3-allyl-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine hydrobromide, 6-Chloro-N-allyl-SKF-38393 hydrobromide, CHEMBL544115, (+/-)-SKF-82958 hydrobromide, EU-0100392, SKF 82958 hydrobromide, (y)-Chloro-APB hydrobromide, MLS001056784, (?)-Chloro-APB hydrobromide, Chloro-APB hydrobromide, solid, SCHEMBL4081594, MolPort-003-940-632, Tox21_500392, HY-10435A, MFCD00069235, AKOS027470269, CCG-221696, CS-4595, LP00392, NCGC00093820-01, NCGC00261077-01, LS-27999, SMR000326974, NCG-C00093820-01, C-130, FT-0081271, ( inverted question mark)-Chloro-APB hydrobromide, C-54143, SR-01000075360, ( inverted question mark)-SKF-82958 hydrobromide, SR-01000075360-1, ( inverted exclamation markA)-SKF-82958 hydrobromide, ( inverted exclamation markA)-SKF 82958 hydrobromide;Chloro-APB hydrobromide, 3-allyl-6-chloro-1-phenyl-2,3,4,5-tetrahydro-1H-benzo[d]azepine-7,8-diol hydrobromide, 3-allyl-6-chloro-7,8-dihydroxy-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine hydrobromide, ( inverted exclamation markA)-6-Chloro-7,8-dihydroxy-3-allyl-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine hydrobromide, 6-Chloro-2,3,4,5-tetrahydro-1-phenyl-3-(2-propen-1-yl)-1H-3-benzazepine-7,8-diol hydrobromide


ID: 2480

chemical graph of compound 2480



InChIKey: WLYYOFJEBGHKEC-VQYXCCSOSA-N
SMILES: C1CN(CC1)CC#CCN2C(=O)CCC2.C1CN(CC1)CC#CCN2C(=O)CCC2.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6436473
synonyms found at PubChem are:
Oxotremorine sesquifumarate salt, Oxotremorine fumarate (2:3), EINECS 241-388-3, 17360-35-9, 1-(N-(1-Pyrrolidinyl)-2-butynyl)-2-pyrrolidinone sesquifumarate, 1-(4-[1-Pyrrolidinyl]2-butynyl)-2-pyrrolidinone, 1-[4-(1-Pyrrolidinyl)-2-butynyl]-2-pyrrolidinone sesquifumarate, 2-Pyrrolidinone, 1-(4-(1-pyrrolidinyl)-2-butynyl)-, sesquifumarate, Bis(1-(4-(pyrrolidin-1-yl)but-2-ynyl)pyrrolidin-2-one) trifumarate, AC1O5LQH, CHEMBL1551988, oxotremorine ses-quifumarate salt, MolPort-006-122-212, HMS3262H10, HMS3266J20, Tox21_500914, MFCD00013163, AKOS024458667, tris(fumaric acid); bis(oxotremorine), CCG-222218, LP00914, 2-Pyrrolidinone, 1-(4-(1-pyrrolidinyl)-2-butynyl)-, (E)-2-butenedioate (2:3), NCGC00094225-01, NCGC00261599-01, tris(butenedioic acid); bis(oxotremorine), LS-139011, EU-0100914, O 9126, Oxotremorine sesquifumarate salt, >=98% (HPLC), solid, 2-Pyrrolidinone, 1-(4-(1-pyrrolidinyl)-2-butynyl)-, fumarate (2:3), 2-Pyrrolidinone, 1-(4-(1-pyrrolidinyl)-2-butynyl)-, (E)-2-butenedioate (2:3) (9CI), 2-Pyrrolidinone, 1-(4-(1-pyrrolidinyl)-2-butynyl)-, fumarate (2:3) (8CI)


ID: 2481

chemical graph of compound 2481



InChIKey: WMPXPUYPYQKQCX-UHFFFAOYSA-N
SMILES: COC1=NC=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)N

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5332
synonyms found at PubChem are:
sulfamonomethoxine, 1220-83-3, Sulfamonomethoxin, Daimeton, Sulfamonometoxina, Sulfamonomethoxinum, 4-amino-N-(6-methoxypyrimidin-4-yl)benzenesulfonamide, DS-36, 4-Amino-N-(6-methoxy-4-pyrimidinyl)benzenesulfonamide, DJ-1550, Benzenesulfonamide, 4-amino-N-(6-methoxy-4-pyrimidinyl)-, N1-(6-Methoxy-4-pyrimidinyl)sulfanilamide, ICI 32525, Ro 4-3476, Sulfamonomethoxinum [INN-Latin], Sulfamonometoxina [INN-Spanish], UNII-U700P169W2, BRN 0621128, Sulfamonomethoxine [USAN:INN:BAN:JAN], 4-METHOXY-6-SULFANILAMIDOPYRIMIDINE, CHEBI:32164, U700P169W2, NCGC00016572-01, CAS-1220-83-3, Daimeton (TN), DSSTox_CID_25351, DSSTox_RID_80818, DSSTox_GSID_45351, N(sup 1)-(6-Methoxy-4-pyrimidinyl)sulfanilamide, 4-Amino-N-[6-methoxy-4-pyrimidinyl]benzenesulfonamide, Sulfanilamide, N(sup 1)-(6-methoxy-4-pyrimidinyl)-, SMR000036718, SR-01000000177, [(4-aminophenyl)sulfonyl](6-methoxypyrimidin-4-yl)amine, Prestwick_105, Spectrum_001414, AC1Q4FBS, Prestwick0_000823, Prestwick1_000823, Prestwick2_000823, Prestwick3_000823, Spectrum2_001421, Spectrum3_000913, Spectrum4_001012, Spectrum5_000985, art-chem-bb b014359, AC1L1K4B, ici32525, Oprea1_147724, SCHEMBL93784, BSPBio_000745, KBioGR_001503, KBioSS_001894, 5-25-12-00493 (Beilstein Handbook Reference), MLS000069737, MLS000079369, ARONIS23882, DivK1c_000949, SPECTRUM1501147, SPBio_001522, SPBio_002666, BPBio1_000821, CHEMBL462990, DTXSID8045351, CTK7B2176, HMS502P11, KBio1_000949, KBio2_001894, KBio2_004462, KBio2_007030, KBio3_001886, KS-00000YZZ, ZINC49137, BBC/161, MolPort-000-731-191, NINDS_000949, ro4-3476, HMS1570F07, HMS1921J21, HMS2092H07, HMS2097F07, HMS3714F07, Pharmakon1600-01501147, Ro43476, HY-B0946, KS-000046QL, ZX-AS004378, Sulfamonomethoxine (JAN/USAN/INN), Tox21_110502, BBL023014, CCG-38995, MFCD00063466, NSC757862, SBB001134, STL089636, AKOS000308735, Tox21_110502_1, CS-4419, MCULE-7069712858, NSC-757862, RP29839, IDI1_000949, NCGC00016572-02, NCGC00016572-03, NCGC00016572-04, NCGC00016572-05, NCGC00016572-06, NCGC00016572-07, NCGC00016572-08, NCGC00016572-12, NCGC00023060-04, NCGC00023060-05, AC-14922, AN-48915, CC-34593, N-(6-Methoxy-4-pyrimidinyl)sulfanilamide, O348, ST007533, SBI-0051659.P002, BB0293573, LS-147813, AB00052221, FT-0633498, S0592, T7351, C12540, D01141, AB00052221-12, AB00052221_14, n(sup1)-(6-methoxy-4-pyrimidinyl)-sulfanilamid, 220S833, A804842, C-17634, I14-8665, J-004759, J-524311, SR-01000000177-3, SR-01000000177-4, 4-amino-n-(6-methoxy-4-pyrimidinyl)-benzenesulfonamid, BRD-K14116214-001-04-7, BRD-K14116214-001-07-0, Sulfamonomethoxine, VETRANAL(TM), analytical standard, 4-amino-N-(6-methoxy-pyrimidin-4-yl)-benzenesulfonamide, 4-azanyl-N-(6-methoxypyrimidin-4-yl)benzenesulfonamide, 4-amino-N-(6-methoxypyrimidin-4-yl)benzene-1-sulfonamide, 4-AMINO-N-(6-METHOXY-4-PYRIMIDINYL)-BENZENESULFONAMIDE, 4-Amino-N-(2-methoxy-4-pyrimidinyl)benzene-sulfonamide monohydrate


ID: 2482

chemical graph of compound 2482



InChIKey: WMWTYOKRWGGJOA-CENSZEJFSA-N
SMILES: CCC(=O)O[C@@]1([C@@H](C[C@@H]2[C@@]1(C[C@@H]([C@]3([C@H]2C[C@@H](C4=CC(=O)C=C[C@@]43C)F)F)O)C)C)C(=O)SCF

