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: 501

chemical graph of compound 501



InChIKey: DPUYFRUJYACFFQ-UHFFFAOYSA-N
SMILES: CC1=CC(=C2C3=C4C(=CC(=C13)OC)C(C(=O)C5=C(C=C(C(=C45)C2=O)OC)OC)(C)C)OC

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 4309556
synonyms found at PubChem are:
KBio2_002348, Spectrum_001843, Spectrum5_001816, AC1N7X0K, KBioSS_002351, KBio2_004916, KBio2_007484, RESISTOMYCIN, TETRAMETHYL ETHER


ID: 502

chemical graph of compound 502



InChIKey: DPYIXBFZUMCMJM-BTJKTKAUSA-N
SMILES: CCOC(=O)NC1=C(N=C(C=C1)NCC2=CC=C(C=C2)F)N.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:

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


CID is 6435335
synonyms found at PubChem are:
Flupirtine maleate, 75507-68-5, Katadolon, Flupirtine Maleate Salt, Flupirtine (Maleate), Flupirtin-maleat [German], UNII-0VCI53PK4A, Flupirtine maleate [USAN], W 2964M, EINECS 278-225-0, 0VCI53PK4A, D-9998, W-2964M, NCGC00093935-01, Ethyl 2-amino-6-((p-fluorobenzyl)amino)-3-pyridinecarbamate maleate (1:1), Ethyl-N-(2-amino-6-(4-fluorophenylmethylamino)pyridin-3-yl)carbamate maleate, Flupirtine maleate (USAN), (2-Amino-6-(((4-fluorophenyl)methyl)amino)-3-pyridinyl)carbamic acid ethyl ester maleate, DSSTox_CID_25771, DSSTox_RID_81113, Ethyl-N-(2-amino-6-(4-fluor-phenylmethylamino)pyridin-3-yl)carbamat maleat [German], DSSTox_GSID_45771, Q-101869, Flupirtin-maleat, 2-Amino-3-(ethoxycarbonylamino)-6-(4-fluorobenzylamino)pyridine Maleate Salt, ETHYL (2-AMINO-6-((4-FLUOROBENZYL)AMINO)PYRIDIN-3-YL)CARBAMATE MALEATE, Ethyl 2-amino-6-((4-fluorobenzyl)amino)pyridine-3-carbamate, compound with maleic acid (1:1), C19H21FN4O6, Carbamic acid, (2-amino-6-(((4-fluorophenyl)methyl)amino)-3-pyridinyl)-, ethyl ester, (Z)-2-butenedioate (1:1), CAS-75507-68-5, NCGC00015451-03, Flupirtinmaleat, D 9998, Effirma, (Z)-but-2-enedioic acid;ethyl N-[2-amino-6-[(4-fluorophenyl)methylamino]pyridin-3-yl]carbamate, Ethyl 2-amino-6-(4-fluorobenzylamino)pyridin-3-ylcarbamate maleate, FLUPIRITNE MALEATE, AC1O5JLR, flupirtine maleate (1:1), SCHEMBL124707, CHEMBL1256752, DTXSID8045771, DPYIXBFZUMCMJM-BTJKTKAUSA-N, MolPort-003-941-407, HMS3261N15, 56995-20-1 (Parent), 75507-68-5 (maleate)., C15H18N4O2.C4H4O4, Tox21_111232, Tox21_113397, Tox21_500547, ABP000440, AC-454, BG0448, Flupirtine maleate/D 9998,Katadolon, AKOS024286722, Ethyl-N-(2-amino-6-(4-fluor-phenylmethylamino)pyridin-3-yl)carbamat maleat, Tox21_111232_1, AF10216, AN-1081, BCP9000699, CCG-221851, CS-0573, LP00547, RL04876, NCGC00015451-05, NCGC00093935-02, NCGC00261232-01, 133AP001, BC227821, HY-17001, LS-48933, ST096085, Flupirtine maleate salt, >=98% (HPLC), KB-297192, EU-0100547, F0736, D04226, F 8927, J10053, W-5234, 507F685, A838439, SR-01000075887, I06-1582, SR-01000075887-1, [2-AMINO-6-(4-FLUORO-BENZYLAMINO)-PYRIDIN-3-YL]-CARBAMIC ACID ETHYL ESTER MALEATE, 2-Amino-6-[(p-fluorobenzyl)amino]-3-pyridinecarbamic Acid Ethyl Ester Maleate, 2-amino-6-[[(4-fluorophenyl)methyl]amino]-3-pyridinyl]-carbamic acid, ethyl ester maleate, ethyl N-[2-amino-6-[(4-fluorophenyl)methylamino]-3-pyridyl]carbamate; maleic acid, N-[2-Amino-6-[[4-fluorophenyl)methyl]amino]-3-pyridinyl]carbamic acid ethyl ester maleate, (Z)-but-2-enedioic acid; ethyl N-[2-amino-6-[(4-fluorophenyl)methylamino]pyridin-3-yl]carbamate, (Z)-but-2-enedioic acid; ethyl N-[2-azanyl-6-[(4-fluorophenyl)methylamino]pyridin-3-yl]carbamate, [2-AMINO-6-[[(4-FLUOROPHENYL)METHYL]AMINO]-3-PYRIDINYL]-CARBAMIC ACID ETHYL ESTER MALEATE SALT, 2-AMINO-[6-[[(4-FLUOROPHENYL)METHYL]AMINO]]-3-PYRIDINYL-CARBAMIC ACID ETHYL ESTER MALEATE, 56995-21-2, Carbamic acid, (2-amino-6-(((4-fluorophenyl)methyl)amino)-3-pyridinyl)-, ethyl ester,(Z)-2-butenedioate (1:1), CARBAMIC ACID, N-[2-AMINO-6-[[(4-FLUOROPHENYL)METHYL]AMINO]-3-PYRIDINYL]-, ETHYL ESTER, (2Z)-2-BUTENEDIOATE (1:1), N-(2-amino-6-{[(4-fluorophenyl)methyl]amino}(3-pyridyl))ethoxycarboxamide, (2Z )but-2-enedioic acid, N-[2-amino-6-[(4-fluorophenyl)methylamino]-3-pyridinyl]carbamic acid ethyl ester; (Z)-2-butenedioic acid, N-[2-Amino-6-[[(4-fluorophenyl)methyl]amino]-3-pyridinyl]carbamic Acid Ethyl Ester (2Z)-2-Butenedioate, N-[2-AMINO-6-[[[4-FLUOROPHENYL]METHYL]AMINO]-3-PYRIDINYL]CARBAMIC ACID ETHYL ESTER MALEATE


ID: 503

chemical graph of compound 503



InChIKey: DQMZLTXERSFNPB-UHFFFAOYSA-N
SMILES: CCC1(C(=O)NCNC1=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:

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


CID is 4909
synonyms found at PubChem are:
primidone, 125-33-7, Primaclone, Mysoline, Lepimidin, Mylepsinum, Misodine, Mizodin, Mylepsin, Primidon, Sertan, 2-Deoxyphenobarbital, 2-Desoxyphenobarbital, Hexadiona, Lepsiral, Liskantin, Majsolin, Milepsin, Misolyne, Neurosyn, Prilepsin, Primakton, Primoline, Prysoline, Midone, Mizolin, Mysedon, Cyral, Medi-Pets, Primacone, Desoxyphenobarbitone, Pyrimidone Medi-pets, Primidonum, Primidona, Resimatil, Desoxyphenobarbital, Primacione, Roe 101, 5-Phenyl-5-ethyl-hexahydropyrimidine-4,6-dione, Myidone, 4,6(1H,5H)-Pyrimidinedione, 5-ethyldihydro-5-phenyl-, Apo-Primidone, Primidone (primaclone), 5-Ethyl-5-phenylhexahydropyrimidine-4,6-dione, Primidonum [INN-Latin], Primidona [INN-Spanish], 5-ethyl-5-phenyldihydropyrimidine-4,6(1H,5H)-dione, NCI-C56360, Hexamidine (the antispasmodic), 5-ethyl-5-phenyl-1,3-diazinane-4,6-dione, 5-Ethyldihydro-5-phenyl-4,6(1H,5H)-pyrimidinedione, 5-Ethylhexahydro-4,6-dioxo-5-phenylpyrimidine, 5-Ethylhexahydro-5-phenylpyrimidine-4,6-dione, 4,4'-(Hexamethylenedioxy)dibenzamidine, Pms Primidone, CCRIS 54, NSC 41701, Mysoline (TN), 5-Aethyl-5-phenyl-hexahydropyrimidin-4,6-dion, UNII-13AFD7670Q, HSDB 3169, Primidone [USAN:INN:BAN:JAN], EINECS 204-737-0, 5-Phenyl-5-aethylhexahydropyrimidindion-(4,6), Primidone Methanol Solution, BRN 0218034, Hexamidine(the antispasmodic), 5-Aethyl-5-phenyl-hexahydropyrimidin-4,6-dion [German], 5-Phenyl-5-aethylhexahydropyrimidindion-(4,6) [German], MLS000028593, CHEBI:8412, DQMZLTXERSFNPB-UHFFFAOYSA-N, 13AFD7670Q, NCGC00015834-11, CAS-125-33-7, SMR000058501, DSSTox_CID_3510, P 7295, 5-ethylhe xahydro-4,6-dioxo-5-phenylpyrimidine, DSSTox_RID_77058, DSSTox_GSID_23510, 5-Ethyl-5-phenyldihydro-4,6(1H,5H)-pyrimidinedione, 5-ethyldihydro-5-phenyl-4,6[1H,5H]-pyrimidinedione, Primidon Holsten, SR-01000003162, 5-ethyl-5-phenyl-1,2,3,5-tetrahydropyrimidine-4,6-dione, Primidone [USP:INN:BAN:JAN], Mylepsinum (TN), Liskantin (TN), Prysoline (TN), Resimatil (TN), Primidone(Mysoline), Sertan (TN), Primidone (Mysoline), Apo-Primidone (TN), Spectrum_000832, Tocris-0830, Pyrimidone "Medi-pets", Pyrimidone 'Medi-pets', Pyrimidone (Medi-pets), Xcel Brand of Primidone, Astra Brand of Primidone, Opera_ID_1083, Prestwick0_000933, Prestwick1_000933, Prestwick2_000933, Prestwick3_000933, Spectrum2_001293, Spectrum3_000553, Spectrum4_000485, Spectrum5_001144, Lopac-P-7295, Apotex Brand of Primidone, Draxis Brand of Primidone, Zeneca Brand of Primidone, Mysoline;Neurosyn;Mylepsin, Biomol-NT_000261, CHEMBL856, D0U5RT, Desitin Brand of Primidone, Holsten Brand of Primidone, Pyrimidone ''Medi-pets'', Lopac0_001021, SCHEMBL34221, BSPBio_000866, BSPBio_002225, KBioGR_000969, KBioSS_001312, 5-24-08-00102 (Beilstein Handbook Reference), MLS001055411, MLS001074125, BIDD:GT0319, DivK1c_000324, Primidone, analytical standard, SPECTRUM1500501, AstraZeneca Brand of Primidone, SPBio_001325, SPBio_003035, Primidone (JP15/USP/INN), Primidone (JP17/USP/INN), AC1L1J82, BPBio1_000859, BPBio1_000954, GTPL5338, ZINC1979, hexamidine (the antispasmodic), DTXSID7023510, CTK8B3224, HMS501A06, KBio1_000324, KBio2_001312, KBio2_003880, KBio2_006448, KBio3_001725, WLN: T6MV DVMTJ C2 CR, MolPort-001-783-659, NINDS_000324, HMS1570L08, HMS1920J20, HMS2092A21, HMS2097L08, HMS2236G03, HMS3259K04, HMS3263M03, HMS3266H18, HMS3369J12, HMS3655L05, HMS3714L08, LS-48, Pharmakon1600-01500501, HY-B0339, KS-00000XM8, NSC41701, Tox21_110238, Tox21_201948, Tox21_303194, Tox21_501021, ANW-42020, BG0404, CCG-39231, NSC-41701, NSC757291, s1965, Sanofi-Synthelabo Brand of Primidone, SBB017254, AKOS003368409, Tox21_110238_1, API0003929, CS-2381, DB00794, KS-5217, LP01021, MCULE-2519004832, NC00532, NSC-757291, IDI1_000324, SMP1_000135, NCGC00015834-01, NCGC00015834-02, NCGC00015834-03, NCGC00015834-04, NCGC00015834-05, NCGC00015834-06, NCGC00015834-07, NCGC00015834-08, NCGC00015834-09, NCGC00015834-10, NCGC00015834-12, NCGC00015834-13, NCGC00015834-14, NCGC00015834-15, NCGC00015834-16, NCGC00015834-17, NCGC00015834-19, NCGC00016377-01, NCGC00023254-02, NCGC00023254-04, NCGC00023254-05, NCGC00023254-06, NCGC00023254-07, NCGC00023254-08, NCGC00023254-09, NCGC00023254-10, NCGC00257146-01, NCGC00259497-01, NCGC00261706-01, AN-22963, BC682375, CC-33920, CPD000058501, H808, SAM002554925, SC-18998, ST076725, ZB000454, SBI-0050994.P004, AB0013274, AB2000396, TR-003816, AB00052079, EU-0101021, FT-0603328, P1906, 5-Ethyldihydro-5-phenyl-4,5H)-pyrimidinedione, C07371, D00474, K-1838, 5-ethyl-5-phenyl-hexahydropyrimidine-4,6-dione, AB00052079-14, AB00052079_15, AB00052079_16, 125P337, 4,5H)-Pyrimidinedione, 5-ethyldihydro-5-phenyl-, A805374, I06-0632, J-005215, SR-01000003162-2, SR-01000003162-4, SR-01000003162-5, SR-01000003162-8, BRD-K32247306-001-05-4, BRD-K32247306-001-17-9, 5-Ethyl-5-phenyldihydro-4,6(1H,5H)-pyrimidinedione #, Primidone, European Pharmacopoeia (EP) Reference Standard, Primidone, United States Pharmacopeia (USP) Reference Standard, Primidone for peak identification, European Pharmacopoeia (EP) Reference Standard


ID: 504

chemical graph of compound 504



InChIKey: DQQCJDBYNZMPOA-FFXKMJQXSA-N
SMILES: CN1CCC2=CC=CC3=C2[C@H]1CC4=C3C(=C(C=C4)O)O.O.Cl

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 6852399
synonyms found at PubChem are:
R-(-)-Apomorphine, MLS000069811, Apomorphine hydrochloride hemihydrate, 41372-20-7, SMR000059235, R-(-)-Apomorphine hydrochloride hemihydrate, SMR000653528, (R)-Apomorphine Hydrochloride Hemihydrate, Opera_ID_1132, MLS001074112, MLS002153277, MLS002222153, C17H17NO2.ClH.H2O, SCHEMBL5429071, CHEMBL1256708, HW2A207, 2223AH, AKOS030526144, NCGC00180984-01, SMR001307246, R(-) Apomorphine hydrochloride hemihydrate, MLS-0235817.0001, (R)-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-10,11-diol hydrochloride hydrate


ID: 505

chemical graph of compound 505



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

biological descriptors:

CFTR relevance: inactive

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

reference list:

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


CID is 9899825
synonyms found at PubChem are:
1-{2-[(4-methoxybenzyl)oxy]phenyl}ethanone, 371258-91-2, 1-[2-[(4-methoxyphenyl)methoxy]phenyl]ethanone, SCHEMBL4938231, CTK1A9683, DTXSID80432562, DQUMVRSTGOLXHO-UHFFFAOYSA-N, 2'-(4-Methoxybenzyloxy)acetophenone, ZINC19475899, AKOS000180550, A1-05667, Ethanone, 1-[2-[(4-methoxyphenyl)methoxy]phenyl]-


ID: 506

chemical graph of compound 506



InChIKey: DQVARXSGNFBPMB-UHFFFAOYSA-N
SMILES: COC1=CC=CC(=C1)C(=O)NCCN2CCN(CC2)C3=CC=C(C=C3)Cl

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 3626837
synonyms found at PubChem are:
N-(2-[4-(4-Chlorophenyl)piperazin-1-yl]ethyl)-3-methoxybenzamide, CHEMBL93403, N-[2-(4-(4-Chlorophenyl)piperazin-1-yl)ethyl]-3-methoxybenzamide, n-(2-(4-(4-chlorophenyl)piperazin-1-yl)ethyl)-3-methoxybenzamide, N-[2-[4-(4-chlorophenyl)piperazin-1-yl]ethyl]-3-methoxybenzamide, AC1MTLV6, Lopac-C-7230, Lopac0_000287, MLS002153518, SCHEMBL1322020, CTK8G1437, HMS2230B03, HMS3260J16, HMS3373J10, PB-12, Tox21_500287, BDBM50068366, AKOS024728383, CCG-204382, LP00287, NCGC00015262-01, NCGC00015262-02, NCGC00015262-03, NCGC00015262-04, NCGC00093740-01, NCGC00093740-02, NCGC00260972-01, SMR001230850, EU-0100287, C 7230, SR-01000075777, SR-01000075777-1, F5264-0494, N-{2-[4-(4-Chloro-phenyl)-piperazin-1-yl]-ethyl}-3-methoxy-benzamide


ID: 507

chemical graph of compound 507



InChIKey: DQWQITFUWFBXON-UHFFFAOYSA-N
SMILES: COC(=O)C1=CC(=O)C(=C2C(=C1)C=CC(=C2O)O)O

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 5098884
synonyms found at PubChem are:
METHYL 7-DESHYDROXYPYROGALLIN-4-CARBOXYLATE, KBio2_003236, Spectrum_000188, SpecPlus_000185, Spectrum2_000602, Spectrum3_000223, Spectrum4_001438, Spectrum5_000296, AC1NP3I1, BSPBio_001865, KBioGR_001916, KBioSS_000668, SPECTRUM201505, DivK1c_006281, SPBio_000504, CHEMBL1556914, SCHEMBL12609926, KBio1_001225, KBio2_000668, KBio2_005804, KBio3_001365, DQWQITFUWFBXON-UHFFFAOYSA-N, MolPort-002-744-054, ZINC3198921, CCG-39164, STK785494, AKOS005621142, MCULE-6169483466, NCGC00095922-01, NCGC00095922-02, NCGC00178939-01, ST085228, A4092/0174489, methyl 3,4,5-trihydroxy-6-oxobenzo[7]annulene-8-carboxylate, methyl 2,8,9-trihydroxy-1-oxobenzo[c][7]annulene-4-carboxylate, methyl 3,4,6-trihydroxy-5-oxo-5H-benzo[7]annulene-8-carboxylate, 5H-Benzo[a]cycloheptene-8-carboxylic acid, 3,4,6-trihydroxy-5-oxo-, methyl ester


ID: 508

chemical graph of compound 508



InChIKey: DRCMAZOSEIMCHM-UHFFFAOYSA-N
SMILES: C1CC2=CC(=C(C=C2CN(C1)C(=S)NCCC3=CC=C(C=C3)Cl)O)O

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 2549
synonyms found at PubChem are:
capsazepine, 138977-28-3, capsazepin, N-[2-(4-Chlorophenyl)ethyl]-1,3,4,5-tetrahydro-7,8-dihydroxy-2H-2-benzazepine-2-carbothioamide, UNII-LFW48MY844, N-[2-(4-chlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide, CHEMBL391997, LFW48MY844, ST50826300, CHEBI:70773, 2-[2-(4-chlorophenyl)ethylamino-thiocarbonyl]-7,8-dihydroxy-2,3,4,5-tetrahydro-1H-2-benzazepine, N-(2-[4-chlorophenyl]ethyl)-1,3,4,5-tetrahydro-7,8-dihydroxy-2H-2-benzazepine-2-carbothioamide, N-[2-(4-chlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2H-2-benzazepine-2-carbothioamide, SR-01000075437, capasazepine, Tocris-0464, Lopac-C-191, AC1MBZ0D, D0G8BN, Lopac0_000373, BSPBio_001550, KBioGR_000270, KBioSS_000270, MLS002153524, SCHEMBL122421, GTPL2461, BDBM20284, CTK8E8275, KBio2_000270, KBio2_002838, KBio2_005406, KBio3_000539, KBio3_000540, DTXSID20160852, DRCMAZOSEIMCHM-UHFFFAOYSA-N, MolPort-003-845-575, Bio1_000394, Bio1_000883, Bio1_001372, Bio2_000270, Bio2_000750, HMS1361N12, HMS1791N12, HMS1989N12, HMS2230F13, HMS3261K07, HMS3266C14, HMS3372M06, HMS3402N12, HMS3650G17, NK101, BCP12782, ZINC3871859, Tox21_500373, 1660AH, BG0125, MFCD00153778, s8137, AKOS024458271, Capsazepine, >=98% (HPLC), solid, CCG-204468, CS-1572, LP00373, IDI1_034020, KS-0000180V, NCGC00015190-01, NCGC00015190-02, NCGC00015190-03, NCGC00015190-04, NCGC00015190-05, NCGC00015190-06, NCGC00015190-07, NCGC00024602-01, NCGC00024602-02, NCGC00024602-03, NCGC00024602-04, NCGC00261058-01, ACM138977283, AN-31786, HY-15640, LS-27974, SC-97943, SMR001230854, RT-011911, C-191, EU-0100373, FT-0664232, 7,8-dihydroxy-2H-2-benzazepine-2-carbothioamide, 977C283, J-007205, SR-01000075437-1, SR-01000075437-3, SR-01000075437-7, BRD-K44849676-001-03-0, N-[2-(4-Chlorophenyl)ethyl]-1,3,4,5-tetrahydro-, 2-({[2-(4-chlorophenyl)ethyl]amino}thioxomethyl)-1H,3H,4H,5H-benzo[e]azepine-7 ,8-diol, N-(4-Chlorophenethyl)-7,8-dihydroxy-1,3,4,5-tetrahydro-2H-2-benzazepine-2-carbothioamide, N-(4-chlorophenethyl)-7,8-dihydroxy-4,5-dihydro-1H-benzo[c]azepine-2(3H)-carbothioamide, 6ET, N-[2-(4-chlorophenyl)ethyl]-7,8-dihydroxy-2,3,4,5-tetrahydro-1H-2-benzazepine-2-carbothioamide


ID: 509

chemical graph of compound 509



InChIKey: DRKXOTFIYYKGMI-UHFFFAOYSA-N
SMILES: CC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC=CS3)C

biological descriptors:

CFTR relevance: CFTR corrector

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

reference list:

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


CID is 734128
synonyms found at PubChem are:
N-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]thiophene-2-carboxamide, (E)-N-(4-(3,4-dimethylphenyl)thiazol-2(3H)-ylidene)thiophene-2-carboxamide, 313374-94-6, AC1LED22, Oprea1_191452, SCHEMBL838040, IFLab1_000229, MolPort-002-274-721, MolPort-003-009-184, HMS1412K09, ZINC4031545, STL230210, AKOS000928713, AKOS024573936, MCULE-3709003538, IDI1_008448, EU-0067591, SR-01000394931, SR-01000394931-1, Z28298877, F0013-0146


ID: 510

chemical graph of compound 510



InChIKey: DRLFMBDRBRZALE-UHFFFAOYSA-N
SMILES: CC(=O)NCCC1=CNC2=C1C=C(C=C2)OC

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 896
synonyms found at PubChem are:
Melatonin, 73-31-4, Melatonine, N-Acetyl-5-methoxytryptamine, Circadin, 5-Methoxy-N-acetyltryptamine, N-[2-(5-Methoxy-1H-indol-3-yl)ethyl]acetamide, N-(2-(5-Methoxy-1H-indol-3-yl)ethyl)acetamide, Melatol, Melatonex, Melovine, N-[2-(5-methoxyindol-3-yl)ethyl]acetamide, Acetamide, N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-, Melapure, Posidorm, Vivitas, Pineal Hormone, Sleep Right, UNII-JL5DK93RCL, Night Rest, Rx Balance, Revital Melatonin, [3H]melatonin, Nature'S Harmony, Melatonina (TN), N-(2-(5-Methoxyindol-3-yl)ethyl)acetamide, Mela-T, [3H]-melatonin, N-acetyl-5-methoxy-tryptamine, NSC 113928, CCRIS 3472, CHEMBL45, EINECS 200-797-7, IN1244, JL5DK93RCL, Acetamide, N-(2-(5-methoxyindol-3-yl)ethyl)-, BRN 0205542, [3H]MLT, CHEBI:16796, PREVENTION 2 (MELATONIN), PREVENTION 3 (MELATONIN), PREVENTION 4 (MELATONIN), PREVENTION 5 (MELATONIN), DRLFMBDRBRZALE-UHFFFAOYSA-N, M-1200, M-1250, Acetamide, N-[2-(5-methoxyindol-3-yl)ethyl]-, TNP00300, Acetamide, N-(2-(5-methoxy-1H-indol-3-yl)ethyl)-, N-[2-(5-Methoxy-1H-indol-3-yl)-ethyl]-acetamide, NSC113928, MT6, CAS-73-31-4, NCGC00015680-11, NMR/14327425, 3-(n-acetyl-2-aminoethyl)-5-methoxyindole, M1105, DSSTox_CID_2421, M 5250, DSSTox_RID_76585, DSSTox_GSID_22421, PREVENTION 1 (MELATONIN) (PREVENTION 1), 8041-44-9, Acetamide, {N-[2-(5-methoxyindol-3-yl)ethyl]-}, Acetamide, {N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-}, 4-ACETAMIDO-4'-ISOTHIO-CYANATOSTILBENE-2,2'-DISULFONIC ACID, WLN: T56 BMJ D2MV1 GO1, ML1, SMR000326666, N-(2-(5-methoxyindol-3-yl)ethyl)-Acetamide, N-[2-(5-methoxyindol-3-yl)ethyl]-Acetamide, N-[2-(5-Methoxy-1H-indol-3-yl)ethyl)acetamide, SR-01000075559, Acetamide, N-(2-(5-methoxy-1H-indol-3-yl)ethyl)-(9CI), Acetamide, N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-(9CI), Melatonina, Acetamide, N-(2-(5-methoxy-1H-indol-3-yl)ethyl)- (9CI), Acetamide, N-[2-(5-methoxy-1H-indol-3-yl)ethyl]- (9CI), Melatonine;, Guna-dermo, HSDB 7509, Melatonin (MLT), Prestwick_312, Melatonex, Melatonin, PubChem18245, Spectrum_000185, Guna-dermo (Salt/Mix), Prestwick0_000458, Prestwick1_000458, Prestwick2_000458, Prestwick3_000458, Spectrum2_001344, Spectrum3_001393, Spectrum4_000066, Spectrum5_001745, Lopac-M-5250, Melatonin, 99% 5g, ChemDiv2_003916, D0AN7B, D0B5CB, D0M9SI, Melatonex, 73-31-4, Melatonin, >=99.5%, AC1L1A9Q, AC1Q4F1W, AC1Q4F1X, Lopac0_000787, Oprea1_104553, Oprea1_814234, SCHEMBL19018, BSPBio_000536, BSPBio_003006, GTPL224, KBioGR_000591, KBioSS_000665, 5-22-12-00042 (Beilstein Handbook Reference), KSC498C4R, MLS000859594, MLS001055382, MLS001240204, ARONIS24462, BIDD:ER0618, DivK1c_000353, SPECTRUM1500690, SPBio_001527, SPBio_002475, Melatonin (synth.) ultra-pure, ACE073, BDBM9019, BPBio1_000590, GTPL1357, DTXSID1022421, CTK3J8148, HMS501B15, KBio1_000353, KBio2_000665, KBio2_003233, KBio2_005801, KBio3_002226, ZINC57060, BBC/626, BIM0105, Melatonin 1.0 mg/ml in Methanol, MolPort-000-737-883, NINDS_000353, ZX-AFC003034, HMS1380B22, HMS1569K18, HMS1921E04, HMS2089F09, HMS2096K18, HMS2233D23, HMS3262M16, HMS3370J20, HMS3654A22, HMS3713K18, Melatonin (synth.) standard-grade, ACT03490, BCP28154, HY-B0075, KS-00000GX9, NSC56423, ZX-AS004827, Tox21_110195, Tox21_201527, Tox21_302926, Tox21_500787, ANW-42685, BG0247, CCG-38837, CM-539, GP8408, HSCI1_000400, KM1545, Melatonin, powder, >=98% (TLC), MFCD00005655, NSC-56423, SBB003265, STK386880, AKOS000276269, Tox21_110195_1, CS-1769, DB01065, KS-1454, LP00787, LS-1623, MCULE-1497884152, NSC-113928, RP17870, RTC-063565, SDCCGMLS-0065812.P001, SDCCGMLS-0065812.P002, SHG0000005, IDI1_000353, IDI1_002631, KS-000048J8, SMP2_000309, N-acetyl-5-methoxy-tryptamine Melatonine, NCGC00015680-01, NCGC00015680-02, NCGC00015680-03, NCGC00015680-04, NCGC00015680-05, NCGC00015680-06, NCGC00015680-07, NCGC00015680-08, NCGC00015680-09, NCGC00015680-10, NCGC00015680-12, NCGC00015680-13, NCGC00015680-14, NCGC00015680-15, NCGC00015680-16, NCGC00015680-18, NCGC00090727-01, NCGC00090727-02, NCGC00090727-03, NCGC00090727-04, NCGC00090727-05, NCGC00090727-06, NCGC00090727-07, NCGC00090727-08, NCGC00090727-09, NCGC00256404-01, NCGC00259077-01, NCGC00261472-01, 4CN-3100, AC-10019, AJ-09558, AK110931, BAS 01281092, BC200187, NCI60_004378, SC-16475, ST057260, ZB001948, AB0007332, AB2000011, KB-178582, TC-063565, AB00053279, EU-0100787, FT-0628191, FT-0658928, S1204, ST24031293, C01598, D08170, J10164, AB00053279-10, AB00053279_12, {N-[2-(5-methoxyindol-3-yl)ethyl]-} Acetamide, 005M655, L001261, N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-Acetamide, I05-0076, I10-0345, SR-01000075559-1, SR-01000075559-6, SR-01000075559-7, SR-01000075559-8, {N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-} Acetamide, BRD-K97530723-001-07-6, BRD-K97530723-001-11-8, F1929-1777, 0E2B08C1-B325-45B1-8939-6F9081EFDFA4, A4039/0172195, Acetamide, N-[2-(5-methoxyindol-3-yl)ethyl]- (6CI,8CI), Acetamide, N-[2-(5-methoxyindol-3-yl)ethyl]-(6CI,8CI), Melatonin, United States Pharmacopeia (USP) Reference Standard, Disodium 4-acetamido-4'-isothiocyanato-stilben-2,2'-disulfonate, Melatonin, Pharmaceutical Secondary Standard; Certified Reference Material


ID: 511

chemical graph of compound 511



InChIKey: DRZDMSPFGPTPER-UHFFFAOYSA-N
SMILES: C1=CC=C2C(=C1)C(=O)N(C2=O)C3=C(C=C(C=C3)N)Cl

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 6603717
synonyms found at PubChem are:
N-(4-Amino-2-chlorophenyl)phthalimide, 19348-53-9, 2-(4-amino-2-chlorophenyl)isoindoline-1,3-dione, 2-(4-amino-2-chlorophenyl)-1H-isoindole-1,3(2H)-dione, 1H-Isoindole-1,3(2H)-dione,2-(4-amino-2-chlorophenyl)-, 2-(4-amino-2-chlorophenyl)-2,3-dihydro-1H-isoindole-1,3-dione, NCGC00015106-01, AC1O7FZU, Lopac-A-9345, AC1Q51LZ, Lopac0_000153, MLS002153513, CHEMBL278755, SCHEMBL1322530, ZINC8695, CTK4E1267, DTXSID90424953, MolPort-004-307-504, HMS2230F03, HMS3260O08, HMS3372L10, Tox21_500153, MFCD00658249, AKOS000142827, CCG-204248, LP00153, MCULE-6724628192, NE11647, NCGC00015106-02, NCGC00015106-03, NCGC00015106-04, NCGC00093643-01, NCGC00093643-02, NCGC00260838-01, DA-08690, SMR001230845, EU-0100153, FT-0720847, EN300-41106, A 9345, 2-(4-amino-2-chlorophenyl)isoindole-1,3-dione, SR-01000075694, J-012528, SR-01000075694-1, 2-(4-Amino-2-chlorophenyl)-2H-isoindole-1,3-dione


ID: 512

chemical graph of compound 512



InChIKey: DSGOSRLTVBPLCU-UHFFFAOYSA-N
SMILES: C1CNCC(C2=CC(=C(C(=C21)Cl)O)O)C3=CC=C(C=C3)O.Br

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 11957552
synonyms found at PubChem are:
Fenoldopam Hydrobromide, Fenoldopam bromide, 67287-54-1, Fenoldopam monohydrobromide, SKF-82526, SMR000875267, 67227-56-9 (Parent), SR-01000075882, EINECS 266-634-7, SKF 82526 Hydrobromide, MLS001333093, MLS001333094, SCHEMBL1319766, CHEMBL1256646, DSGOSRLTVBPLCU-UHFFFAOYSA-N, 6-Chloro-2,3,4,5-tetrahydro-1-(4-hydroxyphenyl)-1H-3-benzazepine-7,8-diol monohydrobromide, AOB33784, Fenoldopam monohydrobromide, >=98%, Tox21_500556, AKOS030558287, CCG-221860, LP00556, 6-Chloro-2,3,4,5-tetrahydro-7,8-dihydroxy-1-(4-hydroxyphenyl)-1H-3-benzazepinium bromide, NCGC00093942-01, NCGC00261241-01, AS-16645, EU-0100556, FT-0668498, EN300-207690, F 6800, SR-01000075882-1, ( inverted exclamation markA)-Fenoldopam Hydrobromide, ( inverted exclamation markA)-SKF 82526 Hydrobromide, 6-Chloro-2,3,4,5-tetrahydro-1-(4-hydroxyphenyl)-1H-3-benzazepine-7,8-diol Hydrobromide, 6-Chloro-7,8-dihydroxy-1-p-hydroxyphenyl-2,3,4,5-tetrahydro-1H-3-benzazepine hydrobromide, 6-Chloro-7,8-dihydroxyl-1-p-hydroxyphenyl-2,3,4,5-tetrahydro-1H-3-benzazepine hydrobromide


ID: 513

chemical graph of compound 513



InChIKey: DSKIOWHQLUWFLG-SPIKMXEPSA-N
SMILES: CN1CCN(CC1)CCCN2C3=C(SC4=CC=CC=C24)C=CC(=C3)Cl.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:

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


CID is 5281032
synonyms found at PubChem are:
Prochlorperazine dimaleate, Prochlorperazine maleate, 84-02-6, UNII-I1T8O1JTL6, Buccastem, Emetiral, Pasotomin, Prochlorperazine dimaleate salt, Nibromin A, Meterazin maleate, Stemetil dimaleate, I1T8O1JTL6, Proclorperazine maleate, Prochlorperazinu dimaleat, Prochlorperazine bimaleate, Prochlorperazine hydrogen maleate, Prochloroproazine hydrogen maleate, Prochlorperazinu dimaleat [Czech], Compazine (TN), EINECS 201-511-3, DSSTox_CID_28941, DSSTox_RID_83206, DSSTox_GSID_49015, C20H24ClN3S.2C4H4O4, CHEBI:8436, 2-Chloro-10-(3-(4-methyl-1-piperazinyl)propyl)phenothiazine dimaleate, 2-Chloro-10-(3-(1-methyl-4-piperazinyl)propyl)phenothiazine, dimaleate, 2-Chloro-10-(3-(4-methyl-1-piperazinyl)propyl)phenothiazine maleate (1:2), CAS-84-02-6, SR-01000000260, NCGC00015856-08, 10H-Phenothiazine, 2-chloro-10-(3-(4-methyl-1-piperazinyl)propyl)-, (Z)-2-butenedioate (1:2), (Z)-but-2-enedioic acid;2-chloro-10-[3-(4-methylpiperazin-1-yl)propyl]phenothiazine, Prestwick_410, Prochlorperazine maleate [USP:JAN], AC1NQXXB, Prochlorperazin-dimaleat, (Z)-but-2-enedioic acid; 2-chloro-10-[3-(4-methylpiperazin-1-yl)propyl]phenothiazine, 2-Chloro-10-(3-(4-methylpiperazin-1-yl)propyl)-10H-phenothiazine dimaleate, Phenothiazine, 2-chloro-10-(3-(4-methyl-1-piperazinyl)propyl)-, maleate (1:2), SCHEMBL40755, CHEMBL1314751, DTXSID1049015, MolPort-001-727-970, HMS1569O19, HMS2096O19, HMS3263O09, HMS3713O19, Tox21_113522, Tox21_501034, MFCD00069330, Prochlorperazine maleate (JP17/USP), AKOS024457528, Tox21_113522_1, CCG-220399, CCG-222338, LP01034, NCGC00015856-10, NCGC00094323-01, NCGC00261719-01, AS-13744, EU-0101034, P2368, W0066, D00479, J10225, P 9178, SR-01000000260-2, SR-01000000260-9, 2-Chloro-10-[3-(4-methylpiperazin-1-yl)propyl]phenothiazine Dimaleate, Prochlorperazine maleate, British Pharmacopoeia (BP) Reference Standard, Prochlorperazine maleate, European Pharmacopoeia (EP) Reference Standard, 2-Chloro-10-[3[(4-methyl-1-piperazinyl)propyl]-10H-phenothiazine dimaleate, Prochlorperazine maleate, United States Pharmacopeia (USP) Reference Standard, AC1NUWJK, 2-chloro-10-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]phenothiazine; (Z)-4-hydroxy-4-oxobut-2-enoate, 2-chloro-10-[3-(4-methylpiperazin-1-yl)propyl]-10H-phenothiazine di[(2Z)-but-2-enedioic acid]


ID: 514

chemical graph of compound 514



InChIKey: DSSOOOVNLBRAPY-UHFFFAOYSA-N
SMILES: CC(C)(C)C1CCC2(CC1)NC(=S)N(N2)C3=NC4=CC=CC=C4S3

biological descriptors:

CFTR relevance: CFTR corrector

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

reference list:

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


CID is 608835
synonyms found at PubChem are:
2-Benzothiazol-2-yl-8-tert-butyl-1,2,4-triaza-spiro[4.5]decane-3-thione, AC1LO30S, Oprea1_280562, SCHEMBL837825, DSSOOOVNLBRAPY-UHFFFAOYSA-N, MolPort-002-710-202, ZINC1067812, STK764818, AKOS001746223, A2544/0108255, 1,2,4-Triazaspiro[4.5]decane-3-thione, 2-(2-benzothiazolyl)-8-tert-butyl-, 2-(1,3-benzothiazol-2-yl)-8-tert-butyl-1,2,4-triazaspiro[4.5]decane-3-thione, 2-(benzo[d]thiazol-2-yl)-8-tert-butyl-1,2,4-triazaspiro[4.5]decane-3-thione, 3-(1,3-benzothiazol-2-yl)-8-tert-butyl-1,3,4-triazaspiro[4.5]decane-2-thione