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 444036
synonyms found at PubChem are:
FLUTICASONE PROPIONATE, Flovent, 80474-14-2, Cutivate, Flixotide, Flonase, Flixonase, Flovent HFA, Flunase, Flusonal, Fluspiral, Flutide, atemur, Flutivate, Asmatil, Axotide, Brethal, Fluinol, Flovent Diskus 50, Flixotide Disks, Flixotide Disk, Flovent Diskus, Flovent Diskus 100, Flovent Diskus 250, Flixotide Inhaler, Cultivate, Inalacor, Rinosone, Trialona, Ubizol, Zoflut, Flixonase Nasal Spray, Flonase Aq, Fluticasonpropionat Allen, Fluticasone (propionate), UNII-O2GMZ0LF5W, CCI-18781, CCI 18781, O2GMZ0LF5W, CHEBI:31441, Fluticasone propionate (Flonase, Veramyst), [(6S,8S,9R,10S,11S,13S,14S,16R,17R)-6,9-difluoro-17-(fluoromethylsulfanylcarbonyl)-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] propanoate, S-(Fluoromethyl) 6alpha,9-difluoro-11beta,17-dihydroxy-16alpha-methyl-3-oxoandrosta-1,4-diene-17beta-carbothioate, 17-propionate, C25H31F3O5S, Flovent-hfa, Androsta-1,4-diene-17-carbothioic acid, 6,9-difluoro-11-hydroxy-16-methyl-3-oxo-17-(1-oxopropoxy)-, (6alpha,11beta,16alpha,17alpha)-S-(fluoromethyl) ester, Fluxonal, Skyron, Xhance, Fluticasone propionate [USAN], Flovent Rotadisk, Cutivate (TN), Fluticasone propionate [USAN:USP], ArmonAir RespiClick, Flonase (TN), Flovent (TN), ArmonAir RespiClickTM, fluticasone proprionate, Flonase Allergy Relief, Fluticasone Impurity B, AC1L9FLD, Prestwick0_000997, Prestwick1_000997, Prestwick2_000997, Prestwick3_000997, fluticasone 17-propionate, SCHEMBL4068, CHEMBL1473, BSPBio_001093, MLS001424085, SPBio_002984, BPBio1_001203, GTPL7080, BIF0710, MolPort-003-847-468, WMWTYOKRWGGJOA-CENSZEJFSA-N, FN-25, HMS1571G15, HMS2051N19, HMS2098G15, HMS3715G15, Fluticasone propionate (JAN/USAN), HY-B0154, ZINC3920027, AC-457, BDBM50354849, MFCD00866007, RS0009, s1992, AKOS015895220, CCG-100981, CS-1986, DB00588, KS-1173, NC00231, NCGC00179308-01, NCGC00179308-05, AJ-47435, BC216013, BR-72799, LS-19323, SC-19333, SMR000469159, AB1010912, ST2407016, AB00513992, FT-0082893, D01708, AB00513992-06, AB00513992_08, Fluticasone propionate, >=98% (HPLC), powder, 474F142, AN-584/43505443, SR-01000763355, Q-101393, SR-01000763355-3, BRD-K62310379-001-03-0, Fluticasone propionate, European Pharmacopoeia (EP) Reference Standard, Fluticasone propionate, United States Pharmacopeia (USP) Reference Standard, Fluticasone Propionate, Pharmaceutical Secondary Standard; Certified Reference Material, (1R,2S,8S,10S,11S,13R,14R,15S,17S)-1,8-difluoro-14-{[(fluoromethyl)sulfanyl]carbonyl}-17-hydroxy-2,13,15-trimethyl-5-oxotetracyclo[8.7.0.0;{2,7}.0;{11,15}]heptadeca-3,6-dien-14-yl propanoate, (6?,11?,16?,17?)-6,9-Difluoro-11-hydroxy-16-methyl-3-oxo-17-(1-oxopropoxy)androsta-1,4-diene-17-carbothioic acid fluoromethyl ester, (6alpha,11beta,16alpha,17alpha)-6,9-Difluoro-11-hydroxy-16-methyl-3-oxo-17-(1-oxopropoxy)androsta-1,4-diene-17-carbothioic acid S-(fluoromethyl) ester, 6alpha,9-difluoro-17beta-{[(fluoromethyl)sulfanyl]carbonyl}-11beta-hydroxy-16-methyl-3-oxoandrosta-1,4-dien-17alpha-yl propanoate, Androsta-1,4-diene-17-carbothioic acid, 6,9-difluoro-11-hydroxy-16-methyl-3-oxo-17-(1-oxopropoxy)-, S-(fluoromethyl) ester, (6-alpha,11-beta,16-alpha,17-alpha)-, Fluticasone propionate for impurity C identification, EuropePharmacopoeia (EP) Reference Standard, Fluticasone propionate for impurity G identification, EuropePharmacopoeia (EP) Reference Standard, S-(fluoromethyl)-6,9-difluoro-11,17-dihydroxy-16-methyl-3-oxoandrosta-1,4-diene-17-carbothioate,17-propionate


ID: 2483

chemical graph of compound 2483



InChIKey: WNCZPWWLBZOFJL-UHFFFAOYSA-N
SMILES: CS(=O)(=O)CCCCN=C=S

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 3080557
synonyms found at PubChem are:
Erysolin, 504-84-7, 1-isothiocyanato-4-(methylsulfonyl)butane, Spectrum_001235, SpecPlus_000632, AC1MIV8O, Spectrum2_001443, Spectrum3_001471, Spectrum4_001909, Spectrum5_000598, BSPBio_003021, KBioGR_002504, KBioSS_001715, DivK1c_006728, SCHEMBL437996, SPECTRUM1501193, SPBio_001305, CHEMBL1600484, CTK8F9485, KBio1_001672, KBio2_001715, KBio2_004283, KBio2_006851, KBio3_002521, DTXSID30198449, 4-methylsulfonylbutyl isothiocyanate, ZINC2558705, ACM504847, CCG-38863, AKOS006282271, 1-isothiocyanato-4-methylsulfonylbutane, 4-(Methanesulfonyl)butyl isothiocyanate, SDCCGMLS-0066701.P001, NCGC00095655-01, NCGC00095655-02, 1-Isothiocyanato-5-thiahexane5,5-dioxide, KB-50554, FT-0693107, Butane, 1-isothiocyanato-4-(methylsulfonyl)-


ID: 2484

chemical graph of compound 2484



InChIKey: WNIDXAKKFOKNEF-UHFFFAOYSA-N
SMILES: CCC1=C(C(=CC=C1)CC)NC(=O)CN(CC(=O)O)CC(=O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 170344
synonyms found at PubChem are:
Etifenin, 63245-28-3, N-(2,6-Diethylphenylcarbamoylmethyl)iminodiacetic acid, UNII-MH922908EB, MH922908EB, NCGC00016902-01, CAS-63245-28-3, 2-[carboxymethyl-[2-(2,6-diethylanilino)-2-oxoethyl]amino]acetic acid, DSSTox_CID_25492, DSSTox_RID_80912, DSSTox_GSID_45492, W-104923, ((((2,6-Diethylphenyl)carbamoyl)methyl)imino)diacetic acid, Etifeninum, Etifenia, Etifenine, Etifenino, Etifenia [Spanish], Etifeninum [Latin], Etifenine [INN-French], Etifeninum [INN-Latin], Etifenino [INN-Spanish], [[[(2,6-Diethylphenyl)carbamoyl]methyl]imino]diacetic acid, Etifenin [USAN:INN:BAN], Glycine, N-(carboxymethyl)-N-(2-((2,6-diethylphenyl)amino)-2-oxoethyl)-, Glycine, N-(carboxymethyl)-N-[2-[(2,6-diethylphenyl)amino]-2-oxoethyl]-, Etifenin (USAN), Prestwick_843, EINECS 264-041-8, EHIDA Kit, ACMC-209neb, AC1Q5LZB, Prestwick0_000504, Prestwick1_000504, Prestwick2_000504, Prestwick3_000504, AC1L55FO, BSPBio_000427, MLS002153849, SCHEMBL487233, SPBio_002348, BPBio1_000471, ZINC1396, CHEMBL1323453, DTXSID2045492, CHEBI:93120, CTK5B8279, WNIDXAKKFOKNEF-UHFFFAOYSA-N, HMS1569F09, HMS2096F09, HMS2234J19, HMS3373I15, HMS3713F09, Tox21_110673, 2,2'-((2-((2,6-diethylphenyl)amino)-2-oxoethyl)imino)diacetic acid, ANW-34593, AKOS015838614, Tox21_110673_1, CCG-220504, CHM0141899, NCGC00016902-02, NCGC00016902-04, AN-39014, LS-11710, O996, SMR001233209, TR-031463, D1735, FT-0766865, ST50826201, D04096, 245D283, C-44472, SR-01000841826, SR-01000841826-2, BRD-K63979671-001-03-6, Etifenin;N-(2,6-Diethylphenylcarbamoylmethyl)iminodiacetic acid, 2,2'-(2-(2,6-diethylphenylamino)-2-oxoethylazanediyl)diacetic acid, 2,2'-((2-((2,6-Diethylphenyl)amino)-2-oxoethyl)azanediyl)diacetic acid, 2-[carboxymethyl-[2-(2,6-diethylanilino)-2-oxo-ethyl]amino]acetic acid, Glycine,N-(carboxymethyl)-N-[2-[(2,6-diethylphenyl)amino]-2-oxoethyl]-, 2-({[N-(2,6-diethylphenyl)carbamoyl]methyl}(carboxymethyl)amino)acetic acid