ID: 515

chemical graph of compound 515



InChIKey: DSSYKIVIOFKYAU-PVSHWOEXSA-N
SMILES: CC1([C@@H]2CCC1(C(=O)C2)C)C

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 6857773
synonyms found at PubChem are:
SR-05000001993, 1R-CAMPHOR, AC1OAH6S, SPECTRUM1500156, SCHEMBL16582770, HMS1920I11, HMS2091O13, CCG-38655, SDCCGMLS-0066642.P001, (1R)-4,7,7-trimethylbicyclo[2.2.1]heptan-3-one, SR-05000001993-1, SR-05000001993-3


ID: 516

chemical graph of compound 516



InChIKey: DTCZZBVPTHVXFA-UHFFFAOYSA-N
SMILES: CC1=CC(=C(C(=C1)C)N=C2C=C3C4=CC(=C(C=C4CCN3C(=O)N2C)OC)OC)C.Cl

reference list:

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


CID is 3060974
synonyms found at PubChem are:
Trequinsin hydrochloride, HL 725, 78416-81-6, TCMDC-125545, Trequinsin, Hydrochloride, HL-725, NCGC00094424-01, DSSTox_CID_25806, DSSTox_RID_81144, DSSTox_GSID_45806, 4H-Pyrimido(6,1-a)isoquinolin-4-one, 2,3,6,7-tetrahydro-9,10-dimethoxy-3-methyl-2-((2,4,6-trimethylphenyl)imino)-, monohydrochloride, 9,10-Dimethoxy-2-mesitylimino-3-methyl-2,3,6,7-tetrahydro-4H-pyrimido-(6,1-a)-isoquinolin-4-one, HCl, CAS-78416-81-6, Trequinsin HCl, Trequinsinhydrochlorid, AC1MI0R6, C24H27N3O3.HCl, CHEMBL527956, SCHEMBL7327917, CHEMBL1256910, DTXSID8045806, CTK8G3572, MolPort-023-276-400, Trequinsin hydrochloride, >=98%, 79855-88-2 (Parent), Tox21_111279, Tox21_501165, MFCD01076563, AKOS024457057, Tox21_111279_1, CCG-222469, LP01165, NCGC00092376-01, NCGC00092376-06, NCGC00261850-01, LS-136233, B7022, EU-0101165, FT-0630860, T 2057, SR-01000076150, SR-01000076150-1, 2,3,6,7-Tetrahydro-9,10-dimethoxy-3-methyl-2-[(2,4,6-trimethylphenyl)imino]-4H-pyrimido[6,1-a]isoquinolin-4-one hydrochloride, 9,10-dimethoxy-3-methyl-2-(2,4,6-trimethylphenyl)imino-6,7-dihydropyrimido[6,1-a]isoquinolin-4-one hydrochloride, AC1Q1SZQ, SCHEMBL6375918, 9,10-dimethoxy-3-methyl-2-(2,4,6-trimethylphenyl)imino-6,7-dihydropyrimido[4,3-a]isoquinolin-4-one hydrochloride


ID: 517

chemical graph of compound 517



InChIKey: DTFARBHXORYQBF-ORYQWCPZSA-N
SMILES: CC(C)[C@@H]1CC2=C(O1)C=CC3=C2O[C@H]4COC5=CC(=C(C=C5[C@H]4C3=O)OC)OC

biological descriptors:

CFTR relevance: weak CFTR corrector

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

reference list:

"JW Hanrahan" "R Robert" "Y Luo" "KA Teske" "GW Carlile" "D Zhang" "DY Thomas"


CID is 73068
synonyms found at PubChem are:
Dihydrorotenone, (2s,6ar,12ar)-8,9-dimethoxy-2-(propan-2-yl)-1,2,12,12a-tetrahydrochromeno[3,4-b]furo[2,3-h]chromen-6(6ah)-one, Caswell No. 353, Dihydrorotenone (VAN), 1',2'-Dihydrorotenone, Rotenone, dihydro- (VAN), NSC 53866, EPA Pesticide Chemical Code 071002, NSC 351138, AC1L2J7Q, AC1Q6KP8, CTK5C4931, (1)Benzopyrano(3,4-b)furo(2,3-h)(1)benzopyran-6(6a-alphah)-one, 1,2,12,12a-alpha-tetrahydro-2-alpha-isopropyl-8,9-dimethoxy-, LS-39365, (1)Benzopyrano(3,4-b)furo(2,3-h)(1)benzopyran-6(6aalphaH)-one, 1,2,12,12aalpha-tetrahydro-2alpha-isopropyl-8,9-dimethoxy-, (1)Benzopyrano(3,4-b)furo(2,3-h)(1)benzopyran-6(6aH)-one, 1,2,12,12a-tetrahydro-8,9-dimethoxy-2-(1-methylethyl)-, (2R-(2alpha,6aalpha,12aalpha))-


ID: 518

chemical graph of compound 518



InChIKey: DTNGBIGBPPPNNB-UHFFFAOYSA-N
SMILES: CC1=CC(=O)C2=C(C(=C(C=C2O1)O)CC=C(C)C)O

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 68477
synonyms found at PubChem are:
Peucenin, 578-72-3, 4H-1-Benzopyran-4-one, 5,7-dihydroxy-2-methyl-6-(3-methyl-2-butenyl)-, 5,7-Dihydroxy-2-methyl-6-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one, Chromone, 5,7-dihydroxy-2-methyl-6-(3-methyl-2-butenyl)-, Spectrum_000553, SpecPlus_000018, AC1Q6AFP, Spectrum2_000344, Spectrum3_000095, Spectrum4_001371, Spectrum5_000042, BSPBio_001650, KBioGR_001662, KBioSS_001033, SPECTRUM100528, DivK1c_006114, SPBio_000407, AC1L29T7, CHEMBL1415085, SCHEMBL15106595, CTK1H3643, KBio1_001058, KBio2_001033, KBio2_003601, KBio2_006169, KBio3_000750, DTNGBIGBPPPNNB-UHFFFAOYSA-N, CCG-38619, AKOS030553263, SDCCGMLS-0066289.P001, NCGC00095426-01, NCGC00095426-02, NCGC00179118-01, 5,7-dihydroxy-2-methyl-6-4h-1-benzopyran-4-one, SR-05000002510, SR-05000002510-1, BRD-K73103240-001-03-3, 5,7-dihydroxy-2-methyl-6-(3-methylbut-2-enyl)chromone, 5,7-dihydroxy-2-methyl-6-(3-methylbut-2-enyl)chromen-4-one, 5,7-Dihydroxy-2-methyl-6-(3-methyl-2-butenyl)-4H-chromen-4-one #


ID: 519

chemical graph of compound 519



InChIKey: DTNMUOXAPMXVHZ-UHFFFAOYSA-N
SMILES: C(C1=C(SCC(=O)OC)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:

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


CID is 46227419
synonyms found at PubChem are:
CHEMBL596405


ID: 520

chemical graph of compound 520



InChIKey: DTOUUUZOYKYHEP-UHFFFAOYSA-N
SMILES: CCCCC(CC)CN1CC(CN(C1)CC(CC)CCCC)(C)N

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 3607
synonyms found at PubChem are:
hexetidine, 141-94-6, Oraldene, Hexoral, Glypesin, Hextril, Elsix, Collu hextril, Sterilate, Sterisil, Triocil, Triscol, Duranil Aerosol, Hexetidinum, Collu-Hextril, Steri/Sol, Drossadin, Hexetidina, Oraseptic, Paradenyl, Steri/Sol (VAN), Caswell No. 033BB, Hexetidinum [INN-Latin], Hexetidina [INN-Spanish], NSC 17764, 5-Pyrimidinamine, 1,3-bis(2-ethylhexyl)hexahydro-5-methyl-, C21H45N3, EINECS 205-513-5, 1,3-bis(2-ethylhexyl)-5-methyl-1,3-diazinan-5-amine, AI3-15546, MLS002207232, 5-Amino-1,3-bis(2-ethylhexyl)-5-methylhexahydropyrimidine, 5-Amino-1,3-bis(2-ethylhexyl)hexahydro-5-methylpyrimidine, P 252, DTOUUUZOYKYHEP-UHFFFAOYSA-N, Hexetidine, mixture of stereoisomers, 1,3-Bis(2-ethylhexyl)-5-amino-hexahydro-5-methylpyrimidin, DSSTox_CID_25297, DSSTox_RID_80788, DSSTox_GSID_45297, 1,3-Bis(2-ethylhexyl)hexahydro-5-methyl-5-pyrimidiamine, 5-Amino-1,3-bis(2-ethylhexyl)-5-methyl-hexhydropyrimidine, Hexigel, Pyrimidine, 5-amino-1,3-bis(2-ethylhexyl)hexahydro-5-methyl-, Hexetidine [BAN], Hexetidine [INN:BAN], SR-01000872662, Hexopyrimidine, Esetidina, Hexetidin, Hexocil, 1,3-bis(2-ethylhexyl)-5-methyl-1,3-diazaperhydroine-5-ylamine, HSDB 7828, NCGC00016404-01, CAS-141-94-6, Hexetidine (INN), Prestwick_800, Spectrum_000236, Prestwick0_000551, Prestwick1_000551, Prestwick2_000551, Prestwick3_000551, Spectrum2_000953, Spectrum3_000271, Spectrum4_000395, Spectrum5_001435, AC1L1GB5, AC1Q2V9B, AC1Q4V4W, SCHEMBL56672, BSPBio_000621, BSPBio_001742, KBioGR_000949, KBioSS_000716, DivK1c_000280, SPECTRUM1500633, SPBio_000946, SPBio_002542, BPBio1_000685, CHEMBL144673, DTXSID1045297, CHEBI:94339, CTK8G0178, HMS500N22, KBio1_000280, KBio2_000716, KBio2_003284, KBio2_005852, KBio3_001242, MolPort-001-770-543, NINDS_000280, HMS1569P03, HMS1921M09, HMS2096P03, HMS3713P03, Pharmakon1600-01500633, HY-B0996, NSC17764, ZX-AT010428, Tox21_110424, CCG-39752, NSC-17764, NSC757394, OR8156, SBB001384, AKOS000277944, AKOS024348907, Tox21_110424_1, CS-4490, DB08958, MCULE-8471986715, NSC-757394, IDI1_000280, NCGC00094819-01, NCGC00094819-02, NCGC00094819-03, NCGC00094819-04, NCGC00094819-07, AN-43898, CC-29333, SMR000059080, SBI-0051566.P002, KB-270000, LS-173102, AB00052133, FT-0627047, ST50826237, X6883, D07068, AB00052133_06, 141H946, C-20302, Pyrimidine,3-bis(2-ethylhexyl)hexahydro-5-methyl-, SR-01000872662-1, SR-01000872662-2, I14-44805, 5-Pyrimidinamine,3-bis(2-ethylhexyl)hexahydro-5-methyl-, 1,3-bis(2-ethylhexyl)-5-methyl-hexahydropyrimidin-5-amine, 1,3-bis(2-ethylhexyl)-5-methylhexahydropyrimidin-5-amine, 5-pyrimidinamine,1,3-bis(2-ethylhexyl)hexahydro-5-methyl-, Hexetidine, European Pharmacopoeia (EP) Reference Standard, 1,3-Bis(2-ethylhexyl)-5-methylhexahydro-5-pyrimidinamine #, Pyrimidine, 5-amino-1,3-bis(2-ethylhexyl)hexahydro-5-methyl- (8CI)


ID: 521

chemical graph of compound 521



InChIKey: DTSOZYYWEZJFSS-XTHCGPPUSA-N
SMILES: C1[C@@H]([C@H]([C@@H]([C@H]([C@@H]1NC(=O)[C@H](CCN)O)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)N)O)O)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CN)O)O)O)N.O

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 16218899
synonyms found at PubChem are:
Amikacin hydrate, 1257517-67-1, BAY416651 hydrate, MLS002207279, SMR001306795, N1-[(S)-4-Amino-2-hydroxybutyryl]kanamycin A, SCHEMBL2172496, CHEMBL1879513, BDBM91426, cid_16218899, DTSOZYYWEZJFSS-XTHCGPPUSA-N, C22H43N5O13.H2O, HY-B0509, 2212AH, AKOS030627375, CS-2711, Amikacin hydrate, aminoglycoside antibiotic, 1257517-67-1,37517-28-5(freebase), (2S)-4-amino-N-[(1R,2S,3S,4R,5S)-5-amino-2-[(2S,3R,4S,5S,6R)-4-amino-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-[(2R,3R,4S,5S,6R)-6-(aminomethyl)-3,4,5-trihydroxyoxan-2-yl]oxy-3-hydroxycyclohexyl]


ID: 522

chemical graph of compound 522



InChIKey: DUECABXXAMFFBH-CYBMUJFWSA-N
SMILES: CC(=C)[C@H]1COC2=C(O1)C=C3C=CC(=O)OC3=C2

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 6708593
synonyms found at PubChem are:
OBLIQUIN, 16167-05-8, KBio2_006211, Spectrum_000595, SpecPlus_000178, AC1O8FER, Spectrum2_000348, Spectrum3_000100, Spectrum4_001382, Spectrum5_000084, BSPBio_001660, KBioGR_001704, KBioSS_001075, SPECTRUM100540, DivK1c_006274, SPBio_000415, CHEMBL3039091, SCHEMBL12062102, KBio1_001218, KBio2_001075, KBio2_003643, KBio3_000760, CHEBI:113544, CCG-38623, SDCCGMLS-0066301.P001, SR-05000002491, SR-05000002491-1, BRD-K88954184-001-03-0, (2S)-2-prop-1-en-2-yl-2,3-dihydropyrano[2,3-g][1,4]benzodioxin-7-one


ID: 523

chemical graph of compound 523



InChIKey: DUHUCHOQIDJXAT-OLVMNOGESA-N
SMILES: CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC(=O)[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:

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


CID is 104845
synonyms found at PubChem are:
Alfaxalone, Alphaxalone, 23930-19-0, 5alpha-Pregnan-3alpha-ol-11,20-dione, alfaxolone, Alfaxalonum [INN-Latin], GR 2/234, Alfaxalona [INN-Spanish], 3alpha-Hydroxy-5alpha-pregnane-11,20-dione, UNII-BD07M97B2A, BRN 3217240, Alfadione, 3alpha-Hydroxy-5alpha-pregnan-11,20-dion, MLS000069684, MLS001076262, BD07M97B2A, CHEMBL190279, CHEBI:34531, 3-alpha-Hydroxy-5-alpha-pregnane-11,20-dione, (3-alpha,5-alpha)-3-Hydroxypregnane-11,20-dione, 3-Hydroxypregnane-11,20-dione, NCGC00023100-03, SMR000058494, DSSTox_CID_2576, DSSTox_RID_76638, Alphaxolone, DSSTox_GSID_22576, 5-alpha-Pregnane-11,20-dione, 3-alpha-hydroxy-, Alfaxalona, Alfaxalonum, (3R,5S,8S,9S,10S,13S,14S,17S)-17-acetyl-3-hydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-11-one, delta(16)-alfaxalone, SR-01000000168, Alfaxalone [INN:DCF:JAN], 5alpha-alphaxalone, Alfaxalone [INN:BAN:DCF:JAN], Alfaxalone (INN), CAS-23930-19-0, AC1L2XLT, Opera_ID_1629, Prestwick0_001002, Prestwick1_001002, Prestwick2_001002, Prestwick3_001002, D06UBH, 3 alpha-hydroxy-5 alpha-pregnane-11,20-dione, BIDD:PXR0037, Lopac0_000929, SCHEMBL57756, BSPBio_001123, 4-08-00-02091 (Beilstein Handbook Reference), SPBio_003004, BPBio1_001237, GTPL5461, DTXSID9022576, CTK8F7676, DUHUCHOQIDJXAT-OLVMNOGESA-N, MolPort-003-959-279, HMS1571I05, HMS2098I05, HMS2236N05, HMS3262J20, HMS3715I05, ZINC4081122, Tox21_110884, Tox21_500929, BDBM50164570, AKOS024457399, Tox21_110884_1, API0010033, CCG-205010, DB11371, LP00929, 5alpha-pregnane-3alpha-ol-11,20-dione, NCGC00023100-04, NCGC00023100-05, NCGC00023100-06, NCGC00023100-08, NCGC00261614-01, (3a,5a)-3-Hydroxypregnane-11,20-dione, LS-118546, (3?,5?)-3-Hydroxypregnane-11,20-dione, AB00384358, B7253, EU-0100929, C13803, D07282, P 5052, (3alpha,5alpha)-3-hydroxypregnane-11,20-dione, Pregnane-11,20-dione, 3-hydroxy-, (3a,5a)-, SR-01000076070, J-015280, SR-01000000168-2, SR-01000000168-3, SR-01000076070-1, BRD-K41445866-001-03-0, Pregnane-11,20-dione, 3-hydroxy-, (3-alpha,5-alpha)-, 5alpha-Pregnan-3alpha-ol-11,20-dione, powder, >=98% (TLC), Pregnane-11,20-dione, 3-hydroxy-, (3-alpha,5-alpha)- (9CI), (3R,5S,8S,9S,10S,13S,14S,17S)-17-Acetyl-3-hydroxy-10,13-dimethyl-hexadecahydro-cyclopenta[a]phenanthren-11-one, EY4


ID: 524

chemical graph of compound 524



InChIKey: DUIBXZLCROUOFD-UHFFFAOYSA-N
SMILES: CC1=CC(=C(C(=C1C(=O)O)O)C)OC(=O)C2=C(C(=C(C=C2C)OC)C=O)O

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 5321461
synonyms found at PubChem are:
Baeomycesic acid, Baeomycessaure, Beomycesic acid, AC1NT0J3, CHEMBL2227773, SCHEMBL18621794, 644-66-6, 4-(3-formyl-2-hydroxy-4-methoxy-6-methylbenzoyl)oxy-2-hydroxy-3,6-dimethylbenzoic acid


ID: 525

chemical graph of compound 525



InChIKey: DUIGUKRYYAGJAF-UHFFFAOYSA-N
SMILES: C1CN=C(N1)CN(CC2=CC=CC=C2)C3=CC=CC=C3.OP(=O)(O)O

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 158798
synonyms found at PubChem are:
Antazoline phosphate, 154-68-7, Antazoline HO, UNII-VPR5FPH326, Antazoline phosphate [USP], Antazoline phosphate salt, VPR5FPH326, MLS000028623, SMR000058669, N-Benzyl-4,5-dihydro-N-phenyl-1H-imidazole-2-methylamine monophosphate, Antazoline phosphate (USP), Benzyl-(4,5-dihydro-1H-imidazol-2-ylmethyl)-phenyl-amine HO, 91-75-8 (Parent), N-benzyl-N-(4,5-dihydro-1H-imidazol-2-ylmethyl)aniline; phosphoric acid, N-benzyl-N-(4,5-dihydro-1H-imidazol-2-ylmethyl)aniline;phosphoric acid, EINECS 205-831-4, AC1L4KMX, Opera_ID_1677, SCHEMBL23316, MLS001148180, 2-yl)methyl)aniline phosphate, SPECTRUM1500126, cid_158798, CHEMBL1200550, CTK5J6286, HMS500E05, C17H19N3.H3PO4, DTXSID00165507, 2-((N-Benzylanilino)methyl)-2-imidazoline phosphate (1:1), HMS1920E05, HMS2091K05, HMS2235H13, HMS3372H07, Pharmakon1600-01500126, 6397AF, CCG-39133, NSC755865, AKOS015963420, API0001509, MCULE-6727478889, NSC-755865, 1H-Imidazole-2-methanamine, 4,5-dihydro-N-phenyl-N-(phenylmethyl)-, phosphate (1:1), NCGC00094590-01, NCGC00094590-02, NCGC00094590-03, AC-20134, AN-23332, N-benzyl-N-((4,5-dihydro-1H-imidazol-, FT-0766726, ST51037133, D02950, J-009133, SR-01000000255-4, 2-(N-BENZYLANILINOMETHYL) IMIDAZOLINE PHOSPHATE, (2-imidazolin-2-ylmethyl)phenylbenzylamine, phosphoric acid, Antazoline phosphate salt, analytical standard, for drug analysis, Antazoline phosphate, United States Pharmacopeia (USP) Reference Standard, N-benzyl-N-(4,5-dihydro-1H-imidazol-2-ylmethyl)aniline,phosphoric acid