ID: 2485

chemical graph of compound 2485



InChIKey: WNMJYKCGWZFFKR-UHFFFAOYSA-N
SMILES: CN(CCCNC(=O)C1CCCO1)C2=NC3=CC(=C(C=C3C(=N2)N)OC)OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 2092
synonyms found at PubChem are:
alfuzosin, 81403-80-7, Alfuzosina, Alfuzosine, Alfuzosinum, Alfuzosine [French], Alfuzosinum [Latin], Alfusosine, Alfuzosina [Spanish], Alfuzosin [INN:BAN], alphuzosine, Alfuzosin (INN), Xatral (TN), ALFLUZOCIN, SL 77499, HSDB 7290, SL 77-499, CHEMBL709, CHEBI:51141, WNMJYKCGWZFFKR-UHFFFAOYSA-N, N-(3-((4-Amino-6,7-dimethoxy-2-quinazolinyl)methylamino)propyl)tetrahydro-2-furancarboxamide, N-{3-[(4-amino-6,7-dimethoxyquinazolin-2-yl)(methyl)amino]propyl}tetrahydrofuran-2-carboxamide, C19H27N5O4, N-[3-[(4-amino-6,7-dimethoxy-2-quinazolinyl)methylamino]propyl]tetrahydro-2-furancarboxamide, N-[3-[(4-amino-6,7-dimethoxyquinazolin-2-yl)-methylamino]propyl]oxolane-2-carboxamide, 2-Furancarboxamide, N-(3-((4-amino-6,7-dimethoxy-2-quinazolinyl)methylamino)propyl)tetrahydro-, SMR000466340, Alfuzosin/, N-(3-((4-amino-6,7-dimethoxyquinazolin-2-yl), SR-01000759345, n-(3-((4-amino-6,7-dimethoxyquinazolin-2-yl)(methyl)amino)propyl)tetrahydrofuran-2-carboxamide, ALFLUZOSIN, AC1L1CWF, Prestwick0_000322, Prestwick1_000322, Prestwick2_000322, Prestwick3_000322, Spectrum2_000505, Spectrum3_001063, Spectrum4_001208, Spectrum5_000817, D09MWJ, SCHEMBL34477, BSPBio_000323, BSPBio_002646, KBioGR_001616, MLS000759449, MLS001424027, MLS006011887, SPECTRUM1505263, SPBio_000429, SPBio_002244, BPBio1_000357, GTPL7109, DTXSID6048549, KBio3_001866, MolPort-003-666-623, 81403-68-1 (hydrochloride), HMS1922P11, HMS2051I10, HMS2093O06, HMS2235O22, HMS3369K03, HMS3393I10, Pharmakon1600-01505263, SL 77, ACT03219, HY-B0192, ABP000595, BDBM50033110, BG0022, CCG-39585, NSC760065, STK643675, AKOS005574697, API0001406, CCG-100859, CS-2086, DB00346, MCULE-9094645643, NC00109, NSC-760065, VA10203, NCGC00095152-01, NCGC00095152-02, NCGC00095152-03, NCGC00095152-04, NCGC00095152-05, NCGC00095152-07, AN-36345, CC-23834, CPD000466340, K449, KB-47180, LS-70106, SAM001246638, SC-17006, SBI-0206735.P001, AB0014226, AB00514667, FT-0630891, D07124, AB00514667-07, AB00514667-09, AB00514667-10, AB00514667_11, AB00514667_12, (methyl)amino)propyl)tetrahydrofuran-2-carboxamide, 403A807, A840122, C-21524, L001317, SR-01000759345-4, BRD-A09056319-001-02-2, BRD-A09056319-001-05-5, BRD-A09056319-003-03-6, N-[3-[(4-amino-6,7-dimethoxy-2-quinazolinyl)-methylamino]propyl]-2-oxolanecarboxamide, N-[3-[(4-azanyl-6,7-dimethoxy-quinazolin-2-yl)-methyl-amino]propyl]oxolane-2-carboxamide, N-{3-[(4-amino-6,7-dimethoxyquinazolin-2-yl)(methyl)amino]propyl}oxolane-2-carboxamide, (+/-)-N-[3-[(4-amino-6,7-dimethoxy-2-quinazolinyl)methylamino]propyl]tetrahydro-2-furamide, 128707-53-9, 86163-78-2, N-[3-[(4-amino-6,7-dimethoxy-quinazolin-2-yl)- methyl-amino]propyl] tetrahydrofuran- 2-carboxamide, N-[3-[(4-amino-6,7-dimethoxy-quinazolin-2-yl)-methyl-amino]propyl]tetrahydrofuran-2-carboxamide, N-[3-[(4-Amino-6,7-dimethoxy-quinazolin-2-yl)methylamino]propyl]tetrahydrofuran-2-carboxamide, N-{3-[(4-imino-6,7-dimethoxy-3,4-dihydroquinazolin-2-yl)(methyl)amino]propyl}oxolane-2-carboximidic acid


ID: 2486

chemical graph of compound 2486



InChIKey: WNNNWFKQCKFSDK-BYPYZUCNSA-N
SMILES: C=CC[C@@H](C(=O)O)N

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 167529
synonyms found at PubChem are:
L-Allylglycine, 16338-48-0, (S)-2-aminopent-4-enoic acid, (2S)-2-aminopent-4-enoic acid, (S)-(-)-2-Amino-4-pentenoic acid, H-Gly(Ally)-OH, (S)-2-Amino-4-pentenoic acid, s-allylglycine, L-2-Amino-4-pentenoic acid, L-alpha-Allyl-Gly, (S)-2-Amino-4- Pentenoic Acid, (S)-ALLYLGLYCINE, 3-VINYL-L-ALANINE, 4-Pentenoic acid, 2-amino-, (2S)-, (2S)-2-amino-4-pentenoic acid, (S)-2-Amino-pent-4-enoic acid, MFCD00002627, D-Allylglycine hydrochloride, (-)-Allylglycine, C5H9NO2, (S)-2-aminopent-4-enoicacid, 2-Allyl-L-glycine, H-Gly(allyl)-OH, L-alpha-Allylglycine, 4-Pentenoic acid, 2-amino-, (S)-, Lopac-A-7762, D09OTM, AC1Q4U7A, Lopac0_000141, SCHEMBL74086, GTPL5267, Jsp003275, (2S)-2-aminopent-4-enoicacid, CHEMBL1229875, CTK0H8383, MolPort-000-000-937, WNNNWFKQCKFSDK-BYPYZUCNSA-N, (2S)-2-azanylpent-4-enoic acid, HMS3260M04, AC1L5042, ACT02836, KS-00000K3W, ZINC1696507, Tox21_500141, ANW-42977, RW2345, SBB006743, (S)-(?)-2-Amino-4-pentenoic acid, AKOS006339850, AKOS015853990, AC-9624, AL359-1, AM84669, CA-1959, CCG-204236, CS-W013622, GS-6220, LP00141, RTX-011065, NCGC00015091-01, NCGC00093631-01, NCGC00093631-02, NCGC00093631-03, NCGC00260826-01, AJ-30305, AN-10059, AN-15454, AN-33762, BR-49452, L-|A inverted exclamation mark-Allyl-Gly, L-Allylglycine, >=99% (TLC), powder, SC-14143, AB0005354, KB-105224, ST2402793, EU-0100141, FT-0627674, ST24036025, (S)-(-)-2-Amino-4-pentenoic acid, 98%, (S)-(&#8722;)-2-Amino-4-pentenoic acid, A 7762, A58069, 316A724, SR-01000075687, I05-0485, J-010040, SR-01000075687-1, (2S)-2-azaniumylpent-4-enoate, AC1ODVS0, (2S)-2-amino-4-pentenoate, (2S)-2-ammonio-4-pentenoate, (2S)-2-amino-4-pent-4-enoate, CJ-28463, A838868


ID: 2487

chemical graph of compound 2487



InChIKey: WNPNNLQNNJQYFA-LREBCSMRSA-N
SMILES: C1=CC(=C(C=C1C(CN)O)O)O.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 5813
synonyms found at PubChem are:
3414-63-9, (+/-)-Norepinephrine (+)-bitartrate salt, Norepinephrine tartrate, Norepinephrine bitartrate anhydrous, 4-(2-Amino-1-hydroxyethyl)benzene-1,2-diol (2R,3R)-2,3-dihydroxysuccinate, Arterenol bitartrate, Noradrenaline tartrate, Norartrinal bitartrate, l-Arterenol bitartrate, Levarterenol bitartrate, Noradrenalin bitartrate, Noradrenaline bitartrate, l-Noradrenaline tartrate, l-Arterenol d-bitartrate, L-Noradrenaline bitartrate, l-Norepinephrine bitartrate, Noradrenaline acid tartrate, Noradrenalin bitartrate, l-, l-Noradrenaline d-bitartrate, (-)-Norepinephrine bitartrate, Noradrenaline hydrogen tartrate, Noradrenaline, tartrate (1:1), (-)-R-Norepinephrine bitartrate, EINECS 200-095-0, 4-(2-amino-1-hydroxyethyl)benzene-1,2-diol 2,3-dihydroxybutanedioate(1:1), NSC 169106, (-)-Noradrenaline ( )-bitartrate, AC1Q5R3A, Lopac0_000053, AC1L1L72, SCHEMBL14973482, (y)-Norepinephrine (+)bitartrate, BENZYL ALCOHOL, alpha-(AMINOMETHYL)-3,4-DIHYDROXY-, (-)-, TARTRATE (1:1), Benzyl alcohol, alpha-(aminomethyl)-3,4-dihydroxy-, (-)-, tartrate (1:1) (salt), (?)-Norepinephrine (+)bitartrate, HMS3260K07, 1,2-Benzenediol, 4-((1R)-2-amino-1-hydroxyethyl)-, (2R,3R)-2,3-dihydroxybutanedioate (1:1) (salt), 1,2-Benzenediol, 4-(2-amino-1-hydroxyethyl)-, (R)-, (R-(R*,R*))-2,3-dihydroxybutanedioate (1:1), Tox21_500053, MFCD00132876, Norepinephrine Bitartrate (anhydrous), AKOS015963988, CCG-221357, LP00053, (+/-)-Arterenol (+)-bitartrate salt, NCGC00093567-01, NCGC00093567-02, NCGC00260738-01, (+/-)-Noradrenalin (+)-bitartrate salt, AC-18536, LS-42681, AX8043105, EU-0100053, A 0937, SR-01000075658, J-019372, SR-01000075658-1, ( inverted question mark)-Norepinephrine (+)bitartrate, 4-(2-amino-1-hydroxyethyl)benzene-1,2-diol; (2R,3R)-2,3-dihydroxybutanedioic acid, ( inverted question mark)-Arterenol (+)bitartrate; ( inverted question mark)-Noradrenalin (+)bitartrate


ID: 2488

chemical graph of compound 2488



InChIKey: WNPNNLQNNJQYFA-QRPNPIFTSA-N
SMILES: C1=CC(=C(C=C1[C@H](CN)O)O)O.C(C(C(=O)O)O)(C(=O)O)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 11957447
synonyms found at PubChem are:
L(-)-Norepinephrine bitartrate, L-(-)-Norepinephrine-(+)-bitartrate, R(-)-4-(2-Amino-1-hydroxyethyl)-1,2-benzenediol-(+)-tartrate, Levarterenol bitartrate, Noradrenaline bitartrate, 51-40-1, Lopac0_000094, SCHEMBL598842, CHEMBL1356607, CTK8G0452, WNPNNLQNNJQYFA-QRPNPIFTSA-N, HMS3260C10, Tox21_500094, CCG-221398, LP00094, NCGC00093596-01, NCGC00260779-01, EU-0100094, A 9512, (-)-Arterenol bitartrate; Noradrenaline bitartrate, 051N401


ID: 2489

chemical graph of compound 2489



InChIKey: WNXJCQNXNOOMDJ-UHFFFAOYSA-N
SMILES: CC(CCCC(=C)C)CCOC(=O)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 8833
synonyms found at PubChem are:
Rhodinyl acetate, 141-11-7, Rhodinol acetate, alpha-Citronellyl acetate, Rhodinyl ethanoate, 7-OCTEN-1-OL, 3,7-DIMETHYL-, ACETATE, 3,7-dimethyloct-7-en-1-yl acetate, 3,7-Dimethyl-7-octen-1-yl acetate, 3,7-Dimethyl-7-octen-1-yl ethanoate, 3,7-dimethyloct-7-enyl acetate, 7-Octen-1-ol, 3,7-dimethyl-, 1-acetate, EINECS 205-458-7, BRN 1906633, AC1L1RSA, .alpha.-Citronellyl acetate, SCHEMBL891472, CTK5H6686, FEMA 2981, WNXJCQNXNOOMDJ-UHFFFAOYSA-N, 3,7-dimethyl-7-octen-1-ol acetate, 6028AF, LMFA07011010, AKOS015911034, LS-3083, 7-Octen-1-ol,3,7-dimethyl-,1-acetate, AN-23192, 7-Octen-1-ol,3,7-dimethyl-, 1-acetate, 3,7- dimethyl-6 or 7-octen-1-yl acetate, FT-0631819, I14-38365, 130980-16-4, 20777-37-1, 62494-04-6


ID: 2490

chemical graph of compound 2490



InChIKey: WOCXQMCIOTUMJV-UHFFFAOYSA-N
SMILES: C1CN1C2=C(C=C(C(=C2)C(=O)N)[N+](=O)[O-])[N+](=O)[O-]

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 89105
synonyms found at PubChem are:
Tretazicar, CB 1954, 21919-05-1, CB1954, 5-(1-Aziridinyl)-2,4-dinitrobenzamide, 5-Aziridino-2,4-dinitrobenzamide, CB-1954, 5-(AZIRIDIN-1-YL)-2,4-DINITROBENZAMIDE, 5-Aziridinyl-2,4-dinitrobenzamide, Tretazicar [INN], 2,4-Dinitroethyleneiminobenzamide, 2,4-Dinitro-5-ethyleneiminobenzamide, CHEMBL23330, CCRIS 1631, UNII-7865D5D01M, 7865D5D01M, NSC 115829, BRN 5825582, Benzamide,5-(1-aziridinyl)-2,4-dinitro-, Benzamide, 5-(1-aziridinyl)-2,4-dinitro-, CB1, C9H8N4O5, SMR000326847, aziridine dinitrobenzamide, CB1954(Tretazicar), AC1Q1YAR, CB 1954, solid, Lopac-C-2235, D07ZHV, Lopac0_000200, MLS000859988, MLS001066333, SCHEMBL366755, AC1L3H57, SCHEMBL15691893, CTK4E7975, DTXSID00176335, MolPort-006-169-612, HMS2233F04, HMS3260H21, HMS3369C05, BCP09250, WLN: T3NTJ AR CVZ DNW FNW, ZINC4475105, Tox21_500200, BDBM50004681, CB 954, MFCD00869490, NSC115829, s7829, AKOS030239859, API0005340, CCG-204295, DB04253, LP00200, NSC-115829, 5-aziridin-1-yl-2,4-dinitro-benzamide, NCGC00015220-01, NCGC00015220-02, NCGC00015220-03, NCGC00015220-04, NCGC00093675-01, NCGC00093675-02, NCGC00260885-01, 5-(aziridyn-1-yl)-2,4-dinitrobenzamide, LS-25723, NCI60_000357, EU-0100200, C 2235, 28334-EP2269990A1, 28334-EP2280001A1, 28334-EP2281824A1, 28334-EP2301923A1, 28334-EP2301930A1, 28334-EP2308869A1, 28334-EP2314578A1, 919A051, SR-01000075746, J-014359, SR-01000075746-1


ID: 2491

chemical graph of compound 2491



InChIKey: WOFMFGQZHJDGCX-ZULDAHANSA-N
SMILES: C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2([C@]1(C(=O)CCl)OC(=O)C5=CC=CO5)C)O)Cl)C

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 441336
synonyms found at PubChem are:
mometasone furoate, 83919-23-7, Nasonex, Ecural, Elomet, Asmanex, MOMETASONE FUROATE MONOHYDRATE, mometasone 17-furoate, Danitin, UNII-04201GDN4R, Asmanex Twisthaler, CHEMBL1161, Elocone, Flumeta, Nosorex, Rimelon, CHEBI:47564, 04201GDN4R, Sch 32088, DSSTox_CID_3333, DSSTox_RID_76981, DSSTox_GSID_23333, [(8S,9R,10S,11S,13S,14S,16R,17R)-9-chloro-17-(2-chloroacetyl)-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] furan-2-carboxylate, 9,21-dichloro-11beta-hydroxy-16alpha-methyl-3,20-dioxopregna-1,4-dien-17-yl furan-2-carboxylate, C27H30Cl2O6, Sch-32088, Monovo, Ovixan, Asmanex HFA, BRN 4340538, (8S,9R,10S,11S,13S,14S,16R,17R)-9-chloro-17-(2-chloroacetyl)-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-17-yl furan-2-carboxylate, (9beta,10alpha,11alpha,14beta,16alpha,17alpha)-9,21-dichloro-11-hydroxy-16-methyl-3,20-dioxopregna-1,4-dien-17-yl furan-2-carboxylate, Sinuva, 9,21-Dichloro-11beta,17-dihydroxy-16alpha-methylpregna-1,4-diene-3,20-dione 17-(2-furoate), NCGC00016950-01, Prestwick_924, Mometasone furoate [USAN:USP:JAN], CAS-83919-23-7, LAS 41002, AC1L9AZS, Prestwick0_000572, Prestwick1_000572, Prestwick2_000572, Prestwick3_000572, mometasone furancarboxylate, SCHEMBL4568, BSPBio_000384, Mometasone 17-(2-furoate), MLS002153879, Mometasone Furoate Impurity G, SPBio_002603, Mometasone furoate (JAN/USP), BPBio1_000424, DTXSID4023333, KS-00000SPL, MolPort-003-849-257, WOFMFGQZHJDGCX-ZULDAHANSA-N, HMS1569D06, HMS2096D06, HMS2235I14, HMS3713D06, Pregna-1,4-diene-3,20-dione, 9,21-dichloro-17-((2-furanylcarbonyl)oxy)-11-hydroxy-16-methyl-, (11beta,16alpha)-, ZINC3938677, Tox21_110705, AC-941, BDBM50148733, NSC746171, s1987, Mometasone furoate, >=98% (HPLC), AKOS015994732, Tox21_110705_1, CCG-220572, CS-2389, KS-1275, NSC-746171, NCGC00179578-01, NCGC00179578-03, NCGC00179578-04, AN-15438, BC228151, HY-13693, SMR001233233, AB2000407, TL8005500, M2354, ST24048112, C07817, D00690, 919M237, A840685, SR-01000841209, Q-101380, SR-01000841209-2, BRD-K60640630-001-03-7, BRD-K60640630-001-11-0, Mometasone furoate, European Pharmacopoeia (EP) Reference Standard, Mometasone furoate, United States Pharmacopeia (USP) Reference Standard, 11?,16?)-9,21-Dichloro-11-hydroxy-16-methyl-3,20-dioxopregna-1,4-dien-17-yl 2-furoate, Mometasone Furoate, Pharmaceutical Secondary Standard; Certified Reference Material, (11beta,16alpha)-9,21-dichloro-11-hydroxy-16-methyl-3,20-dioxopregna-1,4-dien-17-yl furan-2-carboxylate, (11beta,16alpha)-9,21-Dichloro-17-[(2-furanylcarbonyl)oxy]-11-hydroxy-16-methylpregna-1,4-diene-3,20-dione, [(8S,9R,10S,11S,13S,14S,16R,17R)-9-chloranyl-17-(2-chloranylethanoyl)-10,13,16-trimethyl-11-oxidanyl-3-oxidanylidene-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] furan-2-carboxylate, 2-furancarboxylic acid [(8S,9R,10S,11S,13S,14S,16R,17R)-9-chloro-17-(2-chloro-1-oxoethyl)-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] ester, Pregna-1,20-dione, 9,21-dichloro-17-[(2-furanylcarbonyl)oxy]-11-hydroxy-16-methyl-, (11.beta.,16.alpha.)-