ID: 526

chemical graph of compound 526



InChIKey: DUQADSPERJRQBW-UHFFFAOYSA-N
SMILES: C1=CC(=C(C=C1C=C(C#N)C#N)O)[N+](=O)[O-]

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 2046
synonyms found at PubChem are:
AG 126, Tyrphostin AG 126, 118409-62-4, AG-126, ag126, alpha-Cyano-(3-hydroxy-4-nitro)cinnamonitrile, (3-Hydroxy-4-nitrobenzylidene)malononitrile, UNII-7YA4AMD1JC, 7YA4AMD1JC, IN1431, 2-[(3-hydroxy-4-nitrophenyl)methylidene]propanedinitrile, Tyrphostin AG127, Propanedinitrile, ((3-hydroxy-4-nitrophenyl)methylene)-, Propanedinitrile,2-[(3-hydroxy-4-nitrophenyl)methylene]-, Tyrphostin A 10, SR-01000076182, AG-127, ACMC-20dhp9, AC1L1CSU, BiomolKI_000026, Lopac-T-9177, BiomolKI2_000034, UPCMLD-DP015, AC1Q5AT2, Lopac0_001272, BMK1-D2, BSPBio_001196, KBioGR_000536, KBioSS_000536, CHEMBL77387, BDBM4326, SCHEMBL1802883, UPCMLD-DP015:001, UPCMLD-DP015:002, CHEBI:94704, CTK4B0663, KBio2_000536, KBio2_003104, KBio2_005672, KBio3_000971, KBio3_000972, DTXSID80152117, MolPort-009-019-541, Bio2_000438, Bio2_000918, HMS1362L17, HMS1792L17, HMS1990L17, HMS3403L17, HMS3648K20, BCP29141, ZINC2560269, HSCI1_000134, CCG-100630, CS-8032, IDI1_002193, NCGC00016062-01, NCGC00016062-02, NCGC00016062-03, NCGC00016062-04, NCGC00016062-05, NCGC00016062-06, NCGC00016062-07, NCGC00094508-01, NCGC00094508-03, NCGC00094508-04, NCGC00094508-05, NCGC00094508-06, NCGC00094508-07, ACM118409624, benzylidenemalononitrile (BMN) deriv. 10, HY-108330, LS-172382, RT-011205, EU-0101272, 2-(3-hydroxy-4-nitrobenzylidene)malononitrile, T 9177, J-003748, SR-01000076182-1, SR-01000076182-4, BRD-K67506692-001-03-8, BRD-K67506692-001-04-6, Propanedinitrile, 2-[(3-hydroxy-4-nitrophenyl)methylene]-


ID: 527

chemical graph of compound 527



InChIKey: DURULFYMVIFBIR-UHFFFAOYSA-N
SMILES: CC(C)NCC(COC1=CC=C(C=C1)NC(=O)C)O

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 4883
synonyms found at PubChem are:
practolol, 6673-35-4, Dalzic, Eraldin, Teranol, Practololum, Praktololu, Practololo [DCIT], Praktololu [Polish], Practololo, dl-Practolol, rac Practolol, ICI 50172, Eralzdin Practolol, Practololum [INN-Latin], AY 21011, 1-(4-Acetamidophenoxy)-3-isopropylamino-2-propanol, ICI-50172, Practolol [USAN:BAN:INN], (+-)-Practolol, CCRIS 1089, N-{4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}acetamide, (+/-)-Practolol, 4'-(2-Hydroxy-3-(isopropylamino)propoxy)acetanilide, N-(4-(2-Hydroxy-3-((1-methylethyl)amino)propoxy)phenyl)acetamide, N-[4-[2-HYDROXY-3-[(1-METHYLETHYL)AMINO]PROPOXY]PHENYL]ACETAMIDE, EINECS 229-712-1, CHEMBL6995, N-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]acetamide, CHEBI:258351, N-(4-{2-hydroxy-3-[(propan-2-yl)amino]propoxy}phenyl)acetamide, Acetamide, N-(4-(2-hydroxy-3-((1-methylethyl)amino)propoxy)phenyl)-, NCGC00024810-02, AY-21011, N-{4-[2-hydroxy-3-(isopropylamino)propoxy]phenyl}acetamide, Acetamide,N-[4-[2-hydroxy-3-[(1-methylethyl)amino]propoxy]phenyl]-, DSSTox_CID_1179, N-[4-({2-hydroxy-3-[(1-methylethyl)amino]propyl}oxy)phenyl]acetamide, DSSTox_RID_75993, DSSTox_GSID_21179, 4'-[2-Hydroxy-3-(Isopropylamino)propoxy]acetanilide, Acetanilide, 4'-(2-hydroxy-3-(isopropylamino)propoxy)-, Acetanilide, 4'-[2-hydroxy-3-(isopropylamino)propoxy]-, N-(4-(2-hydroxy-3-(isopropylamino)propoxy)phenyl)acetamide, Prestwick_742, Acetamide, N-[4-[2-hydroxy-3-[(1-methylethyl)amino]propoxy]phenyl]-, Spectrum_001454, AC1Q1QBZ, SR-01000597449, Practalol, Practolol [USAN:INN:BAN], Racemic Practolol, Cordialina (TN), Eraldina (TN), Practolol,(+), Practolol,(-), Cardiol (TN), CAS-6673-35-4, Eraldin (TN), Practolol (USAN), Praktol (TN), Teranol (TN), Dalzic (TN), Pralon (TN), Prestwick0_000332, Prestwick1_000332, Prestwick2_000332, Prestwick3_000332, Spectrum2_001572, Spectrum4_000859, Spectrum5_001123, D0KD1U, Oprea1_095524, SCHEMBL39925, BSPBio_000363, GTPL555, KBioGR_001497, KBioSS_001934, MLS002153779, DivK1c_000901, SPBio_001504, SPBio_002284, AC1L1J62, BPBio1_000401, DTXSID0021179, Practolol, >=95% (HPLC), BDBM25749, CTK5C5115, HMS502N03, KBio1_000901, KBio2_001934, KBio2_004502, KBio2_007070, DURULFYMVIFBIR-UHFFFAOYSA-N, MolPort-000-182-968, NINDS_000901, HMS1569C05, HMS2089I09, HMS2096C05, HMS2233K23, HMS3374G04, HMS3713C05, Tox21_110928, CCG-39350, STL489279, AKOS002685374, AKOS016054902, Tox21_110928_1, DB01297, MCULE-7992924679, NE25450, ( inverted exclamation markA)-Practolol, IDI1_000901, NCGC00024810-03, NCGC00024810-04, NCGC00024810-07, LS-10763, SMR001233163, I.C.I. 50,172, SBI-0051937.P002, AY-21,011, KB-294694, AB00052459, FT-0673986, Z3381, EN300-72170, C11696, D05587, L000491, SR-01000597449-1, SR-01000597449-2, SR-01000597449-4, 4-[2-Hydroxy-3-(isopropylamino)propoxy]-acetanilide, BRD-A41304429-001-04-9, BRD-A41304429-001-12-2, DL-4'-[2-Hydroxy-3-(isopropylamino)propoxy]acetanilide, Z274728816, N-(4-[2-Hydroxy-3-(isopropylamino)propoxy]phenyl)acetamide #, [3-(4-Acetylamino-phenoxy)-2-hydroxy-propyl]-isopropyl-ammonium, 23313-50-0


ID: 528

chemical graph of compound 528



InChIKey: DUUGKQCEGZLZNO-UHFFFAOYSA-N
SMILES: C1=CC2=C(C=C1O)C(=CN2)CC(=O)O

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 1826
synonyms found at PubChem are:
5-Hydroxyindole-3-acetic acid, 54-16-0, 5-HIAA, 2-(5-hydroxy-1H-indol-3-yl)acetic acid, 5-Hydroxyindoleacetic acid, 5-Hydroxyheteroauxin, (5-Hydroxy-1H-indol-3-yl)acetic acid, 5-Oxyindoleacetic acid, 5-Hydroxy-IAA, 5-Hydroxy-3-indoleacetic acid, 5-Hydroxyindol-3-ylacetic acid, Hydroxyindoleacetic acid, 5-Hydroxy-1H-indole-3-acetic acid, 5-Hydroxyindolacetic acid, 5-Hydroxyindolylacetic acid, 1H-Indole-3-acetic acid, 5-hydroxy-, 1321-73-9, Indole-3-acetic acid, 5-hydroxy-, 5-Hydroxyindoleacetate, UNII-YHC763JY1P, NSC 90432, CCRIS 4423, 1H-Indoleacetic acid, hydroxy-, 5-hydroxy-indole-3-acetic acid, EINECS 200-195-4, BRN 0168797, YHC763JY1P, 5-Hydroxyindol-3-acetic acid, CHEBI:27823, DUUGKQCEGZLZNO-UHFFFAOYSA-N, 5-22-05-00203 (Beilstein Handbook Reference), 2-(5-hydroxyindol-3-yl)acetic acid, INDOLEACETIC ACID, 5-HYDROXY-, H-6200, 5-hydroxyindole acetate, 5-hydroxyindolylaceticacid, 5-Oxyindoleacetate, Hydroxyindoleacetate, HIAA, 5HIAA, ACMC-1BTZR, AC1L1CBR, Lopac-H-8876, CBMicro_013565, 5-Hydroxyindole-3-acetate, bmse000364, D02VPC, 5-Hydroxy-3-indolylacetate, 5-Hydroxyindol-3-ylacetate, AC1Q1HA7, 5-hydroxy-Indole-3-acetate, NCIOpen2_001406, Lopac0_000636, Oprea1_139007, 5-Hydroxyindole-3-aceticAcid, MLS000859593, SCHEMBL138121, CHEMBL395915, 5-Hydroxy-1H-indole-3-acetate, 5-Hydroxyindolyacetic Acid,(S), 5-HYDROXYINDOLE-3acetic acid, 5-hydroxyl indole-3-acetic acid, CTK4B7780, KS-00000VYP, MolPort-002-507-333, (5-hydroxyindol-3-yl)acetic acid, 5-hydroxy-indol-3-yl-acetic acid, HMS2230M10, HMS3261P14, HMS3372G16, ZINC185722, ALBB-006262, BB_NC-01187, NSC90432, ZX-AN058764, Tox21_500636, ANW-31980, BBL012272, MFCD00005639, NSC-90432, SBB003639, STK501256, 1H-Indole-3-aceticacid, 5-hydroxy-, AKOS003382389, CCG-221940, CS-W008253, FCH1114712, HY-W008253, LP00636, MCULE-5193831459, TRA0074741, VI30289, (5-hydroxy-1H-indol-3-yl)-acetic acid, NCGC00015522-01, NCGC00015522-02, NCGC00015522-03, NCGC00015522-04, NCGC00094003-01, NCGC00094003-02, NCGC00261321-01, 2-(5-Hydroxy-1H-indol-3-yl)aceticacid, AJ-17701, AK-57807, CC-21853, DS-15683, EN001070, Indole-3-acetic acid, 5-hydroxy-, 1H-, Indoleacetic acid, 5-hydroxy- (Related), KB-73537, LS-82180, SMR000326665, ST059601, (5-Hydroxy-1H-indol-3-yl)acetic acid #, AX8012895, DB-007055, KB-208728, ST2403989, TR-004414, TX-016059, 4CH-018708, BB 0260171, EU-0100636, FT-0081418, FT-0620472, FT-0679205, X6993, C05635, H 8876, H19318, C-08237, SR-01000075583, I04-5778, I10-0543, J-006135, SR-01000075583-1, 5-Hydroxyindole-3-acetic acid, >=98% (HPLC), crystalline, 74C13742-18FA-4D80-8B54-1B85D9463949, 113303-91-6, 99155-61-0, HID


ID: 529

chemical graph of compound 529



InChIKey: DVGGLGXQSFURLP-VWMSDXGPSA-N
SMILES: C1=CC(=CC=C1/C=C/C(=O)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)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:

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


CID is 5320686
synonyms found at PubChem are:
Tiliroside, 20316-62-5, Trans-Tiliroside, Tribuloside, UNII-15M04TXR9M, 15M04TXR9M, CHEMBL266564, CHEBI:80944, 2-Propenoic acid, 3-(4-hydroxyphenyl)-, 6'-ester with 3-(beta-D-glucopyranosyloxy)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one, 22153-44-2, AC1NSZRJ, D0IB3K, SCHEMBL23597, Tiliroside, analytical standard, MEGxp0_000169, MolPort-001-740-347, 4H-1-Benzopyran-4-one,5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[[6-O-[3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]-b-D-glucopyranosyl]oxy]-, BDBM50241244, ZINC17654711, AKOS015896718, MCULE-6075035042, NCGC00163634-01, LS-123660, W1685, kaempferol 3-O-(6"-O-p-coumaroyl)-glucoside, C17140, Kaempferol-3-O-(6''''-p-coumaroyl)-glucoside, 316T625, A814433, I07-0175, Q-100248, kaempferol-3-beta-D-(6-O-trans-p-coumaroyl)glucopyranoside, Kaempferol-3-O-(6-O-trans-p-coumaroyl)-.beta.-glucopyranoside, kaempferol-3-O-beta-D-(6''-(E)-p-coumaroyl)-glucopyranoside, kaempferol 3-O-(6'''' ''''-O-E-p-coumaroyl)-beta-D-glucopyranoside, (E)-((2R,3S,4S,5R,6S)-6-(5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-3-yloxy)-3,4,5-trihydroxy-tetrahydro-2H-pyran-2-yl)methyl 3-(4-hydroxyphenyl)acrylate, (E)-((2R,3S,4S,5R,6S)-6-(5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-3-yloxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)methyl 3-(4-hydroxyphenyl)acrylate, (E)-3-(4-hydroxyphenyl)-2-propenoic acid [(2R,3S,4S,5R,6S)-6-[[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-1-benzopyran-3-yl]oxy]-3,4,5-trihydroxy-2-oxanyl]methyl ester, [(2R,3S,4S,5R,6S)-6-[2-(4-hydroxyphenyl)-5,7-bis(oxidanyl)-4-oxidanylidene-chromen-3-yl]oxy-3,4,5-tris(oxidanyl)oxan-2-yl]methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate, [(2R,3S,4S,5R,6S)-6-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-chromen-3-yl]oxy-3,4,5-trihydroxy-tetrahydropyran-2-yl]methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate, [(2R,3S,4S,5R,6S)-6-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate, 4H-1-Benzopyran-4-one, 5,7-dihydroxy-2-(4-hydroxyphenyl)-3-[[6-O-[(2E)-3-(4-hydroxyphenyl)-1-oxo-2-propenyl]-.beta.-D-glucopyranosyl]oxy]-, 5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4E-1-benzopyran-3-yl 6-O-[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]-beta-D-glucopyranoside


ID: 530

chemical graph of compound 530



InChIKey: DVZQTPMQQXAHSQ-UHFFFAOYSA-N
SMILES: C1CCN2CC3CC(C2C1)CN4C3CCCC4=O.OCl(=O)(=O)=O

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 5351561
synonyms found at PubChem are:
LUPANINE PERCHLORATE, NSC59268, 14691-01-1, Dodecahydro-7,14-methano-4H,6H-dipyrido(1,2-a:1,2-e)(1,5)diazocin-4-one monoperchlorate, EINECS 238-733-5, CHEMBL1979081, CHEMBL3186825, CTK4C5164, NSC95094, NSC-59268, NSC-95094, AKOS030255103, Dodecahydro-7,14-methano-4H,6H-dipyrido(1,2-a:1',2'-e)(1,5)diazocin-4-one monoperchlorate, NCGC00095701-01, MolPort-000-757-301, AKOS024384307, MCULE-3593851047, ST51034517


ID: 531

chemical graph of compound 531



InChIKey: DWFIBKRMQRGBJH-UHFFFAOYSA-N
SMILES: C(C([HH0])=O)1C(CCC=C)=NN(C2=CC=CC=C2)C=1OC

biological descriptors:

CFTR relevance: effective CFTR activator

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

reference list:

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


CID is 100967242
synonyms found at PubChem are:
1-Phenyl-3-(3-butenyl)-5-methoxy-1H-pyrazole-4-carbaldehyde


ID: 532

chemical graph of compound 532



InChIKey: DWOIUCRHVWIHAH-UHFFFAOYSA-N
SMILES: CCC1(CC2=CC=CC=C2O1)C3=NCCN3.Cl

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 11957548
synonyms found at PubChem are:
Efaroxan hydrochloride, 89197-00-2, RX 821037A, 2-Ethyl-2-(imidazolin-2-yl)-2,3-dihydrobenzofuran hydrochloride, 2-(2-ethyl-2,3-dihydro-2-benzofuranyl)-4,5-dihydro-1H-imidazolehydrochloride, 2-(2-ETHYL-2,3-DIHYDROBENZOFURAN-2-YL)-4,5-DIHYDRO-1H-IMIDAZOLE HCL, SR-01000075857, Efaroxan HCl, EU-0100521, MLS002153473, SPECTRUM2300218, CHEMBL539313, SCHEMBL1320556, CTK8F9416, DTXSID00474686, MolPort-003-941-265, Pharmakon1600-02300218, Tox21_500521, BN0204, MFCD00069270, NSC759562, AKOS022488640, CCG-214022, LP00521, NSC-759562, Efaroxan hydrochloride, >=98% (HPLC), NCGC00093915-01, NCGC00093915-02, NCGC00093915-03, NCGC00261206-01, AS-53724, SMR001230826, FT-0732645, E 3263, C-54152, SR-01000075857-1, SR-01000075857-3, SR-01000075857-6, 2-(2-Ethyl-2,3-dihydro-2-benzofuranyl)-4,5-dihydro-1H-imidazole hydrochloride, 2-(2-Ethyl-2,3-dihydrobenzofuran-2-yl)-4,5-dihydro-1H-imidazole hydrochloride