ID: 2492

chemical graph of compound 2492



InChIKey: WOLHOYHSEKDWQH-UHFFFAOYSA-N
SMILES: C1C2CC3CC1CC(C2)(C3)N.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 64150
synonyms found at PubChem are:
Amantadine hydrochloride, 1-Adamantanamine hydrochloride, 665-66-7, Symmetrel, 1-Aminoadamantane hydrochloride, Amantadine HCl, Amazolon, Midantan, Midantane, Mydantane, adamantan-1-amine hydrochloride, 1-Adamantylamine hydrochloride, Adamantanamine hydrochloride, Influenol, Trivaline, Virofral, Amantan, Virasol, Viregyt, Virosol, Adamantylamine hydrochloride, Aminoadamantane hydrochloride, Adamantine hydrochloride, 1-Adamantanamine, hydrochloride, EXP 105-1, NSC 83653, Tricyclodecane, Mantadix, Exp-105-1, Amantadine (hydrochloride), UNII-M6Q1EO9TD0, 1-Adamantanaminehydrochloride, 1-Aminoadamantene hydrochloride, MLS000028731, GP 38026, EINECS 211-560-2, M6Q1EO9TD0, AI3-52211, ADS-5102, Amantadine hydrochloride (Symmetrel), NSC-83653, Tricyclo[3.3.1.13,7]decan-1-amine, hydrochloride, amantidine hydrochloride, SMR000059204, Symmetrel (TN), adamantanylamine, chloride, Tricyclo(3.3.1.13,7)decan-1-amine, hydrochloride, adamantan-1-amine;hydrochloride, adamantan-1-aminium chloride, CHEBI:2619, 13878-11-0, NSC83653, Cerebramed, Adamine, Hofcomant, Lysovir, Mantadan, Nurelin, Adamin, SR-01000075353, Adamantanamine HCl, Amantadine hydrochloride [USAN:JAN], 1-Adamantanamine HCl, PubChem6390, Amantadine hydrochloride [USAN:USP:JAN], ACMC-209nvq, Opera_ID_671, Adamantamine hydrochloride, EC 211-560-2, AC1L20JO, adamantyl amine hydrochloride, 1-Adamantanamin Hydrochlorid, CHEMBL1569, SCHEMBL40713, KSC353A2R, MLS002153257, MLS003899199, SPECTRUM1500110, 768-94-5 (Parent), CHEMBL1255870, CTK2F3028, HY-B0402A, 1-aminoada- mantane hydrochloride, AOB5792, N04BB01, MolPort-000-692-440, MolPort-003-925-531, MolPort-038-942-500, WOLHOYHSEKDWQH-UHFFFAOYSA-N, HMS1920A19, Pharmakon1600-01500110, ADS-5101, BCP11857, STR01017, Tox21_500004, A3A501, ANW-35220, CCG-38899, MFCD00074723, NSC755860, s2451, SBB003680, Tricyclo[3.3.1.13, hydrochloride, Amantadine hydrochloride (JP17/USP), AKOS015900347, AKOS015951188, AC-8689, AN-7740, CA-1982, CS-2502, EBD2156754, LP00004, MCULE-2948891352, NC00489, NSC-755860, RTR-022507, TRA0093399, KS-000009I7, NCGC00093531-01, NCGC00093531-02, NCGC00093531-03, NCGC00093531-04, NCGC00260689-01, BC204764, CPD001370746, K091, KB-11068, LS-14931, SAM002554881, SC-06172, SMR001370746, SY012930, AB0014024, AB1008533, TL8004713, TR-022507, (3s,5s,7s)-adamantan-1-amine hydrochloride, A0588, EU-0100004, FT-0622248, ST24032190, ST50508424, V2452, (3R,5S,7s)-Adamantan-1-amine hydrochloride, A 1260, C07939, D00777, WLN: L66 B6 A B- C 1B ITJ BZ &GH, I14-0454, J-650095, J-650235, Q-200621, SR-01000075353-1, Tricyclo[3.3.1.1 3,7]decan-1-amine hydrochloride, Tricyclo[3.3.1.13,7]decan-1-amine hydrochloride, F3111-1111, Tricyclo(3.3.1.1(sup 3,7))decan-1-amine, hydrochloride, Tricyclo(3.3.1.1(sup 3,7))decan-1-amine, hydrochloride (9CI), Amantadine hydrochloride, European Pharmacopoeia (EP) Reference Standard, Amantadine hydrochloride, Pharmaceutical Secondary Standard; Certified Reference Material, Amantadine hydrochloride, United States Pharmacopeia (USP) Reference Standard, 1-Adamantanamine hydrochloride; 1-Adamantylamine hydrochloride; 1-Aminoadamantane hydrochloride, AC1LAOME, 1-adamantylazanium chloride, 1-adamantylammonium chloride, 1-Aminoadamantene hydrochlorid, Q-200622, tricyclo[3.3.1.1(3,7)]decan-1-aminium chloride, SCHEMBL8907194, AKOS026750102, 1-Adamantanamine hydrochloride, 99% 25g


ID: 2493

chemical graph of compound 2493



InChIKey: WOVKYSAHUYNSMH-RRKCRQDMSA-N
SMILES: C1[C@@H]([C@H](O[C@H]1N2C=C(C(=O)NC2=O)Br)CO)O

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 6035
synonyms found at PubChem are:
5-BROMO-2'-DEOXYURIDINE, 59-14-3, Broxuridine, Bromodeoxyuridine, 5-Bromodeoxyuridine, BRDU, 5-BrdU, BUDR, 5-Bromouracil deoxyriboside, Bromouracil deoxyriboside, 5-Bromodesoxyuridine, 5-Bdu, Broxuridinum, Broxuridina, 5-Bromouracil-2-deoxyriboside, 5-Bromo-2-deoxyuridine, bromodeoxyuridine (brdu), Broxuridinum [INN-Latin], Broxuridina [INN-Spanish], Uridine, 5-bromo-2'-deoxy-, C9H11BrN2O5, Bromoouridine, NSC-38297, Radibud, CCRIS 818, Brudr, UNII-G34N38R2N1, HSDB 7477, CHEBI:472552, EINECS 200-415-9, 5-Budr, BRN 0030395, CHEMBL222280, G34N38R2N1, 5-Bromo-2'-deoxyuridine (BRDU), NCGC00090770-05, NSC 38297, 5-bromo-2'-desoxyuridine, 5-Bromo-1-(2-deoxy-beta-D-ribofuranosyl)uracil, DSSTox_CID_13105, DSSTox_RID_79051, DSSTox_GSID_33105, brdurd, BDU, 5-Bromo-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione, 5-bromo-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidine-2,4-dione, CAS-59-14-3, 1-[(4S,2R,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-bromo-1,3-dihydropyrim idine-2,4-dione, 5-bromo-1-((2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)pyrimidine-2,4(1H,3H)-dione, SMR001227189, Broxuridine [INN], Broxuridine [INN:JAN], 5-Bromo-dURD, AC1L1LNR, Broxuridine (JAN/INN), Maybridge4_003385, D0M4MA, Epitope ID:138105, 5-bromo-2'-deoxy uridine, AC1Q24DG, cid_6035, Lopac0_000212, SCHEMBL27755, 4-24-00-01234 (Beilstein Handbook Reference), KSC911S7T, MLS001055406, MLS002153366, DTXSID7033105, CTK8B1979, 5-Bromo-2'-deoxyuridine(BRDU), 5-Bromo-2'-deoxyuridine, 97%, MolPort-000-784-028, MolPort-002-527-651, WOVKYSAHUYNSMH-RRKCRQDMSA-N, ZX-AFC000364, HMS1619B05, HMS3039G15, HMS3260L05, BCP21681, KS-00000JJ3, ZINC1081243, 5-BROMO-2''-DEOXY URIDINE, Tox21_111016, Tox21_200106, Tox21_500212, ANW-33171, BDBM50207303, BI2048, CB-072, HG1160, LS-250, MFCD00006529, SBB002964, AKOS001715166, AKOS016015753, Tox21_111016_1, CCG-204307, CS-3028, DB12028, LP00212, MCULE-5086148258, uridine, 3-15N-5-bromo-2'-deoxy-, NCGC00090770-01, NCGC00090770-02, NCGC00090770-03, NCGC00090770-04, NCGC00090770-06, NCGC00090770-07, NCGC00090770-08, NCGC00090770-09, NCGC00175901-01, NCGC00257660-01, NCGC00260897-01, AJ-24922, AK-44014, AN-15303, AS-11762, BR-44014, CC-21273, HY-15910, SC-18439, ST057095, AB0010697, AX8021654, DB-053327, 5-Bromo-2'-deoxyuridine, >=99% (HPLC), EU-0100212, 5-Bromo-2'-deoxyuridine, BioUltra, >=99%, 5-Bromo-1-(2-deoxy-|A-D-ribofuranosyl)uracil, 5-Bromo-2'-deoxyuridine, >=99.0% (HPLC), B 5002, D01763, S-2807, 5- Br-2 inverted exclamation mark -deoxyuridine, 006B529, 140455-EP2277565A2, 140455-EP2277566A2, 140455-EP2277567A1, 140455-EP2277568A2, 140455-EP2277569A2, 140455-EP2277570A2, 140455-EP2292280A1, 156905-EP2284178A2, 156905-EP2284179A2, 5-Bromo-2 inverted exclamation marka-deoxyuridine, C-30689, SR-01000075718, J-700086, SR-01000075718-1, Br-dU; 5-Bromo-1-(2-deoxy-beta-D-ribofuranosyl)uracil, Carbobenzoxy-valyl-alanyl-aspartyl-[O-methyl]-fluoromethylketone, 1236362-78-9, 3445-26-9, 396726-49-1, 5-bromo-1-((2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-tetrahydrofuran-2-yl)pyridine-2,4(1H,3H)-dione, 5-bromo-1-((2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-tetrahydrofuran-2-yl)pyrimidine-2,4(1H,3H)-dione, 5-bromo-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2,3,4-tetrahydropyrimidine-2,4-dione, 723-73-9


ID: 2494

chemical graph of compound 2494



InChIKey: WPNJAUFVNXKLIM-UHFFFAOYSA-N
SMILES: CC1=NC(=C(C(=N1)Cl)NC2=NCCN2)OC

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 4810
synonyms found at PubChem are:
MOXONIDINE, 75438-57-2, Norcynt, Nucynt, moxonidin, Normoxocin, Physiotens, Cynt, Moxonidinum [Latin], Moxonidina [Spanish], Lomox, BE 5895, 4-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)-6-methoxy-2-methylpyrimidin-5-amine, UNII-CC6X0L40GW, BDF 5895, 4-Chloro-N-(4,5-dihydro-1H-imidazol-2-yl)-6-methoxy-2-methyl-5-pyrimidinamine, LY 326869, CC6X0L40GW, CHEMBL19236, CHEBI:7009, BDF5896, WPNJAUFVNXKLIM-UHFFFAOYSA-N, 4-chloro-N-imidazolidin-2-ylidene-6-methoxy-2-methylpyrimidin-5-amine, BE5895, 5-Pyrimidinamine, 4-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)-6-methoxy-2-methyl-, NCGC00015649-02, CAS-75438-57-2, BE-5895, DSSTox_CID_25170, DSSTox_RID_80720, DSSTox_GSID_45170, Moxonidina, Moxonidinum, 2-(6-Chloro-4-methoxy-2-methylpyrimidin-5-ylamino)-2-imidazoline, 4-Chloro-5-(2-imidazolidinyldeneamino)-6-methoxy-2-methylpyrimidine, 4-Chloro-5-(2-imidazolin-2-ylamino)-6-methoxy-2-methylpyrimidine, 4-chloro-N-(imidazolidin-2-ylidene)-6-methoxy-2-methylpyrimidin-5-amine, BDF-5895, Moxonidine [USAN:INN:BAN], Zint, N-(4-chloro-6-methoxy-2-methylpyrimidin-5-yl)imidazolidin-2-imine, SR-01000075981, Cynt (TN), Moxonidine (USAN/INN), Prestwick0_001016, Prestwick1_001016, Prestwick2_001016, Prestwick3_001016, Lopac-M-1559, Monoxidine [common misspelling of Moxonidine], Lopac0_000753, SCHEMBL49143, BSPBio_001171, MLS002222183, Moxonidine [USNA:BAN:INN], SPBio_003042, AC1L1J08, AC1Q4F80, BPBio1_001289, DTXSID5045170, MolPort-003-666-832, MolPort-005-933-594, HMS1571K13, HMS2098K13, HMS2230B15, HMS3373O04, HMS3655B17, HMS3715K13, Moxonidine 1.0 mg/ml in Methanol, ALBB-022451, BCP23003, HY-B0374, ZINC1854466, Tox21_110190, 4-chloro-6-methoxy-2-methyl-5-(2-imidazolin-2-yl)aminopyrimidine, AC-637, BDBM50050093, KM1693, PDSP1_000177, PDSP2_000176, s2066, STL419983, STL450991, AKOS015895873, AKOS015997932, Tox21_110190_1, AF-0062, CCG-204838, CS-2439, DB09242, VA11330, NCGC00015649-01, NCGC00015649-04, NCGC00015649-05, NCGC00015649-08, NCGC00092355-02, 4CA-0870, AN-15697, BC203979, CC-31018, CJ-30608, K289, LY326869, SMR000857402, AB0014143, AB2000470, LS-134437, AB00514003, FT-0601601, FT-0657360, M2660, T5483, C07451, D05087, AB00514003-08, AB00514003_10, 102678-EP2272841A1, 102678-EP2301936A1, 438M572, C-14527, I06-1331, SR-01000075981-7, BRD-K77771411-001-04-4, (4-Chloro-6-methoxy-2-methyl-pyrimidin-5-yl)-imidazolidin-2-ylidene-amine, 4-chloro-N-(imidazolin-2-ylidene)-6-methoxy-2-methyl-5-pyrimidinamine, 5-pyrimidinamine, 4-chloro-N-2-imidazolidinylidene-6-methoxy-2-methyl-, 2-(4-Chloro-6-methoxy-2-methyl-pyrimidin-5-ylamino)-4,5-dihydro-3H-imidazol-1-ium, 4-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)-6-methoxy-2-methyl-pyrimidin-5-amine, 5-Pyrimidinamine, 4-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)-6-methoxy-2-methyl- (9CI), (2R,4R)-1-[(2S)-5-[(aminoiminomethyl)amino]-1-oxo-2-[[(1,2,3,4-tetrahydro-3-methyl-8- quinolinyl)sulfonyl]amino]pentyl]-4-methyl-2-piperidinecarboxylic acid


ID: 2495

chemical graph of compound 2495



InChIKey: WQHRFBCFNAQNOQ-UHFFFAOYSA-N
SMILES: C(C1=C(C)C=CS1)1C(C(=O)OCC2=CC=CC=C2)=C(C)NC(C)=C1C(=O)OCC1=CC=CC=C1

biological descriptors:

CFTR relevance: CFTR activator

Category:
Influence on CFTR function enhances CFTR function
Order of interaction unknown
subcellular compartment unknown

reference list:

"P Fossa" "N Pedemonte" "LJ Galietta" "M Giampieri" "F Cateni" "M Mazzei" "MT Mazzei" "M Zacchigna"


CID is 46196559
synonyms found at PubChem are:
CHEMBL593648


ID: 2496

chemical graph of compound 2496



InChIKey: WQKFYGJPNATGJS-UITAMQMPSA-N
SMILES: CCOC(=O)C/C(=N\NC(=S)N)/C

biological descriptors:

CFTR relevance: inactive

Category:
Influence on CFTR function none
Order of interaction unknown
subcellular compartment unknown

reference list:

"MH Nantz" "LJ Galietta" "K By" "EJ Niedzinski" "M Eda" "MF Springsteel" "MJ Haddadin" "MJ Kurth" "AS Verkman"


CID is 5359573
synonyms found at PubChem are:
AC1NSE34, NSC710, NSC-710, 1118-76-9, ZINC4353068, ACETOACETIC ACID, THIOSEMICARBAZONE, ethyl (3Z)-3-(carbamothioylhydrazinylidene)butanoate


ID: 2497

chemical graph of compound 2497



InChIKey: WQLVFSAGQJTQCK-VKROHFNGSA-N
SMILES: C[C@@H]1CC[C@@]2([C@H]([C@H]3[C@@H](O2)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC=C6[C@@]5(CC[C@@H](C6)O)C)C)C)OC1