ID: 533

chemical graph of compound 533



InChIKey: DWSGTFTVBLXELC-MOTQWOLNSA-N
SMILES: CN1[C@@H]2CC[C@H]1CC(C2)OC(=O)C(C3=CC=CC=C3)O.Br

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 6419941
synonyms found at PubChem are:
51-56-9, homatropine bromide, HOMATROPINE HYDROBROMIDE, Homatropine (Bromide), Homatropine hydrobromide (R,S), Isopto Homatropine, (1R,3r,5S)-8-Methyl-8-azabicyclo[3.2.1]octan-3-yl 2-hydroxy-2-phenylacetate hydrobromide, Homatropini bromidum, Homatropini hydrobromidum, Homatropinum hydrobromicum, (+-)-Homatropine bromide, Homatropine dl- hydrobromide, DSSTox_CID_25099, DSSTox_RID_80669, DSSTox_GSID_45099, Homatropine (bromhydrate d'), EINECS 200-105-3, [(1R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] 2-hydroxy-2-phenylacetate hydrobromide, NCGC00179630-03, 1alphaH,5alphaH-Tropan-3alpha-ol mandelate (ester) hydrobromide, Homatropine HBr, Benzeneacetic acid, alpha-hydroxy-, 8-methyl-8-azabicyclo(3.2.1)oct-3-yl ester, HBr, endo-(+-), Prestwick_261, Homatropine hydrobromide [USP:JAN], Homatropine(Bromide), AC1O4WGN, CAS-51-56-9, NCGC00016230-01, rac Homatropine Hydrobromide, SCHEMBL41950, MLS002154189, hydrobromide salt of homatropine, 1-alpha-H,5-alpha-H-Tropan-3-alpha-ol, mandelate (ester), hydrobromide, CHEMBL1319362, DTXSID5045099, HY-B0547A, MolPort-006-110-080, HMS1568M05, Benzeneacetic acid, alpha-hydroxy-, (3-endo)-8-methyl-8-azabicyclo(3.2.1)oct-3-yl ester, hydrobromide, Benzeneacetic acid, alpha-hydroxy-, 8-methyl-8-azabicyclo(3.2.1)oct-3-yl ester, hydrobromide, endo-(+-)-, KS-00001F7O, Tox21_110034, Tox21_110318, s4025, Homatropine hydrobromide (JP17/USP), AKOS025117351, Tox21_110318_1, CCG-220062, CS-2649, NCGC00013718-01, AK-88682, SMR001233480, KB-277832, ST2402114, D01004, Benzeneacetic acid, alpha-hydroxy-, (3-endo)-8-methyl-8-azabicyclo(3.2.1)oct-3-yl ester, hydrobromide (1:1), SCHEMBL14672464, I06-1257


ID: 534

chemical graph of compound 534



InChIKey: DWTTZBARDOXEAM-JSGCOSHPSA-N
SMILES: C[C@H]1CCC[C@H](CCCCCC2=CC(=CC(=C2C(=O)O1)O)O)O

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 65434
synonyms found at PubChem are:
beta-Zearalanol, Taleranol, 42422-68-4, beta zearalanol, UNII-HUN219N434, CHEMBL491510, CHEBI:35071, P 1560, HUN219N434, P-1560, (3S,7S)-3,4,5,6,7,8,9,10,11,12-Decahydro-7,14,16-trihydroxy-3-methyl-1H-2-benzoxacyclotetradecin-1-one, (3S,7S)-7,14,16-trihydroxy-3-methyl-3,4,5,6,7,8,9,10,11,12-decahydro-1H-2-benzoxacyclotetradecin-1-one, Taleranolum, Taleranol [USAN:INN], Taleranolum [INN-Latin], Taleranol (USAN/INN), BIDD:ER0109, SCHEMBL343276, 2,4-Dihydroxy-6-(6|A,10-dihydroxyundecyl]benzoic acid |I-lactone, DTXSID3022532, DWTTZBARDOXEAM-JSGCOSHPSA-N, MolPort-002-941-952, beta-Zearalanol, ~98% (HPLC), AC1L2391, ZINC3831617, (6S,10S)-6-(6,10-Dihydroxyundecyl)-beta-resorcyclic acid mu-lactone, BDBM50250268, MFCD00151077, STK078170, AKOS001582522, CCG-208500, MCULE-3886817675, FT-0639791, C14753, D05992, AB01329960-02, 2,4-Dihydroxy-6-(6beta,10-dihydroxyundecyl]benzoic acid mu-lactone, beta-Zearalanol solution, 10 mug/mL in acetonitrile, analytical standard, (3S,7S)-7,14,16-trihydroxy-3-methyl-3,4,5,6,7,8,9,10,11,12-decahydro-1H-benzo[c][1]oxacyclotetradecin-1-one, (7S,11S)-7,15,17-trihydroxy-11-methyl-12-oxabicyclo[12.4.0]octadeca-1(14),15,17-trien-13-one, 1H-2-Benzoxacyclotetradecin-1-one, 3,4,5,6,7,8,9,10,11,12-decahydro-7,14,16-trihydroxy-3-methyl-, (3S,7S)-, 1H-2-Benzoxacyclotetradecin-1-one, 3,4,5,6,7,8,9,10,11,12-decahydro-7,14,16-trihydroxy-3-methyl-, (3S-(3R*,7R*))


ID: 535

chemical graph of compound 535



InChIKey: DXDRHHKMWQZJHT-FPYGCLRLSA-N
SMILES: C1=CC(=CC=C1/C=C/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:

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


CID is 638278
synonyms found at PubChem are:
isoliquiritigenin, 961-29-5, 2',4,4'-Trihydroxychalcone, 4,2',4'-Trihydroxychalcone, 6'-deoxychalcone, (E)-1-(2,4-dihydroxyphenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one, 2',4',4-Trihydroxychalcone, isoliquirtigenin, UNII-B9CTI9GB8F, GU 17, GU-17, CCRIS 7676, Chalcone, 2',4,4'-trihydroxy-, C15H12O4, EINECS 237-316-5, B9CTI9GB8F, 42'4'-trihydroxychalcone, 1-(2,4-Dihydroxyphenyl)-3-(4-hydroxyphenyl)-2-propen-1-one, BRN 1914295, Acrylophenone, 2',4'-dihydroxy-3-(p-hydroxyphenyl)-, CHEMBL129795, CHEBI:310312, DXDRHHKMWQZJHT-FPYGCLRLSA-N, (2E)-1-(2,4-dihydroxyphenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one, (E)-1-(2,4-Dihydroxyphenyl)-3-(4-hydroxyphenyl)-2-propen-1-one, 2-PROPEN-1-ONE, 1-(2,4-DIHYDROXYPHENYL)-3-(4-HYDROXYPHENYL)-, 2-Propen-1-one, 1-(2,4-dihydroxyphenyl)-3-(4-hydroxyphenyl)-, (2E)-, (2E)-1-(2,4-Dihydroxyphenyl)-3-(4-hydroxyphenyl)-2-propen-1-one, 2-Propen-1-one, 1-(2,4-dihydroxyphenyl)-3-(4-hydroxyphenyl)-, (E)-, 13745-20-5, Q-100904, (E)-1-(2,4-Dihydroxy-phenyl)-3-(4-hydroxy-phenyl)-propenone, SMR000112969, 1-(2,4-Dihydroxyphenyl)-3-(4-hydroxyphenyl)prop-2-en-1-one, SR-01000075499, iso-Liquiritigenin, Isoliquiritigenin/, ILTG, ISLQ, PubChem21917, Isoliquiritigenin, powder, Spectrum5_000612, AC1LCW23, Lopac0_000681, BSPBio_003411, 1-08-00-00707 (Beilstein Handbook Reference), MLS000438943, MLS002207240, MLS006010045, BIDD:ER0235, SCHEMBL161168, SPECTRUM1504200, BIFK0057, cid_638278, GU17, MEGxp0_001326, 2',4,4'-Trihydroxy-Chalcone, DTXSID2022466, 2'',4'',4-trihydroxychalcone, 2'',4,4''-trihydroxychalcone, ACon1_000047, CHEBI:94010, MolPort-001-741-660, BCPP000201, HMS2233H18, HMS3262I03, trans-2',4,4'-trihydroxychalcone, 2,4''-dihydroxy-4-hydroxychalcone, BCP02312, HY-N0102, ZINC3869608, Tox21_500681, ABP000708, BDBM50042944, CCG-40334, CI-098, CI0036, CMLD3_000056, GP4188, LMPK12120096, MFCD00075907, s2404, SBB066136, 2',4,4'-Trihydroxychalcone, 97%, Isoliquiritigenin, analytical standard, AKOS001590146, BCP9000795, CS-1745, DB03285, KS-5256, LP00681, MCULE-1557671934, SDCCGMLS-0066751.P001, NCGC00090504-01, NCGC00090504-02, NCGC00090504-03, NCGC00090504-04, NCGC00090504-05, NCGC00090504-06, NCGC00090504-07, NCGC00090504-08, NCGC00261366-01, AJ-46320, AK160201, AN-48170, CC-29647, KB-52784, LS-52925, O271, ST081356, AB0000350, AX8035519, LS-123872, EU-0100681, I0822, N1288, ST24047435, C08650, I 3766, M-1539, 961I295, A845551, NCGC00090504-04!2',4,4'-Trihydroxychalcone, 2',4'-Dihydroxy-3-(p-hydroxyphenyl)-Acrylophenone, I06-0544, SR-01000075499-1, SR-01000075499-5, BRD-K33583600-001-03-9, BRD-K33583600-001-04-7, 1-(2,4-Dihydroxy-phenyl)-3-(4-hydroxy-phenyl)-propenone, 1-(2,4-Dihydroxyphenyl)-3-(4-hydroxyphenyl)-prop-2-en-1-one, (E)-1-(2,4-dihydroxyphenyl)-3-(4-hydroxyphenyl)-2-propene-1-one, (E)-1-[2,4-bis(oxidanyl)phenyl]-3-(4-hydroxyphenyl)prop-2-en-1-one, 2-Propen-1-one,1-(2,4-dihydroxyphenyl)-3-(4-hydroxyphenyl)-, (2E)-, 4,2 inverted exclamation marka,4 inverted exclamation marka-Trihydroxychalcone, 1060-19-1, InChI=1/C15H12O4/c16-11-4-1-10(2-5-11)3-8-14(18)13-7-6-12(17)9-15(13)19/h1-9,16-17,19H/b8-3


ID: 536

chemical graph of compound 536



InChIKey: DXGLGDHPHMLXJC-UHFFFAOYSA-N
SMILES: COC1=CC(=C(C=C1)C(=O)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:

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


CID is 4632
synonyms found at PubChem are:
oxybenzone, 131-57-7, 2-HYDROXY-4-METHOXYBENZOPHENONE, Benzophenone-3, Oxybenzon, 4-Methoxy-2-hydroxybenzophenone, 2-Benzoyl-5-methoxyphenol, Oxibenzona, Oxybenzonum, (2-hydroxy-4-methoxyphenyl)(phenyl)methanone, Anuvex, Methanone, (2-hydroxy-4-methoxyphenyl)phenyl-, Chimassorb 90, Uvinul 9, Advastab 45, Cyasorb UV 9, Sunscreen UV-15, Syntase 62, Uvistat 24, Usaf cy-9, Escalol 567, Spectra-sorb UV 9, Ongrostab HMB, Oxybenzonum [INN-Latin], Uvinul M40, Oxibenzona [INN-Spanish], Oxibenzonum, HMBP, Cyasorb UV 9 Light Absorber, (2-Hydroxy-4-methoxyphenyl)phenylmethanone, UF 3, UV 9, NSC-7778, Benzophenone, 2-hydroxy-4-methoxy-, DuraScreen, NCI-C60957, UNII-95OOS7VE0Y, CCRIS 1078, Uvinul M 40, CHEBI:34283, 2-hydroxy-4-methoxy benzophenone, HSDB 4503, NSC 7778, EINECS 205-031-5, BRN 1913145, 95OOS7VE0Y, CHEMBL1625, AI3-23644, (2-hydroxy-4-methoxyphenyl)-phenylmethanone, MOB, (2-hydroxy-4-methoxy-phenyl)-phenyl-methanone, NSC7778, DXGLGDHPHMLXJC-UHFFFAOYSA-N, NCGC00016394-07, CAS-131-57-7, 4-Methoxy-2-hydroxybenzophenone butyric acid, DSSTox_CID_2405, DSSTox_RID_76576, DSSTox_GSID_22405, 2-HYDROXY-4-METHOXYBENZOPHENONE (OXYBENZONE), 2-hydroxy-4-methoxyphenyl phenyl ketone, SMR000035344, SR-01000610567, Oxybenzone [USAN:USP:INN], Benzophenone 3, Neo heliopan BB, Kopben-3, PubChem3274, Solaquin (Salt/Mix), Spectrum_001049, DuraScreen (Salt/Mix), ACMC-1BVPH, KAHSCREEN BZ-3, AC1L1ILP, Prestwick0_000887, Prestwick1_000887, Prestwick2_000887, Prestwick3_000887, Spectrum2_001008, Spectrum3_000538, Spectrum4_000463, Spectrum5_001337, Benzophenone-3 (Bp-3), PreSun 15 (Salt/Mix), D02CWR, Epitope ID:131795, WLN: 1OR CQ DVR, EC 205-031-5, Oprea1_174131, SCHEMBL15551, BSPBio_000674, BSPBio_002155, KBioGR_000906, KBioSS_001529, KSC174M0J, MLS000039797, MLS001055487, BIDD:ER0353, DivK1c_000184, SPECTRUM1500451, SPBio_001135, SPBio_002893, Oxybenzone, analytical standard, BPBio1_000742, DTXSID3022405, CTK0H4604, HMS500J06, KBio1_000184, KBio2_001529, KBio2_004097, KBio2_006665, KBio3_001655, MolPort-001-760-048, NINDS_000184, HMS1570B16, HMS1920D16, HMS2091L16, HMS2097B16, HMS2424P09, HMS3714B16, Pharmakon1600-01500451, ZINC136138, ALBB-021277, BCP25880, HY-A0067, Tox21_110418, Tox21_201985, Tox21_302852, ANW-19363, BBL003220, BDBM50253134, CCG-40226, component of Presun 23 (Salt/Mix), component of Presun 29 (Salt/Mix), component of Presun 30 (Salt/Mix), LS-742, MFCD00008387, NSC757260, s4691, SBB056669, STK057962, AKOS000120532, Tox21_110418_1, 2-Hydroxy-4-methoxybenzophenone, 98%, CS-3186, DB01428, MCULE-2222013605, NSC-757260, RL01485, RTR-004325, TRA0043295, IDI1_000184, NCGC00016394-01, NCGC00016394-02, NCGC00016394-03, NCGC00016394-04, NCGC00016394-05, NCGC00016394-06, NCGC00016394-08, NCGC00016394-10, NCGC00065306-03, NCGC00065306-04, NCGC00065306-05, NCGC00065306-06, NCGC00256323-01, NCGC00259534-01, AC-11987, AJ-12292, AN-23061, AS-13616, CJ-01030, I956, ST029243, ZB004802, SBI-0051470.P003, KB-173071, KB-193020, ST2407894, TR-004325, AB00052063, FT-0612546, H2437, 2-Hydroxy-4-methoxybenzophenone, 98% 50g, (2-hydroxy-4-methoxyphenyl)(phenyl) methanone, C14285, D05309, AB00052063_13, AE-848/01549044, I01-3099, Q-200287, SR-01000610567-2, SR-01000610567-4, BRD-K59037100-001-05-5, BRD-K59037100-001-09-7, component of Caraloe snow & sun lip balm (Salt/Mix), Z1945708085, Oxybenzone, United States Pharmacopeia (USP) Reference Standard, 2-Hydroxy-4-methoxybenzophenone, certified reference material, TraceCERT(R), Oxybenzone, Pharmaceutical Secondary Standard; Certified Reference Material, 1-(cyclopropylcarbonyl)-N-(4-ethoxyphenyl)-3,3-dimethylindoline-5-sulfonamide, 2-Hydroxy-4-methoxybenzophenone (Neo Heliopan BB) 10 microg/mL in Cyclohexane, 138464-23-0, 14375-37-2, 153859-73-5, 58392-15-7, 58392-22-6, 897050-18-9, InChI=1/C14H12O3/c1-17-11-7-8-12(13(15)9-11)14(16)10-5-3-2-4-6-10/h2-9,15H,1H


ID: 537

chemical graph of compound 537



InChIKey: DXVJRTIPBNBLLB-BJMVGYQFSA-N
SMILES: C1=CC(=CC=C1/C=C(\C#N)/C(=C(C#N)C#N)N)O

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 5328804
synonyms found at PubChem are:
Tyrphostin AG 112, Tyrphostin A48, AG 112, ag112, AG-112, 2-Amino-4-(4′-hydroxyphenyl)-1,1,3-tricyanobuta-1,3-diene, Tyrphostin-48, Tyrphostin Ag-112, AC1NS5DP, Lopac-T-6943, D02KVB, Lopac0_001140, CHEMBL76589, GTPL5913, SCHEMBL10144540, CHEBI:93930, HMS3229M17, HMS3263D21, 144978-82-5, Tox21_501140, HSCI1_000156, ZINC15977019, CCG-205214, LP01140, NCGC00016041-01, NCGC00016041-02, NCGC00016041-03, NCGC00016041-04, NCGC00094406-01, NCGC00094406-02, NCGC00261825-01, EU-0101140, T 6943, SR-01000076168, J-008034, SR-01000076168-1, BRD-K01192156-001-01-9, 2-amino-4-(4'-hydroxyphenyl)-1,1,3-tricyanobuta-1,3-diene, 3-Amino-2,4-dicyano-5-(4'-hydroxyphenyl)-penta-2,4-dienonitrile, (3Z)-2-Amino-4-(4-hydroxyphenyl)-1,3-butadiene-1,1,3-tricarbonitrile, (3Z)-2-amino-4-(4-hydroxyphenyl)buta-1,3-diene-1,1,3-tricarbonitrile, 3-Amino-2,4-dicyano-5-(4 inverted exclamation marka-hydroxyphenyl)penta-2,4-dienonitrile


ID: 538

chemical graph of compound 538



InChIKey: DYAYBCFQSRNPME-UHFFFAOYSA-N
SMILES: C(C1=CC=C([NH0+]([OH0-])=O)S1)1C(C(=O)OC)=C(C)NC(C)=C1C(=O)OC

biological descriptors:

CFTR relevance: CFTR activator

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

reference list:

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


CID is 15225370
synonyms found at PubChem are:
CHEMBL594332, SCHEMBL11686041


ID: 539

chemical graph of compound 539



InChIKey: DYDCUQKUCUHJBH-UWTATZPHSA-N
SMILES: C1[C@H](C(=O)NO1)N

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 6234
synonyms found at PubChem are:
D-cycloserine, cycloserine, 68-41-7, Seromycin, orientomycin, Oxamycin, Cyclorin, Cyclo-D-serine, Cicloserina, Farmiserina, Miroseryn, Tisomycin, Wasserina, Closina, D-4-amino-3-isoxazolidinone, (R)-4-AMINOISOXAZOLIDIN-3-ONE, alpha-Cycloserine, (+)-4-Amino-3-isoxazolidinone, Cycloserinum, Miroserina, D-4-amino-3-isoxazolidone, Oxamicina, PA 94, (+)-Cycloserine, (4R)-4-amino-1,2-oxazolidin-3-one, Oxamicina [Italian], Cycloserin, Micoserina, (4R)-4-aminoisoxazolidin-3-one, Cicloserina [Italian], PA-94, Tebemicina, Novoserin, D-Oxamycin, D-CS, Cycloserinum [INN-Latin], E-733-A, Cicloserina [INN-Spanish], (R)-4-AMINO-ISOXAZOLIDIN-3-ONE, D-4-Amino-3-isossazolidone, D-(+)-Cycloserine, RO-1-9213, 3-Isoxazolidinone, 4-amino-, (R)-, Closerin, HSDB 3218, D-Oxamicina, 3-Isoxazolidinone, 4-amino-, d-, (R)-Cycloserine, K-300, Seromycin (TN), UNII-95IK5KI84Z, R-4-Amino-3-isoxazolidinone, Cycloserine [INN:BAN:JAN], I-1431, 3-Isoxazolidinone, 4-amino-, (+)-, D-4-Amino-3-isossazolidone [Italian], NSC 154851, 3-Isoxazolidinone, 4-amino-, (4R)-, R-(+)-Cycloserine, (R)-4-Amino-3-isoxazolidinone, CHEBI:40009, AI3-50153, (4R)-4-Amino-3-isoxazolidinone, D-Cycloserine, synthetic, DRG-0195, (R)-(+)-Cycloserine, EINECS 200-688-4, D-amino-3-isoxazolidinone, CHEMBL771, BRN 0080798, SC-49088, (R)-4-Amino-3-isoxazolidone, 95IK5KI84Z, 3-Isoxazolidinone, 4-amino-, D, DYDCUQKUCUHJBH-UWTATZPHSA-N, R(+)-4-Amino-3-isoxazolidinone, 3-Isoxazolidinone, 4-amino-, (R), (R)-(+)-4-Amino-3-isoxazolidinone, CAS-68-41-7, NCGC00016306-01, DSSTox_CID_2870, 3-Isoxazolidinone, 4-amino-, (+)- (8CI), 3-Isoxazolidinone, 4-amino-, (4R)- (9CI), C 3909, C-9390, C-9400, DSSTox_RID_76766, DSSTox_GSID_22870, FA6C7F8B-D080-4EA3-978F-1ECFB5A29D09, Cycloserine (JP15/USP/INN), Cycloserine, D-, .alpha.-Cycloserine, 4AX, CPD000058313, SMR000058313, (S)-(-)-Cycloserine, 3-Isoxazolidinone, 4-amino-, (+)-(8CI), 3-isoxazolidinone, 4-amino-, (4r)-(9ci), 4-Amino-isoxazolidin-3-one, SR-01000075432, D-Cycloserine synth. BP 88, Serine, cyclo-, Cycloserine [USP:INN:BAN:JAN], PubChem5763, D-Cycloserine, powder, Spectrum_000860, 1pb9, CYCLOSERINE (D), Prestwick0_001089, Prestwick1_001089, Prestwick2_001089, Prestwick3_001089, Spectrum2_000084, Spectrum3_000371, Spectrum4_000305, Spectrum5_000797, Lopac-C-1159, Lopac-C-3909, Lopac-C-7005, D02WFK, D04TMQ, D0G6RT, AC1Q4UA7, Lopac0_000252, SCHEMBL34322, BSPBio_001138, BSPBio_002121, KBioGR_000890, KBioSS_001340, 4-27-00-05549 (Beilstein Handbook Reference), MLS000758215, MLS001423962, MLS002548887, BIDD:GT0707, DivK1c_000098, SPECTRUM1500215, SPBio_000008, SPBio_003029, AC1L1M33, BPBio1_001252, GTPL9489, Cycloserine (JP17/USP/INN), 4-Amino-3-isoxazolidinone, D-, DTXSID8022870, HMS500E20, KBio1_000098, KBio2_001340, KBio2_003908, KBio2_006476, KBio3_001341, MolPort-000-858-643, NINDS_000098, HMS1571I20, HMS1920C06, HMS2051C15, HMS2091I14, HMS2098I20, HMS2232F03, HMS3259L19, HMS3260D06, HMS3715I14, NJ-21, Pharmakon1600-01500215, R (+)-4-amino-3-isoxazolidinone, (R)-3-Isoxazolidinone, 4-amino-, 4-Amino-3-isoxazolidinone, (R)-, ACT04767, HY-B0030, KS-00001FB7, Tox21_110361, Tox21_500252, BDBM50038178, BDBM50103516, CCG-39705, D-Cycloserine, >=96.0% (NT), FC1270, LMPK14000007, MFCD00005353, NSC756712, s1998, ZINC34676245, (R)-4-amino-1,2-oxazolidin-3-one, 4-Isoxazolidinamine, 3-oxo-, (D)-, AKOS015994626, Tox21_110361_1, AC-4721, CS-2395, DB00260, HS-0079, LP00252, MCULE-4212827696, NC00050, NC00676, NSC-756712, RL04615, IDI1_000098, SMP1_000167, NCGC00015213-01, NCGC00015213-02, NCGC00015213-03, NCGC00016306-02, NCGC00016306-03, NCGC00016306-04, NCGC00016306-05, NCGC00016306-07, NCGC00016306-08, NCGC00093713-01, NCGC00093713-02, NCGC00260937-01, AJ-89953, AN-11678, BR-26256, CAS-339-72-0, K138, KB-49618, LS-86757, SAM001247014, SAM002264599, SC-06256, ST075697, SBI-0050240.P004, AB0007232, AB2000415, ST2408171, AB00443920, EU-0100252, FT-0624464, (4R)-4-amino-2,4,5-trihydroisoxazol-3-one, C08057, D00877, AB00443920_09, AB00443920_10, 005C353, 101039-EP2295402A2, 101039-EP2301544A1, SR-01000759389, SR-01000075432-1, SR-01000075432-2, SR-01000075432-5, SR-01000075432-9, SR-01000759389-4, SR-01000075432-10, F2173-1228, Z1522567171, Cycloserine, United States Pharmacopeia (USP) Reference Standard, Cycloserine, Pharmaceutical Secondary Standard; Certified Reference Material, cycloserine zwitterion, D-cycloserine zwitterion, alpha-cycloserine zwitterion, CHEBI:74159, D-4-amino-3-isoxazolidinone zwitterion, CJ-18543, (+)-4-amino-3-isoxazolidinone zwitterion, (4R)-4-aminoisoxazolidin-3-one zwitterion, (4R)-4-ammonio-4,5-dihydroisoxazol-3-olate, (4R)-4-ammonio-3-oxo-1,2-oxazolidin-2-ide, A836140, (4R)-4-azaniumyl-4,5-dihydro-1,2-oxazol-3-olate


ID: 540

chemical graph of compound 540



InChIKey: DYEFUKCXAQOFHX-UHFFFAOYSA-N
SMILES: C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3[Se]2

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 3194
synonyms found at PubChem are:
ebselen, 60940-34-3, 2-Phenyl-1,2-benzisoselenazol-3(2H)-one, Ebselene, Ebseleno, Ebselenum, 2-phenyl-1,2-benzoselenazol-3-one, Ebselene [French], Ebselenum [Latin], Ebselen [INN], Ebseleno [Spanish], PZ 51, 2-phenylbenzo[d][1,2]selenazol-3(2H)-one, Harmokisane, SPI-1005, C13H9NOSe, MLS000028488, UNII-40X2P7DPGH, PZ-51, CCRIS 3714, PZ51, DR-3305, 2-Phenyl-1,2-benzisoselenazolin-3-one, SMR000058445, 2-phenyl-1,2-benzoisoselenazol-3(2H)-one, 1,2-Benzisoselenazol-3(2H)-one, 2-phenyl-, CHEMBL51085, NSC 639762, DR 3305, Prestwick_1057, RP 60931, SPI-3005, AC1L1FDW, Prestwick0_000740, Prestwick1_000740, Prestwick2_000740, Prestwick3_000740, Spectrum2_001441, Spectrum3_000799, Spectrum4_000445, Spectrum5_001713, Lopac-E-3520, NSC639762, 40X2P7DPGH, Lopac0_000541, NCGC00015412-06, BSPBio_000700, BSPBio_001342, BSPBio_002538, CPD000058445, KBioGR_000062, KBioGR_000830, KBioSS_000062, DivK1c_000951, SPBio_001301, SPBio_002639, CAS-60940-34-3, MLS001148646, BPBio1_000770, BCBcMAP01_000149, CHEBI:77543, HMS502P13, KBio1_000951, KBio2_000062, KBio2_002630, KBio2_005198, KBio3_000123, KBio3_000124, KBio3_001758, NINDS_000951, DYEFUKCXAQOFHX-UHFFFAOYSA-N, E 3520, Bio2_000062, Bio2_000542, HMS1361D04, HMS1570C22, HMS1791D04, HMS1989D04, HMS2052N09, AC-1124, IDI1_000951, IDI1_033812, QTL1_000035, NCGC00015412-01, NCGC00015412-02, NCGC00015412-03, NCGC00015412-13, NCGC00024072-03, NCGC00024072-04, NCGC00024072-05, NCGC00178610-01, NCGC00178610-02, NCGC00178610-03, 2-phenyl-1,2-benzoselenazol-3(2h)-one, LS-33527, SAM001247071, AB00053217, EU-0100541, MLS-0003066.0001, BRD-K29359156-001-06-1, I09-1611, SR-01000003081, CID3194, Ebselen (C5), nchembio.109-comp1, Opera_ID_1643, Ebselen, cysteine modifier, D0B1FE, cid_3194, DSSTox_CID_25150, DSSTox_RID_80704, C042986, DSSTox_GSID_45150, SCHEMBL33829, MLS001424261, MLS006010108, E3520_SIGMA, DTXSID7045150, BDBM34233, CTK7H1817, CHEBI:175507, MolPort-003-666-383, HMS2097C22, HMS2235A11, HMS3394N09, HMS3402D04, HMS3649O05, HMS3714C22, KUC112559N, Pharmakon1600-01501188, BCP17134, EX-A1447, KS-00000G4G, Tox21_110140, 2-Phenyl-benzo[d]isoselenazol-3-one, BN0569, CCG-39161, DAP001372, DR3305, GP4285, MFCD00210937, NSC757883, AKOS015898841, API0002512, CS-5534, DB12610, LP00541, NC00431, NSC-639762, NSC-757883, TRA0091838, KSC-325-014, NCGC00015412-04, NCGC00015412-05, NCGC00015412-07, NCGC00015412-08, NCGC00015412-09, NCGC00015412-10, NCGC00015412-11, NCGC00015412-12, phenyl-1,2-benzisoselenazol-3(2H)-one, 2-phenyl-1,2-benzisoselazol-3(2H)-one, AK115695, AN-15216, BC224294, HY-13750, SBI-0050524.P003, 2-phenyl-1,2-benzisoselenazole-3(2H)-one, AB0020911, AX8127093, DB-072873, 2-phenyl-1,2-benzoisoselenazole-3(2H)-one, E0946, FT-0759332, V1941, 2-phenyl-1,2-benzoisoselenazole-3-(2H)-one, 2-Phenyl-benzo[d]isoselenazol-3-one(Ebselen), AB00053217_25, 940E343, SR-01000003081-2, SR-01000003081-7, SR-01000003081-8, BRD-K29359156-001-23-6, SR-01000003081-10, SR-01000003081-14


ID: 541

chemical graph of compound 541



InChIKey: DYJVZTAMQYDCLP-VCSAJMHUSA-N
SMILES: CC(C)N1C=C2C[C@@H]3[C@H](C[C@H](CN3C)C(=O)OC(C)C(C)O)C4=C2C1=CC=C4.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:

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


CID is 6437377
synonyms found at PubChem are:
Lilly 53857, LY 53857, LY-53857, LY-53,857 maleate, Ergoline-8-carboxylic acid, 6-methyl-1-(1-methylethyl)-, 2-hydroxy-1-methylpropyl ester, (8beta)-, (Z)-2-butenedioate (1:1) (salt), 60634-51-7, C23H32N2O3.C4H4O4, LY 53,857, SCHEMBL2970215, 6-Methyl-1-(1-methylethyl)-, CHEMBL1399645, NCGC00094069-01, LS-176115, EU-0100721, L-107, SR-01000075553, SR-01000075553-1, ergoline-8beta-carboxylic acid 2-hydroxy-1-methylpropyl ester maleate


ID: 542

chemical graph of compound 542



InChIKey: DYOZWAJOUTVNAF-UHFFFAOYSA-N
SMILES: CNCCC1=CNC2=C1C=C(C=C2)O.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:

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


CID is 260390
synonyms found at PubChem are:
3-(2-Methylaminoethyl)indol-5-ol oxalate, 15558-50-6, 1975-81-1, N-omega-Methylserotonin, N-omega-Methyl-5-hydroxytryptamine oxalate salt, H-7000, Nomega-Methyl-5-hydroxy-trypt-amine oxalate salt, NSC91541, EINECS 239-611-4, 5-hydroxy-nw-methyltryptamine oxalate, AC1Q5RMG, N-Methylserotonin oxalate, MLS000859941, SCHEMBL1320479, CHEMBL1256286, CTK0I2793, N|O-Methylserotonin oxalate salt, DTXSID80293695, HMS2234N19, HMS3262E08, HMS3371J12, Nomega-Methylserotonin oxalate salt, AC1L6327, N-Omega-methylserotonin oxalate salt, Tox21_500743, MFCD00013159, NSC-91541, AKOS024282337, 5-Hydroxy-N|O-methyltryptamine oxalate, ACM1975811, CCG-222047, LP00743, MCULE-1823155663, N-omega-METHYL-5-HYDROXYTRYPTAMINE, NCGC00094085-01, NCGC00261428-01, 5-Hydroxy-Nomega-methyltryptamine oxalate, SMR000326801, ST055634, EU-0100743, FT-0620492, M 1514, N|O-Methyl-5-hydroxy-trypt-amine oxalate salt, 5-Hydroxy-N-omega-methyltryptamine, oxalate salt, 5-Hydroxy-Nomega-methyltryptamine oxalate, 99%, 3-(2-(Methylamino)ethyl)-1H-indol-5-ol oxalate, Nomega'-Methyl-5-hydroxy trypt amine oxalate salt, SR-01000075980, J-012764, SR-01000075980-1, 3-[2-(methylamino)ethyl]indol-5-ol, ethanedioic acid, 3-[2-(methylamino)ethyl]-1H-indol-5-ol; oxalic acid, 1H-Indol-5-ol,3-[2-(methylamino)ethyl]-,ethanedioate(1:1), Nomega-Methyl-5-hydroxy??trypt??amine oxalate salt, >=98% (alkalimetric)


ID: 543

chemical graph of compound 543



InChIKey: DYYZXRCFCVDSKD-UHFFFAOYSA-N
SMILES: CN(C)C1=NC=C2C(=C1)C(=NC=N2)NC3=CC4=C(C=C3)N(N=C4)CC5=CC=CC=C5

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 6603857
synonyms found at PubChem are:
GW2974, 202272-68-2, CHEMBL30432, GW282974X, N4-(1-Benzyl-1H-indazol-5-yl)-N6,N6-dimethyl-pyrido-[3,4-d]-pyrimidine-4,6-diamine, Lopac-G-0668, AC1O7G3B, Lopac0_000509, SCHEMBL1737530, CHEBI:95273, CTK8E8381, DTXSID40424963, DYYZXRCFCVDSKD-UHFFFAOYSA-N, HMS3261F19, HMS3303J07, HMS3305C14, Tox21_500509, BDBM50099963, GW-974, MFCD04974495, ZINC18371391, CCG-204600, LP00509, KS-0000183M, SMP2_000268, SMP2_000301, NCGC00015468-01, NCGC00015468-02, NCGC00015468-03, NCGC00015468-04, NCGC00015468-05, NCGC00015468-06, NCGC00093907-01, NCGC00093907-02, NCGC00261194-01, GW2974, >=98% (HPLC), solid, RT-013147, EU-0100509, G 0668, AB01092265-01, SR-01000075892, J-013131, SR-01000075892-1, 4-N-(1-benzylindazol-5-yl)-6-N,6-N-dimethylpyrido[3,4-d]pyrimidine-4,6-diamine, N*4*-(1-Benzyl-1H-indazol-5-yl)-N*6*,N*6*-dimethyl-pyrido[3,4-d]pyrimidine-4,6-diamine, N4-(1-Benzyl-1H-indazol-5-yl)-N6,N6-dimethyl-pyrido[3,4-d]pyrimidine-4,6-diamine, N4-(1-Benzyl-1H-indazol-5-yl)-N6,N6-dimethyl-pyrido[3,4-d]pyrimidine4-4,6-diamine


ID: 544

chemical graph of compound 544



InChIKey: DZZGIXHAFVXSKV-UHFFFAOYSA-N
SMILES: CC1=C(C=CC(=C1C)S(=O)(=O)N2C=CN=C2C)OC

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:

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


CID is 1094932
synonyms found at PubChem are:
801224-90-8, BAS 09620936, F1696-0184, 1-(4-methoxy-2,3-dimethylphenyl)sulfonyl-2-methylimidazole, 1-((4-methoxy-2,3-dimethylphenyl)sulfonyl)-2-methyl-1H-imidazole, 1-(4-Methoxy-2,3-dimethyl-benzenesulfonyl)-2-methyl-1H-imidazole, AC1LM1YZ, MLS001202930, CHEMBL1360496, DZZGIXHAFVXSKV-UHFFFAOYSA-N, MolPort-002-015-475, HMS2833P13, ZINC816467, AKOS002286101, MCULE-7772630708, SMR000524602, ST50287774, AP-263/42610970, SR-01000367214, SR-01000367214-1, Z57705542, 1-[(4-methoxy-2,3-dimethylphenyl)sulfonyl]-2-methylimidazole, 1-(4-methoxy-2,3-dimethylbenzenesulfonyl)-2-methyl-1H-imidazole, 2,3-dimethyl-4-[(2-methyl-1H-imidazol-1-yl)sulfonyl]phenyl methyl ether


ID: 545

chemical graph of compound 545



InChIKey: FACUYWPMDKTVFU-BYPYZUCNSA-N
SMILES: C1=CN(C(=O)NC1=O)C[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:

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


CID is 440053
synonyms found at PubChem are:
(S)-WILLARDIINE, Willardiine, 21416-43-3, S(-)-Willardiine, 3-(Uracil-1-yl)-L-alanine, (-)-Willardiine, CHEMBL122005, CHEBI:15851, HWD, 3-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-L-alanine, 1mqj, D04SMQ, 3-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)alanine, AC1L98KY, Lopac0_001219, SCHEMBL401191, SCHEMBL13319907, BDBM17661, CTK5H8581, MolPort-003-959-938, ZINC901774, 96108-98-4, 2990AH, AKOS006281897, CCG-205293, CS-3618, DB04129, NCGC00094464-03, HY-12499, EU-0101219, W-105, C03584, (2S)-2-amino-3-(2,4-dioxopyrimidin-1-yl)propanoic acid, (S)-2-Amino-3-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)propanoic acid, 2-amino-3-(2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)propionic acid, S(-)-|A-Amino--3,4-dihydro-2,4-dioxo-1(2H)-pyrimidinepropanoic acid, S(-)-alpha-Amino-3,4-dihydro-2,4-dioxo-1(2H)-pyrimidinepropanoic acid, (2S)-2-amino-3-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)propanoic acid, L-willardiine, CHEBI:57543, 3-(uracil-1-yl)-L-alanine zwitterion, ZB015307, (2S)-2-azaniumyl-3-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)propanoate, (2S)-2-azaniumyl-3-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)propanoate