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 99474
synonyms found at PubChem are:
DIOSGENIN, 512-04-9, Nitogenin, UNII-K49P2K8WLX, K49P2K8WLX, CHEBI:4629, (25R)-spirost-5-en-3beta-diol, Spirost-5-en-3-ol, (3b,25R)-, (20R,25R)-Spirost-5-en-3beta-ol, CCRIS 6803, 22alpha-Spirost-5-en-3beta-ol, (25R)-Spirost-5-en-3beta-ol, SP 37, (3beta,25R)-spirost-5-en-3-ol, EINECS 208-134-3, NSC 33396, BRN 0094582, 3beta-Hydroxy-5-spirostene, (25R)-5-Spirosten-3beta-ol, nitrogen in, Spirost-5-en-3-ol,(3b,25R)-, Spirost-5-en-3-beta-ol, (25R)-, Diosgenin,(S), Spirost-5-en-3-ol, (3-beta,25R)-, (7S,8S,10S,13S,15S,18S,22S,3R,12R,14R,19R)-3,13,15,19-tetramethyl-11-oxaspiro[ 2H-3,4,5,6-tetrahydropyran-6,6'-pentacyclo[10.8.0.0<2,9>.0<4,8>.0<13,18>]icosa ne]-24-en-22-ol, DISOGENIN, Diosgenin, >=93%, 3 -Hydroxy-5-spirostene, Tribulus Terrestris Extract, SCHEMBL83359, 5-19-03-00030 (Beilstein Handbook Reference), AC1L40X7, CHEMBL412437, (25R)-5-Spirosten-3 -ol, MolPort-003-932-544, WQLVFSAGQJTQCK-VKROHFNGSA-N, (25R)-Spirost-5-en-3.beta-ol, HY-N0177, ZINC6857614, LMST01080037, MFCD00016887, SBB058140, AKOS015961083, ACN-034765, AN-7581, CS-5303, MCULE-6739922044, RL03884, NCGC00386027-01, AS-13640, BC205369, CC-27080, ST097775, DHA, 512-04-9, AB0090307, N1715, S2291, Spirost-5-en-3beta-ol, (25R)- (8CI), C08898, J10028, M03858, Spirost-5-en-3-ol, (3beta,25R)- (9CI), 512D049, C-21981, Q-100574, BRD-K28690501-001-02-1, Diosgenin, European Pharmacopoeia (EP) Reference Standard, UNII-5E5W122QCR component WQLVFSAGQJTQCK-VKROHFNGSA-N, (2R,5'R)-5'-tetramethylspiro[[?]-2,2'-tetrahydropyran]ol, NCGC00386027-01_C27H42O3_Spirost-5-en-3-ol, (3beta,25R)-, (4S,5'R,6aR,6bS,8aS,8bR,9S,10R,11aS,12aS,12bS)-5',6a,8a,9-tetramethyl-1,3,3',4,4',5,5',6,6a,6b,6',7,8,8a,8b,9,11a,12,12a,12b-icosahydrospiro[naphtho[2',1':4,5]indeno[2,1-b]furan-10,2'-pyran]


ID: 2498

chemical graph of compound 2498



InChIKey: WQVZLXWQESQGIF-UHFFFAOYSA-N
SMILES: CC(CCC1=CC=CC=C1)NCC(C2=CC(=C(C=C2)O)C(=O)N)O.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 71412
synonyms found at PubChem are:
Labetalol hydrochloride, 32780-64-6, Labetalol HCL, Amipress, Presdate, Labrocol, Pressalolo, Ipolab, 2-Hydroxy-5-(1-hydroxy-2-((4-phenylbutan-2-yl)amino)ethyl)benzamide hydrochloride, Labetalol (hydrochloride), UNII-1GEV3BAW9J, AH 5158A, ScH 15719W, CCRIS 1086, Labetalol hydrochloride, EINECS 251-211-1, 1GEV3BAW9J, NSC 290312, Sch-15719W, MLS000069666, AH-5158A, SMR000058463, Normodyne (TN), Trandate (TN), 5-(1-Hydroxy-2-((1-methyl-3-phenylpropyl)amino)ethyl)salicylamide hydrochloride, 5-[1-Hydroxy-2-[(1-methyl-3-phenylpropyl)amino]ethyl]salicylamide hydrochloride, 2-Hydroxy-5-[1-hydroxy-2-[(1-methyl-3-phenylpropyl)amino]ethyl]benzamide hydrochloride, 5-(1-Hydroxy-2-((1-methyl-3-phenylpropyl)amino)ethyl)salicylamide monohydrochloride, DSSTox_CID_24654, DSSTox_RID_80378, Salicylamide, 5-(1-hydroxy-2-((1-methyl-3-phenylpropyl)amino)ethyl)-, hydrochloride, DSSTox_GSID_44654, C19H25ClN2O3, 5-[1-Hydroxy-2-[(1-methyl-3-phenylpropyl)amino]ethyl]salicylamide monohydrochloride, Benzamide, 2-hydroxy-5-(1-hydroxy-2-((1-methyl-3-phenylpropyl)amino)ethyl)-, monohydrochloride, Benzamide,2-hydroxy-5-[1-hydroxy-2-[(1-methyl-3-phenylpropyl)amino]ethyl]-, hydrochloride(1:1), SR-01000000209, C19H24N2O3.HCl, 2-hydroxy-5-(1-hydroxy-2-(4-phenylbutan-2-ylamino)ethyl)benzamide hydrochloride, 2-Hydroxy-5-(1-hydroxy-2-[(1-methyl-3-phenylpropyl)amino]ethyl)benzamide hydrochloride, 2-hydroxy-5-[1-hydroxy-2-(4-phenylbutan-2-ylamino)ethyl]benzamide hydrochloride, 2-hydroxy-5-[1-hydroxy-2-(4-phenylbutan-2-ylamino)ethyl]benzamide;hydrochloride, Prestwick_290, EINECS 276-694-6, Labetalol hydrochloride [USAN:JAN], Labetalol hydrochloride [USAN:USP:JAN], AC1Q5DEI, La.beta.lol hydrochloride, Opera_ID_1625, Benzamide,monohydrochloride, NCGC00016810-01, Salicylamide, hydrochloride, CAS-32780-64-6, SCHEMBL41230, MLS001148626, MLS002222197, SPECTRUM1503243, AC1L2G48, CHEBI:6344, CHEMBL1200323, DTXSID0044654, CTK4G9285, KS-00000GGU, AOB5072, MolPort-003-666-813, WQVZLXWQESQGIF-UHFFFAOYSA-N, HMS1568H16, HMS1922M13, Pharmakon1600-01503243, BCP13886, HY-B1108, Tox21_110623, Tox21_302725, Tox21_500687, CCG-40314, Labetalol hydrochloride (JP17/USP), MFCD00057663, NSC290312, NSC758438, s4291, AKOS015895575, AC-1389, API0003104, CS-4706, LP00687, NC00571, NSC-290312, NSC-758438, SS-4219, VA11135, NCGC00094044-01, NCGC00094044-02, NCGC00094044-03, NCGC00094044-04, NCGC00094044-05, NCGC00256847-01, NCGC00261372-01, (R*,R*)-(1)-5-(1-Hydroxy-2-((1-methyl-3-phenylpropyl)amino)ethyl)salicylamide monohydrochloride, 72487-34-4, AK144692, AN-14950, BC678573, CPD000058463, Labetalol HCl (Mixture of Diastereomers), LS-26937, SAM002564217, SC-58270, 32780-64-6 (HCl), AX8135749, ST2410032, 4CH-016313, EU-0100687, FT-0630564, D00600, J10319, Labetalol hydrochloride, >98% (TLC), powder, 780L646, C-20992, I06-0868, SR-01000000209-2, SR-01000000209-7, 2-Hydroxy-5-(1-hydroxy-2-((4-phenylbutan-2-yl)amino)ethyl)benzamide HCl, 2-Hydroxy-5-(1-hydroxy-2-(4-phenylbutan-2-ylamino)ethyl)benzamide HCl, Labetalol hydrochloride, European Pharmacopoeia (EP) Reference Standard, Labetalol hydrochloride, United States Pharmacopeia (USP) Reference Standard, 2-hydroxy-5-[1-hydroxy-2-[(1-methyl-3-phenyl-propyl)amino]ethyl]benzamide hydrochloride, Labetalol Hydrochloride, Pharmaceutical Secondary Standard; Certified Reference Material, Benzamide, 2-hydroxy-5-(1-hydroxy-2-((1-methyl-3-phenylpropyl)amino)ethyl)-,monohydrochloride, Benzamide, 2-hydroxy-5-[1-hydroxy-2-[(1-methyl-3-phenylpropyl)amino]ethyl]-, hydrochloride (1:1), AC1LCW63, AKOS026749871, hydron; 2-hydroxy-5-[1-hydroxy-2-(4-phenylbutan-2-ylamino)ethyl]benzamide; chloride