ID: 546

chemical graph of compound 546



InChIKey: FAEKWTJYAYMJKF-QHCPKHFHSA-N
SMILES: CCOC1=C(C=CC(=C1)CC(=O)N[C@@H](CC(C)C)C2=CC=CC=C2N3CCCCC3)C(=O)O

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 65981
synonyms found at PubChem are:
Repaglinide, 135062-02-1, Prandin, NovoNorm, GlucoNorm, AG-EE 623 ZW, Repaglinidum, Repaglinida, Repaglinidum [INN-Latin], Repaglinida [INN-Spanish], AG-EE 388 ZW, (S)-2-Ethoxy-4-(2-((3-methyl-1-(2-(piperidin-1-yl)phenyl)butyl)amino)-2-oxoethyl)benzoic acid, AGEE-623ZW, Repaglinide [USAN], Actulin, Surepost, Prandin (TN), UNII-668Z8C33LU, AG-EE 388, CHEMBL1272, Repaglinide (JAN/USP/INN), (S)-(+)-2-Ethoxy-4-[N-[1-(2-piperidinophenyl)-3-methyl-1-butyl]aminocarbonylmethyl]benzoic acid, AG-EE-623 ZW, CHEBI:8805, AG-EE-388, SMP-508, 668Z8C33LU, C27H36N2O4, NN-623, (S)-2-ethoxy-4-(2-(3-methyl-1-(2-(piperidin-1-yl)phenyl)butylamino)-2-oxoethyl)benzoic acid, 2-ethoxy-4-[2-[[(1S)-3-methyl-1-(2-piperidin-1-ylphenyl)butyl]amino]-2-oxoethyl]benzoic acid, 2-Ethoxy-4-[2-[[(1S)-3-Methyl-1-[2-(1-Piperidinyl)Phenyl]Butyl]Amino]-2-Oxoethyl]Benzoic Acid, NCGC00016978-01, 111GE012, CAS-135062-02-1, (+)-2-Ethoxy-alpha-(((S)-alpha-isobutyl-o-piperidinobenzyl)carbamoyl)-p-toluic acid, (S)-2-Ethoxy-4-(2-((methyl-1-(2-(1-piperidinyl)phenyl)butyl)amino)-2-oxoethyl)-benzoic acid, 2-ethoxy-4-(2-((3-methyl-1-(2-(1-piperidinyl)phenyl)butyl)amino)-2-oxoethyl)benzoic acid, 2-ethoxy-N-(alpha-(2-methyl-1-propyl)-2-piperidinobenzyl)-4-carbamoylmethylbenzoic acid, (S)-2-ethoxy-4-(2-((3-methyl-1-(2-(1-piperidinyl)-phenyl)butyl)amino)-2-oxoethyl)-benzoic acid, Q-201663, (-)-Repaglinide, Reglin, repa-glinide, 2-ethoxy-4-({[(1S)-3-methyl-1-[2-(piperidin-1-yl)phenyl]butyl]carbamoyl}methyl)benzoic acid, 2-ethoxy-4-(2-{[(1S)-3-methyl-1-(2-piperidin-1-ylphenyl)butyl]amino}-2-oxoethyl)benzoic acid, 2-ethoxy-4-[2-({(1S)-3-methyl-1-[2-(piperidin-1-yl)phenyl]butyl}amino)-2-oxoethyl]benzoic acid, Benzoic acid, 2-ethoxy-4-(2-((3-methyl-1-(2-(1-piperidinyl)phenyl)butyl)amino)-2-oxoethyl)-, (S)-, SMR000466305, repaglinide, (+-)-isomer, enyglid, (S)-Repaglinide, Repaglinide,(S), GlucoNorm (TN), Surepost (TN), (S)-2-Ethoxy-4-[2-[[3-methyl-1-[2-(piperidin-1-yl)phenyl]butyl]amino]-2-oxoethyl]benzoic acid, Repaglinide [USAN:USP:INN:BAN], NovoNorm (TN), (S)-(+)-Repaglinide, AC1Q5TZW, Prestwick0_001046, Prestwick1_001046, Prestwick2_001046, Prestwick3_001046, DSSTox_CID_3552, Prandin;GlucoNorm;NovoNorm, D0N5YA, DSSTox_RID_77078, DSSTox_GSID_23552, SCHEMBL16137, BSPBio_000972, MLS000759407, MLS001076684, MLS001424111, MLS006011560, AG-EE 623ZW, BIDD:GT0338, SPBio_002906, AC1L24D5, BPBio1_001070, GTPL6841, DTXSID3023552, CTK3J7345, Novo Nordisk brand of repaglinide, FAEKWTJYAYMJKF-QHCPKHFHSA-N, MolPort-003-850-140, HMS1571A14, HMS2051N08, HMS2094C07, HMS2098A14, HMS2231M21, HMS3715A14, Pharmakon1600-01506035, Glaxo Wellcome brand of replaginide, BCP04250, KS-00000GU9, ZINC3798537, Novo Nordisk brand 2 of repaglinide, Tox21_110721, AC-726, ANW-63956, BDBM50153520, BG0514, MFCD00906179, NSC759893, s1426, STK629501, AKOS005561792, Repaglinide, >=98% (HPLC), solid, API0004049, BS-1010, CCG-101013, CS-0979, DB00912, MCULE-3611790330, NC00263, NSC-759893, RTC-063882, NCGC00016978-02, NCGC00016978-04, NCGC00016978-05, AJ-45642, AK-59609, AN-15576, BC220160, CC-34234, CPD000466305, HY-15209, I979, LS-38509, SAM001246546, SC-17344, Prandin, GlucoNorm, NovoNorm, Repaglinide, SBI-0206942.P001, AB0013959, AB2000099, AX8145505, TC-063882, AB00514019, AM20090697, FT-0631150, R0179, ST24036034, 62R021, C07670, D00594, W-5210, AB00514019-09, AB00514019_10, AB00514019_11, C-22512, SR-01000759404, SR-01000759404-4, BRD-K82846253-001-03-0, Z1777729210, Repaglinide, European Pharmacopoeia (EP) Reference Standard, Repaglinide, United States Pharmacopeia (USP) Reference Standard, (s)-(+)-2-ethoxy-4-(2-oxo-2-[(alpha-isobutyl-2-piperidinobenzyl)amino]ethyl)-benzoic acid, Repaglinide for system suitability, European Pharmacopoeia (EP) Reference Standard, (S)-2-Ethoxy-4-[N-(1-(2-piperidino-phenyl)-3-methyl-1-butyl)-aminocarbonylmethyl]-benzoic acid, 2-ethoxy-4-[2-[[(1S)-3-methyl-1-[2-(1-piperidyl)phenyl]butyl]amino]-2-oxo-ethyl]benzoic acid, 2-Ethoxy-4-{[(S)-3-methyl-1-(2-piperidin-1-yl-phenyl)-butylcarbamoyl]-methyl}-benzoic acid, Benzoic acid, 2-ethoxy-4-[2-[[(1S)-3-methyl-1-[2-(1-piperidinyl)phenyl]butyl]amino]-2-oxoethyl]-


ID: 547

chemical graph of compound 547



InChIKey: FAKRSMQSSFJEIM-RQJHMYQMSA-N
SMILES: C[C@H](CS)C(=O)N1CCC[C@H]1C(=O)O

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 44093
synonyms found at PubChem are:
captopril, 62571-86-2, Capoten, L-Captopril, Captopryl, Lopirin, Cesplon, Captolane, Tensoprel, Acepress, Captoril, Dilabar, Garranil, Hypertil, Tenosbon, Alopresin, Captoprilum, Acepril, Lopril, Acediur, Aceplus, Isopresol, Tensobon, Apopril, Asisten, Captoprilum [INN-Latin], D-2-Methyl-3-mercaptopropanoyl-L-proline, (2S)-1-[(2S)-2-methyl-3-sulfanylpropanoyl]pyrrolidine-2-carboxylic acid, SQ-14225, Hipertil, Lopirin [Switzerland], D-3-Mercapto-2-methylpropanoyl-L-proline, SQ 14225, (2S)-1-(3-Mercapto-2-methylpropionyl)-L-proline, 1-((2S)-3-Mercapto-2-methylpropionyl)-L-proline, SQ 14,225, SA 333, D-3-Mercapto-2-methylpropionylproline, Captril, Tensiomin, UNII-9G64RSX1XD, 3-Mercapto-2-methylpropionyl-proline, (-)-Captopril, Apopril (TN), Capoten (TN), 1-(3-Mercapto-2-methyl-1-oxopropyl)-L-proline, CHEBI:3380, (S)-1-(3-Mercapto-2-methyl-1-oxopropyl)-L-proline, HSDB 6527, Captopril [USAN:INN:BAN:JAN], Garranil (discontinued), EINECS 263-607-1, 1-[(2S)-2-methyl-3-sulfanylpropanoyl]-L-proline, 9G64RSX1XD, CHEMBL1560, 1-[(2S)-3-Mercapto-2-methyl-1-oxopropyl]-L-proline, C9H15NO3S, MLS000069484, 1-(D-3-Mercapto-2-methyl-1-oxopropyl)-L-proline (S,S), L-Proline, 1-[(2S)-3-mercapto-2-methyl-1-oxopropyl]-, L-Proline, 1-(3-mercapto-2-methyl-1-oxopropyl)-, (S)-, FAKRSMQSSFJEIM-RQJHMYQMSA-N, N-[(S)-3-Mercapto-2-methylpropionyl]-L-proline, [2S]-1-[3-Mercapto-2-methylpropionyl]-L-proline, MFCD00168073, NCGC00023654-04, SMR000059061, SQ-14534, SQ-14,225, SQ-14,534, C 4042, 1-Pyrrolidinecarboxylic acid, 1-(D-3-mercapto-2-methyl-1-propionyl)-, L-(S,S)-, DSSTox_CID_17197, DSSTox_RID_79306, DSSTox_GSID_37197, (S)-1-(3-Mercapto-2-methyl-1-oxo-propyl)-L-proline, L-Proline, 1-((2S)-3-mercapto-2-methyl-1-oxopropyl)-, Novocaptopril, Farcopril, Hypopress, Zapto, Captopril (Capoten), (S)-1-((S)-3-mercapto-2-methylpropanoyl)pyrrolidine-2-carboxylic acid, Capozide (Salt/Mix), X8Z, 1-[(2s)-3-mercapto-2-methylpropionyl]-l-proline, SR-01000075603, component of Captea (Salt/Mix), component of Acezide (Salt/Mix), component of Ecazide (Salt/Mix), S-Captopril, (2S)-1-((2S)-2-methyl-3-sulfanylpropanoyl)pyrrolidine-2-carboxylic acid, Captopril,(S), Prestwick_103, Captopril [USAN:USP:INN:BAN:JAN], SCHEMBL4, Spectrum_000688, Opera_ID_1041, Prestwick3_000019, Spectrum2_001211, Spectrum3_001388, Spectrum4_000811, Spectrum5_001587, Lopac-C-4042, 1-((2S)-2-Methyl-3-sulfanylpropanoyl)-L-proline #, D0I0EG, Epitope ID:114065, UPCMLD-DP003, AC1L2B4L, AC1Q29GZ, (S)-(-)-1-(3-Mercapto-2-methyl-1-oxopropyl)-L-proline, Lopac0_000302, BSPBio_000057, BSPBio_002976, KBioGR_001321, KBioSS_001168, MLS001076488, DivK1c_000208, SPECTRUM1500682, SPBio_001022, Captopril (JP15/USP/INN), Captopril (JP17/USP/INN), AC1Q5R48, BPBio1_000063, GTPL5158, DTXSID1037197, UPCMLD-DP003:001, BDBM21642, HMS500K10, KBio1_000208, KBio2_001168, KBio2_003736, KBio2_006304, KBio3_002196, KS-00000XHT, ZINC57001, 1j37, MolPort-001-794-639, NINDS_000208, HMS1921C12, HMS2089P19, HMS2092I12, HMS2095C19, HMS2233I04, HMS3259G10, HMS3260N06, HMS3712C19, Pharmakon1600-01500682, HY-B0368, MCO, Tox21_110890, Tox21_500302, BBL033600, CCG-39104, EI-213, KM0635, NSC757419, s2051, SBB017523, STK802012, AKOS005622581, Captopril, >=98% (HPLC), powder, Tox21_110890_1, AB04252, BCP9000485, CS-2425, DB01197, KS-5025, LP00302, MCULE-1716939647, NC00554, NSC-757419, SQ14225, SQ14534, IDI1_000208, SMP1_000056, NCGC00015235-01, NCGC00015235-02, NCGC00023654-03, NCGC00023654-05, NCGC00023654-06, NCGC00023654-07, NCGC00023654-08, NCGC00023654-09, NCGC00023654-10, NCGC00023654-11, NCGC00023654-13, NCGC00260987-01, AC-12047, BC203925, CPD000059061, SAM002564201, ST079562, SBI-0050290.P004, AB0007072, AB2000455, Captopril, meets USP testing specifications, LS-137465, EU-0100302, FT-0082749, ((S)-3-mercapto-2-methylpropanoyl)-L-proline, BIM-0050290.0001, C06867, D00251, J10167, 54254-EP2269989A1, 54254-EP2270011A1, 54254-EP2272841A1, 54254-EP2277879A1, 54254-EP2287165A2, 54254-EP2287166A2, 54254-EP2292620A2, 54254-EP2295406A1, 54254-EP2298742A1, 54254-EP2298772A1, 54254-EP2298776A1, 54254-EP2298779A1, 54254-EP2301923A1, 54254-EP2301931A1, 54254-EP2301936A1, 54254-EP2305219A1, 54254-EP2305648A1, 54254-EP2308562A2, 54254-EP2308839A1, AB00052156-16, AB00052156_17, AB00052156_18, 571C862, SR-01000000039, 1-[(2S)-3-Mercapto-2-methylpropionyl]- L-proline, SR-01000000039-2, SR-01000075603-1, SR-01000075603-3, 1-[(S)-3-mercapto-2-methyl-1-oxopropyl]-L-proline, BRD-K54529596-001-04-0, BRD-K54529596-001-15-6, Z2786051697, ([2S]-N-[3-MERCAPTO-2-METHYLPROPIONYL]-L-PROLINE, Captopril, European Pharmacopoeia (EP) Reference Standard, Captopril, United States Pharmacopeia (USP) Reference Standard, (S)-1-((S)-3-Mercapto-2-methyl-propionyl)-pyrrolidine-2-carboxylic acid, Captopril, Pharmaceutical Secondary Standard; Certified Reference Material, L-?Proline, 1-?[(2S)?-?3-?mercapto-?2-?methyl-?1-?oxopropyl]?-, Captopril for system suitability, European Pharmacopoeia (EP) Reference Standard, 138452-88-7, 225661-74-5, 70903-77-4


ID: 548

chemical graph of compound 548



InChIKey: FAOZLTXFLGPHNG-KNAQIMQKSA-N
SMILES: C[C@H]1C[C@H]2[C@@H]3CC[C@@]([C@]3(C[C@@H]([C@@]2([C@@]4(C1=CC(=O)C=C4)C)F)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:

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


CID is 9878
synonyms found at PubChem are:
fluorometholone, 426-13-1, Fluoromethalone, Oxylone, Flumetholon, Fluormetholone, FML Liquifilm, Fluor-Op, Cortilet, Delmeson, Trilcin, FML Forte, Fluorometolona, Fluorometholonum, Fluormetholon, Fluormetholonum, Fluorometolone, Efflumidex, Neo-Oxylone, Fluorometolone [DCIT], FML-S Liquifilm, Fluorometholonum [INN-Latin], Fluorometolona [INN-Spanish], NSC 33001, Fluorometholon, Fluaton, Loticort, Ursnon, component of Neo-Oxylone, UNII-SV0CSG527L, FML, Oxylone (TN), U 8614, Fluor-op (TN), CHEBI:31625, Fluorometholone [INN:BAN:JAN], Fml (TN), EINECS 207-041-5, (6S,8S,9R,10S,11S,13S,14S,17R)-17-acetyl-9-fluoro-11,17-dihydroxy-6,10,13-trimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one, FML S.O.P, SV0CSG527L, 9-Fluoro-11beta,17-dihydroxy-6alpha-methylpregna-1,4-diene-3,20-dione, AI3-52813, MLS000069537, MLS001076157, NSC33001, 9-Fluoro-11-beta,17-dihydroxy-6-alpha-methylpregna-1,4-diene-3,20-dione, SMR000058598, F0414, Pregna-1,4-diene-3,20-dione, 9-fluoro-11-beta,17-dihydroxy-6-alpha-methyl-, DSSTox_CID_27435, DSSTox_RID_82345, FML S.O.P., Pregna-1,4-diene-3,20-dione, 9-fluoro-11,17-dihydroxy-6-methyl-, (6alpha,11beta)-, DSSTox_GSID_47435, Cortisdin, Fluoropos, Flucon, Fluoro Ophtal, Fluoro-Ophtal, Isopto Flucon, 11|A,17|A-Dihydroxy-9-fluoro-6-methyl-1,4-pregnadiene-3,20-dione, Flucon, Isopto, 11beta,17alpha-Dihydroxy-9-fluoro-6-methyl-1,4-pregnadiene-3,20-dione, Fluor Op, PMS Fluorometholone, PMS-Fluorometholone, 9-Fluoro-11,17-dihydroxy-6-methylpregna-1,4-diene-3,20-dione, flumetholone, NSC-33001, NCGC00016442-01, CAS-426-13-1, Prestwick_227, Fluorometholone [USP:INN:BAN:JAN], Opera_ID_341, Prestwick0_000718, Prestwick1_000718, Prestwick2_000718, Prestwick3_000718, Fluorometholone, >=98%, D0P0HT, AC1L1U0Y, SCHEMBL5051, BSPBio_000935, Alcon Brand of Fluorometholone, Isdin Brand of Fluorometholone, SPBio_002856, BPBio1_001029, GTPL7079, Winzer Brand of Fluorometholone, CHEMBL1200600, DTXSID7047435, Novartis Brand of Fluorometholone, MolPort-003-941-413, Pregna-1,4-diene-3,20-dione, 9-fluoro-11.beta.,17-dihydroxy-6.alpha.-methyl-, Ursapharm Brand of Fluorometholone, Fluorometholone (JP15/USP/INN), Fluorometholone (JP17/USP/INN), HMS1570O17, HMS2097O17, HMS2234F16, HMS3714O17, Allergan Brand 1 of Fluorometholone, Allergan Brand 2 of Fluorometholone, Allergan Brand 3 of Fluorometholone, Tox21_110440, Tox21_302593, BDBM50103631, MFCD00056461, Pharmascience Brand of Fluorometholone, AKOS015895108, Tox21_110440_1, ZINC118912517, AC-3520, CCG-220718, DB00324, Pharm Allergan Brand of Fluorometholone, Pharm-Allergan Brand of Fluorometholone, NCGC00021575-03, NCGC00021575-05, NCGC00256631-01, AN-12858, AS-12363, CC-28503, NCI60_002886, SC-46978, AB2000748, LS-118455, FT-0603391, Progesterone, 17-dihydroxy-6.alpha.-methyl-, D01367, 426F131, C-21266, SR-01000003019, SR-01000003019-2, BRD-K64862097-001-03-9, BRD-K64862097-001-12-0, Pregna-1,4-diene-3,20-dione, 9-fluoro-11.beta.,17, Fluorometholone, British Pharmacopoeia (BP) Reference Standard, Fluorometholone, United States Pharmacopeia (USP) Reference Standard, 11beta, 17alpha-Dihydroxy-9-fluoro-6-methyl-1,4-pregnadiene-3,-20-dione, Pregna-1,20-dione, 9-fluoro-11.beta.,17-dihydroxy-6.alpha.-methyl-, Pregna-1,4-diene-3,20-dione, 9-fluoro-11beta,17-dihydroxy-6alpha-methyl-, Progesterone, 1-dehydro-9-fluoro-11.beta., 17-dihydroxy-6.alpha.-methyl-, (6alpha,11beta)-9-Fluoro-11,17-dihydroxy-6-methylpregna-1,4-diene-3,20-dione, Pregna-1,20-dione, 9-fluoro-11,17-dihydroxy-6-methyl-, (6.alpha.,11.beta.)-, Pregna-1,4-diene-3,20-dione, 9-fluoro-11,17-dihydroxy-6-methyl-, (6-alpha,11-beta)-, Pregna-1,4-diene-3,20-dione, 9-fluoro-11beta,17-dihydroxy-6alpha-methyl- (8CI), Pregna-1,4-diene-3,20-dione, 9-fluoro-11beta,17-dihydroxy-6alpha-methyl-(8CI), (1R,2S,8S,10S,11S,14R,15S,17S)-14-acetyl-1-fluoro-14,17-dihydroxy-2,8,15-trimethyltetracyclo[8.7.0.0;{2,7}.0;{11,15}]heptadeca-3,6-dien-5-one, (1R,2S,8S,10S,11S,14R,15S,17S)-14-acetyl-1-fluoro-14,17-dihydroxy-2,8,15-trimethyltetracyclo[8.7.0.02,7.011,15]heptadeca-3,6-dien-5-one, Pregna-1, 4-diene-3,20-dione, 9-fluoro-11,17-dihydroxy-6-methyl-, (6.alpha., 11.beta.)-