ID: 2499

chemical graph of compound 2499



InChIKey: WRDABNWSWOHGMS-UHFFFAOYSA-N
SMILES: C1=CC(=CC=C1CCN)S(=O)(=O)F.Cl

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 186136
synonyms found at PubChem are:
30827-99-7, AEBSF, 4-(2-Aminoethyl)benzenesulfonyl fluoride hydrochloride, AEBSF hydrochloride, AEBSF HCl, Pefabloc SC, Pefabloc, 4-(2-Aminoethyl)benzene-1-sulfonyl fluoride hydrochloride, AEBSF, Hydrochloride, 4-(2-Aminoethyl)benzenesulphonyl fluoride hydrochloride, Benzenesulfonyl fluoride, 4-(2-aminoethyl)-, hydrochloride, 4-(2-Aminoethyl)benzenesulfonylfluoride hydrochloride, 4-(2-Aminoethyl)benzenesulfonylfluoride, HCl, A-5440, P-1195, AEBSF.HCl, Benzenesulfonylfluoride, 4-(2-aminoethyl)-, hydrochloride (1:1), Benzenesulfonyl fluoride, 4-(2-aminoethyl)-, hydrochloride (1:1), CHEMBL1256178, SR-01000075690, AEBSF-hydrochloride, PubChem14462, AC1Q3CDP, EU-0100132, ACMC-1CTY2, AC1L4I7J, 2-[4-(fluorosulfonyl)phenyl]ethanaminium chloride, SCHEMBL25973, MLS002153464, BIMB2003, CTK1C4244, KS-00000VYT, DTXSID60184830, MolPort-001-775-981, ZX-AFC000626, ZX-AP010837, Tox21_500132, ANW-43152, GE4678, MFCD00132962, NSC727364, PC5642, Pefabloc(R) SC, analytical standard, s7378, SBB003219, AKOS015847774, CCG-207883, LP00132, NSC-727364, RTR-013198, VZ27664, NCGC00093623-01, NCGC00260817-01, AK-82709, CC-16252, HY-12821, KB-71440, L567, QC-10428, SMR001230821, 30827-99-7 (HCl), 4-(2-Aminoethyl)benzenesulfonylfluoride HCl, AB0014776, AX8005156, DB-047913, TR-013198, FT-0616512, 4-(2-Aminoethyl)Benzenesulfonyl Fluoride HCl, AEBSF Ready Made Solution, 100 mM in water, 4-(2-Aminoethyl)benzenesulfonyl fluoride, HCl, A 8456, K-7365, M01245, [4-(2-aminoethyl)phenyl]fluorosulfone, chloride, Pefabloc, Antibiotic for Culture Media Use Only, 827A997, C-14324, 4-(2-Aminoethyl)benzenesulfonylfluoridehydrochloride, 4-(2-Aminoethyl)phenylsulfonylfluoride hydrochloride, SR-01000075690-1, 4-(2-aminoethyl)-benzenesulfonylfluoride hydrochloride, 4-(2-aminoethyl)benzenesulfonyl fluoride,hydrochloride, 4-(2-Aminoethyl)benzenesulphonylfluoride hydrochloride, I01-10300, 4-(2-aminoethyl) benzenesulfonyl fluoride hydrochloride, Benzenesulfonyl fluoride, p-(2-aminoethyl)-, hydrochloride, Pefabloc(R) SC, certified reference material, TraceCERT(R), 4-(2-Aminoethyl)benzenesulfonyl fluoride hydrochloride, >=97%, 142764-EP2272835A1, 142764-EP2272844A1, 142764-EP2280011A1, 142764-EP2292593A2


ID: 2500

chemical graph of compound 2500



InChIKey: WREGKURFCTUGRC-POYBYMJQSA-N
SMILES: C1C[C@@H](O[C@@H]1CO)N2C=CC(=NC2=O)N

biological descriptors:

CFTR relevance: unspecified

Category:
Influence on CFTR function unknown
Order of interaction unknown
subcellular compartment unknown

reference list:

"J Liao" "DY Thomas" "SD Macknight" "B Kus" "R Robert" "JW Hanrahan" "J Goepp" "GW Carlile" "E Matthes" "D Rotin"


CID is 24066
synonyms found at PubChem are:
zalcitabine, Dideoxycytidine, 2',3'-DIDEOXYCYTIDINE, 7481-89-2, ddCyd, HIVID, ddC, Cytidine, 2',3'-dideoxy-, Zalcitibine, 4-Amino-1-((2R,5S)-5-(hydroxymethyl)tetrahydrofuran-2-yl)pyrimidin-2(1H)-one, ddC (Antiviral), 2,3-dideoxycytidine, NSC 606170, UNII-6L3XT8CB3I, Ro 24-2027/000, CCRIS 692, Hivid(TM), Zalcitabine [USAN:INN:BAN], Hivid (TN), Interferon AD + ddC, C9H13N3O3, HSDB 7156, ddC & sCD4, Ro-24-2027/000, ddC & GM-CSF, PC-SOD & ddC, 1-(2,3-Dideoxy-beta-D-ribofuranosyl)cytosine, CHEMBL853, BRN 0654956, 6L3XT8CB3I, Zalcitabine (JAN/USP/INN), DS-4152 & ddC, CHEBI:10101, WREGKURFCTUGRC-POYBYMJQSA-N, ddC & NP (from PHCA or HSA), SRI-7707, 4-amino-1-[(2R,5S)-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidin-2(1H)-one, 4-AMINO-1-[(2R,5S)-5-(HYDROXYMETHYL)OXOLAN-2-YL]-1,2-DIHYDROPYRIMIDIN-2-ONE, BETA-D-2',3'-DIDEOXYCYTIDINE, KS-1130, NCGC00090705-08, DSSTox_CID_3747, D 5782, DSSTox_RID_77182, DSSTox_GSID_23747, 3'-Azido-3'-deoxythymidine/2',3'-Dideoxycytidine, 2',3'-Dideoxycytidine & sCD4(soluble recombinant protein), 4-amino-1-[(2R,5S)-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one, Lecithinized superoxide dismutase & .beta.-D-2',3'-Dideoxycytidine, Sulfated polysaccharide-peptidoglycan DS-4152 & 2',3'-Dideoxycytidine, NSC606170, 4-amino-1-[(2R,5S)-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidin-2-one, NSC-606170, 2',3'-Dideoxycytidine & Nanoparticles (from human serum albumin or polyhexylcyanoacrylate), SMR000058253, 3-[(5S,2R)-5-(hydroxymethyl)oxolan-2-yl]-6-amino-3-hydropyrimidin-2-one, Zalcitabine [USAN:USP:INN:BAN], CAS-7481-89-2, Beta-D-DDC, DdC & IFN-alpha, ddC & IFN.alpha., .beta.-D-DDC, dideoxycytidine (DDC), DdC & Interferon alpha, Prestwick0_001037, Prestwick1_001037, Prestwick2_001037, Prestwick3_001037, ddC & Interferon.alpha., 2', 3'-dideoxycytidine, bmse000712, D0DC7N, D0M1YO, D0Z9QR, DDC (DDC), UPCMLD-DP115, AC1L2N6R, SCHEMBL3598, TimTec1_004969, Lopac0_000360, BSPBio_001253, 5-25-14-00313 (Beilstein Handbook Reference), MLS000069636, MLS000759540, MLS001055363, MLS001424210, MLS006011951, 2',3-DIDEOXYCYTIDINE, SPBio_003104, BPBio1_001378, GTPL4828, ddC|||2',3'-Dideoxycytidine, DTXSID0023747, UPCMLD-DP115:001, KS-00000MRJ, ZINC39906, AOB5609, MolPort-002-885-873, MolPort-003-699-779, HMS1548B19, HMS1571O15, HMS2051H18, HMS2090C12, HMS2098O15, HMS2236N08, HMS3261G21, HMS3715O15, Pharmakon1600-01502360, .beta.-D-2',3'-Dideoxycytidine, Zalcitabine, 2'3'-Dideoxycytidine, BCP13878, Hivid;Dideoxycytidine;NSC 606170, Tox21_113491, Tox21_201655, Tox21_303169, Tox21_500360, AC-824, ANW-36530, BDBM50145605, MFCD00012188, NSC759655, s1719, SBB066036, AKOS015854844, AKOS015894505, Tox21_113491_1, AB01085, CCG-101050, CS-1110, DB00943, LP00360, LS-1645, MCULE-6071296177, NC00300, NSC-759655, RTC-064018, SRI-7707-13, SRI-7707-14, SRI-7707_15, SRI-7707_17, NCGC00090705-01, NCGC00090705-02, NCGC00090705-03, NCGC00090705-05, NCGC00090705-06, NCGC00090705-07, NCGC00090705-09, NCGC00090705-10, NCGC00090705-11, NCGC00090705-13, NCGC00090705-15, NCGC00179242-01, NCGC00257202-01, NCGC00259204-01, NCGC00261045-01, AJ-08916, AN-15472, BC203863, CPD000058253, HY-17392, K278, SAM001246779, SC-09165, ST069364, ZB001188, 2',3'-Dideoxycytidine & Interferon-alpha, 2',3'-Dideoxycytidine & Interferon.alpha., 2',3'-Dideoxycytidine, >=98% (HPLC), AB0014137, AB2000246, DB-019728, Ro-242027000, TC-064018, D3581, EU-0100360, Ro-24-2027000, ST24043185, Cytidine, 2',3'-dideoxy & Interferon alpha, 2',3'-Dideoxycytidine, >=99.0% (HPLC), C07207, D00412, M-2084, 42060-EP2295503A1, 42060-EP2298761A1, 42060-EP2305695A2, 42060-EP2305696A2, 42060-EP2305697A2, 42060-EP2305698A2, 42060-EP2311808A1, 42060-EP2311829A1, 78798-EP2298783A1, 78798-EP2305695A2, 78798-EP2305696A2, 78798-EP2305697A2, 78798-EP2305698A2, Cytidine, 2',3'-dideoxy- & Interferon.alpha., 481D892, Hivid, Dideoxycytidine, NSC 606170, Zalcitabine, SR-01000075822, SR-01000736919, J-700276, Q-201941, SR-01000075822-1, SR-01000736919-5, 1-(2',3'-DIDEOXY-BETA-RIBOFURANOSYL)CYTOSINE, Cytidine, 2',3'-dideoxy- & Colony-stimulating factor, Cytidine, 2',3'-dideoxy-& Colony-stimulating factor, Ro-242027000/Ro-24-2027-000, Z1550648753, Zalcitabine, United States Pharmacopeia (USP) Reference Standard, 4-Amino-1-(5-hydroxymethyl-tetrahydro-furan-2-yl)-1H-pyrimidin-2-one, .beta.-D-2',3'-Dideoxycytidine & Granulocyte-macrophage colony-stimulating factor, 4-AMINO-1-[(2R,5S)-5-(HYDROXYMETHYL)TETRAHYDRO-2-FURANYL]-2(1H)-PYRIMIDINONE, Beta-D-2',3'-Dideoxycytidine & Granulocyte-macrophage colony-stimulating factor