ID: 549

chemical graph of compound 549



InChIKey: FATOICABJMDCPU-LHTZQXJVSA-N
SMILES: C[C@@H]1CC[C@H]2[C@@H]([C@H]3CC[C@@H]4[C@H]([C@@H]3CN2C1)C[C@H]5[C@H]4C[C@H]([C@@H]6[C@@]5(CC[C@H](C6)OC(=O)C)C)OC(=O)C)C

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 90470318
synonyms found at PubChem are:
21851-07-0, FATOICABJMDCPU-LHTZQXJVSA-N, ZINC100110559


ID: 550

chemical graph of compound 550



InChIKey: FAVUCMGCKDICCE-UHFFFAOYSA-N
SMILES: C[N+]1(C2CCC1CC(C2)OC(=O)C3=CNC4=CC=CC=C43)C.[I-]

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 11957728
synonyms found at PubChem are:
3-Tropanylindole-3-carboxylate methiodide, EU-0101273, MLS002153353, CHEMBL1456417, HMS2232A17, HMS3263P08, HMS3373N11, Tox21_501273, CCG-222577, LP01273, NCGC00261958-01, SMR001230758, SR-01000076183, SR-01000076183-1


ID: 551

chemical graph of compound 551



InChIKey: FBOZXECLQNJBKD-UHFFFAOYSA-N
SMILES: CN(CC1=CN=C2C(=N1)C(=NC(=N2)N)N)C3=CC=C(C=C3)C(=O)NC(CCC(=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:

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


CID is 4112
synonyms found at PubChem are:
Amethopterin, DL-Amethopterin, (+)-Amethopterin, DL-Methotrexate, Methylaminopterin, 60388-53-6, TCMDC-123832, 6-Mtx (DL), Amethopterin (R,S), EINECS 262-213-7, METHOTREXATE(+/-), MLS002701970, N-(4-(((2,4-Diamino-6-pteridinyl)methyl)methylamino)benzoyl)-DL-glutamic acid, N-(p-(((2,4-Diamino-6-pteridinyl)methyl)methylamino)benzoyl)-DL-glutamic acid, NSC 117356, Glutamic acid, N-(p-(((2,4-diamino-6-pteridinyl)methyl)methylamino)benzoyl)-, DL-, L-Glutamic acid, N-[4-[[(2,4-diamino-6-pteridinyl)methyl]methylamino]benzoyl]-, Emtexate, Folex, C19H23N9O4, C20H22N8O5, 2-[(4-{[(2,4-diaminopteridin-6-yl)methyl](methyl)amino}phenyl)formamido]pentanedioic acid, DL-Glutamic acid, N-(4-(((2,4-diamino-6-pteridinyl)methyl)methylamino)benzoyl)-, (+-)-Methotrexate, D(-)-AMETHOPTERIN, SR-05000001673, Methotrexate polyglutamate, FBOZXECLQNJBKD-UHFFFAOYSA-N, NSC117356, ( )Amethopterin, 2-[(4-{[(2,4-diaminopteridin-6-yl)methyl]methylamino}phenyl)carbonylamino]pent anedioic acid, Prestwick_753, Folex (Salt/Mix), AC1L1HFS, Prestwick0_000373, Prestwick1_000373, Prestwick2_000373, Prestwick3_000135, Prestwick3_000373, Methotrexate, (+/-)-, CHEMBL426, AC1Q5SF6, Methotrexate, (DL)-Isomer, SCHEMBL3712, BSPBio_000210, BSPBio_000525, BSPBio_001993, ChEMBL_59579, METHOTREXATE, U.S.P., SPECTRUM1500398, SPBio_002446, BPBio1_000232, BPBio1_000579, Methotrexate pound>>Amethopterin, SCHEMBL11986730, CHEBI:93775, Kyselina N-(p-((2,4-diamino-6-pteridinylmethyl)methylamino)benzoyl)-L-glutamova, MolPort-001-779-666, HMS1569K07, HMS1920L21, HMS2091D16, HMS2096K07, HMS3267F07, HMS3371G08, HMS3403O03, HMS3654M22, HMS3713K07, Pharmakon1600-01500398, BCP02078, BDBM50004545, METHOTREXATE USP AND EP GRADE, NSC757113, AKOS000281496, AKOS024282621, 4-Amino-N10-methylpteroylglutamic acid, CCG-212689, MCULE-3234195945, NSC-117356, NSC-757113, NCGC00015079-03, NCGC00015079-04, NCGC00095284-01, NCGC00095284-02, 4CA-0097, 82334-40-5, AC-11680, AN-39412, L-4-Amino-N10-methylpteroylglutamic acid, LS-71811, NCI60_041622, Poly(imino(1-carboxy-4-oxo-1,4-butanediyl)), alpha-(4-(((2,4-diamino-6-pteridinyl)methyl)methylamino)benzoyl)-omega-hydroxy-, (S)-, SMR001565548, ST057254, ST069344, SBI-0053664.P003, AB0012834, Kyselina 4-amino-N10-methylpteroylglutamova, M1664, 388A536, I06-0203, SR-05000001673-1, SR-05000001673-2, BRD-A55424491-001-07-4, BRD-A55424491-001-08-2, I14-19311, (MTX)2-{4-[(2,4-Diamino-pteridin-6-ylmethyl)-methyl-amino]-benzoylamino}-pentanedioic acid, 2-(4-(((2,4-diaminopteridin-6-yl)methyl)(methyl)amino)benzamido)pentanedioic acid, 2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methyl-amino]benzoyl]amino]pentanedioic acid, 2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]pentanedioic acid, 2-{4-[(2,4-Diamino-pteridin-6-ylmethyl)-methyl-amino]-benzoylamino}-pentanedioic acid(MTX), Glutamic acid, N-[p-[[(2,4-diamino-6-pteridinyl)methyl]methylamino]benzoyl]-, L-(+)-, N-(4-[[(2,4-Diamino-6-pteridinyl)methyl](methyl)amino]benzoyl)glutamic acid, (L)-, N-(p-((2,4-Diamino-6-pteridyl)methyl)methylamino)benzoyl)glutamic acid, (L)-, (methotrexate)2-{4-[(2,4-Diamino-pteridin-6-ylmethyl)-methyl-amino]-benzoylamino}-pentanedioic acid, (Methotrexate, MTX)2-{4-[(2,4-Diamino-pteridin-6-ylmethyl)-methyl-amino]-benzoylamino}-pentanedioic acid, 184883-35-0, 2-[(4-{[(4-amino-2-imino-3H-pteridin-6-yl)methyl](methyl)amino}phenyl)formamido]pentanedioic acid, 2-{4-[(2,4-Diamino-pteridin-6-ylmethyl)-methyl-amino]-benzoylamino}-pentanedioic acid (Methotrexate), 2-{4-[(2,4-Diamino-pteridin-6-ylmethyl)-methyl-amino]-benzoylamino}-pentanedioic acid (MTX), 2-{4-[(2,4-Diamino-pteridin-6-ylmethyl)-methyl-amino]-benzoylamino}-pentanedioic acid bis-adamantan-1-ylamide, 2-{4-[(2,4-Diamino-pteridin-6-ylmethyl)-methyl-amino]-benzoylamino}-pentanedioic acid(Amethopterin), 2-{4-[(2,4-Diamino-pteridin-6-ylmethyl)-methyl-amino]-benzoylamino}-pentanedioic acid(Methotrexate (MTX)), 2-{4-[(2,4-Diamino-pteridin-6-ylmethyl)-methyl-amino]-benzoylamino}-pentanedioic acid(Methotrexate ), 2-{4-[(2,4-Diamino-pteridin-6-ylmethyl)-methyl-amino]-benzoylamino}-pentanedioic acid(methotrexate(MTX)), 2-{4-[(2,4-Diamino-pteridin-6-ylmethyl)-methyl-amino]-benzoylamino}-pentanedioic acid(Methotrexate), 2-{4-[(2,4-Diamino-pteridin-6-ylmethyl)-methyl-amino]-benzoylamino}-pentanedioic acid(Methotrexate, MXT), 4-methyl-(1S,5R,13R,14S,17R)-12-oxa-4-azapentacyclo[9.6.1.01,13.05,17.07,18]octadeca-7(18),8,10,15-tetraene-10,14-diol(methotrexate, MTX), Methotrexate solution, 1.0 mg/mL in methanol with 0.1N NaOH, ampule of 1 mL, certified reference material, Methotrexate2-{4-[(2,4-Diamino-pteridin-6-ylmethyl)-methyl-amino]-benzoylamino}-pentanedioic acid, Poly(imino((1S)-1-carboxy-4-oxo-1,4-butanediyl)), alpha-(4-(((2,4-diamino-6-pteridinyl)methyl)methylamino)benzoyl)-omega-hydroxy-


ID: 552

chemical graph of compound 552



InChIKey: FBOZXECLQNJBKD-ZDUSSCGKSA-N
SMILES: CN(CC1=CN=C2C(=N1)C(=NC(=N2)N)N)C3=CC=C(C=C3)C(=O)N[C@@H](CCC(=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:

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


CID is 126941
synonyms found at PubChem are:
methotrexate, 59-05-2, Rheumatrex, Abitrexate, Amethopterin, Trexall, Mexate, Metatrexan, Hdmtx, Methylaminopterinum, Antifolan, Ledertrexate, Methylaminopterin, Methotrexatum, Methotrexat, Metotrexato, MTX, 4-Amino-10-methylfolic acid, L-Amethopterin, (S)-2-(4-(((2,4-Diaminopteridin-6-yl)methyl)(methyl)amino)benzamido)pentanedioic acid, Folex, N-Bismethylpteroylglutamic acid, Amethopterine, Methoxtrexate, Maxtrex, Rasuvo, A-Methopterin, Mexate-Aq, A-Methpterin, Emtexate, Amethopterin L-, Folex-Pfs, Methotrexat-Ebewe, Methotrexate, L-, Methotrexate Lpf, Metotressato [DCIT], Folex Pfs, Methotextrate, METHOTREXATE SODIUM, 133073-73-1, NSC 740, NSC-740, CL-14377, NCI-C04671, UNII-YL5FZ2Y5U1, [3H]methotrexate, Methotrexatum [INN-Latin], Metotrexato [INN-Spanish], (+)-4-Amino-10-methylfolic acid, [3H]-methotrexate, EMT 25,299, CCRIS 1109, 4-Aminomethylpteroylglutamic acid, HSDB 3123, TCMDC-125858, Abitrexate (Methotrexate), EINECS 200-413-8, R 9985, YL5FZ2Y5U1, CHEMBL34259, (2S)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]pentanedioic acid, AI3-25299, NSC740, X 133, 4-Amino-N(sup 10)-methylpteroylglutamic acid, CHEBI:44185, L-(+)-N-(p-(((2,4-Diamino-6-pteridinyl)methyl)methylamino)benzoyl)glutamic acid, N-[4-[[(2,4-diamino-6-pteridinyl)methyl]methylamino]benzoyl]-L-glutamic acid, (2S)-2-[(4-{[(2,4-diaminopteridin-6-yl)methyl](methyl)amino}phenyl)formamido]pentanedioic acid, N-(p-(((2,4-Diamino-6-pteridinyl)methyl)methylamino)benzoyl)-L-(+)-glutamic acid, Antifolan hydrate, MTX hydrate, Kyselina 4-amino-N(sup 10)-methylpteroylglutamova [Czech], NCGC00025060-04, C20H22N8O5, CL 14377, 4-amino-N(10)-methylpteroylglutamic acid, DSSTox_CID_822, Mexate-Aq Preserved, N-(p-(((2,4-Diamino-6-pteridyl)methyl)methylamino)benzoyl)glutamic acid, N-(4-(((2,4-Diamino-6-pteridinyl)methyl)methylamino)benzoyl)-L-glutamicacid, DSSTox_RID_75810, Kyselina N-(p-((2,4-diamino-6-pteridinylmethyl)methylamino)benzoyl)-L-glutamova [Czech], DSSTox_GSID_20822, Methylaminopterin hydrate, Fauldexato, Medsatrexate, Methoblastin, Metotressato, Brimexate, Emthexat, Emthexate, Lantarel, Lumexon, Metrotex, Novatrex, Otrexup, Tremetex, Trexeron, Trixilem, Metex, Texate, MLS001401431, Methotrexate Preservative Free, MFCD00150847, (4-(((2,4-diaminopteridin-6-yl)methyl)(methyl)amino)benzoyl)-L-glutamic acid, Glutamic acid, N-(p-(((2,4-diamino-6-pteridinyl)methyl)methylamino)benzoyl)-, L-, N-[(4-{[(2,4-diaminopteridin-6-yl)methyl](methyl)amino}phenyl)carbonyl]-L-glutamic acid, SMR000112001, 4-Amino-10-methylfolic acid hydrate, SR-01000075682, SMR000449324, METHOTREXATE SODIUM PRESERVATIVE FREE, Arbitrexate, FBOZXECLQNJBKD-UHFFFAOYSA-N, Methotrate, Metolate, Xatmep, Intradose-MTX, 1dhi, 1dhj, 2drc, 4ocx, (2S)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methyl-amino]benzoyl]amino]pentanedioic acid, N-(4-{[(2,4-diaminopteridin-6-yl)methyl](methyl)amino}benzoyl)-L-glutamic acid, N-{4-[[(2,4-diaminopteridin-6-yl)methyl](methyl)amino]benzoyl}-L-glutamic acid, CAS-59-05-2, Kyselina N-(p-((2,4-diamino-6-pteridinylmethyl)methylamino)benzoyl)-L-glutamova, (2S)-2-[(4-([(2,4-DIAMINOPTERIDIN-6-YL)METHYL](METHYL)AMINO)PHENYL)FORMAMIDO]PENTANEDIOIC ACID, MPI-2505, Prestwick_322, Methotrexate [USAN:INN:BAN:JAN], Otrexup (TN), Xatmep (TN), folic acid antagonist, An-PDN, L-METHOTREXATE, Methotrexate 100mg, Methylaminopterin; MTX, DL-Amethopterin hydrate, Intrathecal methotrexate, Methotrexate [USAN:USP:INN:BAN:JAN], Spectrum_001836, Tocris-1230, 4kn0, WR-19039, METHYLAMINOPTERINE, N-(4-{[(2,4-Diaminopteridin-1-Ium-6-Yl)methyl](Methyl)amino}benzoyl)-L-Glutamic Acid, Prestwick0_000135, Prestwick1_000135, Prestwick2_000135, Spectrum2_001077, Spectrum3_000497, Spectrum4_000616, Spectrum5_000958, Methotrexate - Abitrexate, D07ALU, D0D3DU, D0SV8E, L(+)-Amethopterin hydrate, NCIMech_000767, SCHEMBL3711, BIDD:PXR0175, L-(+)-AMETHOPTERIN, Lopac0_000020, KBioGR_001172, KBioSS_002341, KSC269O8T, Kyselina 4-amino-N(sup 10)-methylpteroylglutamova, MLS000049968, MLS002154208, DivK1c_000114, SPBio_001094, SPBio_002149, AC1L2R79, cid_126941, cid_165528, GTPL4674, GTPL4815, DTXSID4020822, SCHEMBL12421860, BDBM18050, BDBM66082, CTK1G9789, HMS500F16, KBio1_000114, KBio2_002338, KBio2_004906, KBio2_007474, KBio3_001493, Methotrexate (JP17/USP/INN), AOB5585, FBOZXECLQNJBKD-ZDUSSCGKSA-N, g301, MolPort-003-665-521, NINDS_000114, Bio1_000486, Bio1_000975, Bio1_001464, HMS1568K12, HMS2095K12, HMS2233O18, HMS3260C21, HMS3712K12, ACT03341, APC-2002, BCP13701, KS-00000L8X, MPI-5004, ZINC1529323, Tox21_110944, Tox21_300269, Tox21_500020, ANW-72813, CCG-35800, LS-249, s1210, 15475-56-6 (hydrochloride salt), AKOS016340329, Tox21_110944_1, 7413-34-5 (di-hydrochloride salt), AB02593, ACN-050905, CL14377, CS-1732, DB00563, KS-5093, LP00020, MCULE-6523054194, RTR-020497, IDI1_000114, SMP2_000020, (methyl)amino)benzamido)pentanedioic acid, NCGC00025060-01, NCGC00025060-02, NCGC00025060-03, NCGC00025060-05, NCGC00025060-06, NCGC00025060-07, NCGC00025060-08, NCGC00025060-09, NCGC00025060-10, NCGC00025060-11, NCGC00025060-12, NCGC00025060-13, NCGC00025060-15, NCGC00025060-16, NCGC00254216-01, NCGC00260705-01, AJ-26587, BC202627, BR-77824, HY-14519, SC-19293, 4-Amino-N10-methylpteroyl-L-glutamic acid, EU-0100020, FT-0082628, FT-0601523, Methotrexate 1.0 mg/ml in Dimethyl Sulfoxide, 1771-EP0930075A1, 1771-EP2269989A1, 1771-EP2269994A1, 1771-EP2270001A1, 1771-EP2270008A1, 1771-EP2270018A1, 1771-EP2270505A1, 1771-EP2272825A2, 1771-EP2272827A1, 1771-EP2272832A1, 1771-EP2275413A1, 1771-EP2275420A1, 1771-EP2277565A2, 1771-EP2277566A2, 1771-EP2277567A1, 1771-EP2277568A2, 1771-EP2277569A2, 1771-EP2277570A2, 1771-EP2277865A1, 1771-EP2277876A1, 1771-EP2280012A2, 1771-EP2281563A1, 1771-EP2281815A1, 1771-EP2287156A1, 1771-EP2289892A1, 1771-EP2289894A2, 1771-EP2292233A2, 1771-EP2292280A1, 1771-EP2292595A1, 1771-EP2292614A1, 1771-EP2292615A1, 1771-EP2292617A1, 1771-EP2295055A2, 1771-EP2295416A2, 1771-EP2295426A1, 1771-EP2295427A1, 1771-EP2298743A1, 1771-EP2298748A2, 1771-EP2298764A1, 1771-EP2298765A1, 1771-EP2298768A1, 1771-EP2298772A1, 1771-EP2298778A1, 1771-EP2298780A1, 1771-EP2301928A1, 1771-EP2301933A1, 1771-EP2305243A1, 1771-EP2305640A2, 1771-EP2305642A2, 1771-EP2305660A1, 1771-EP2305668A1, 1771-EP2305671A1, 1771-EP2305679A1, 1771-EP2305689A1, 1771-EP2308833A2, 1771-EP2308839A1, 1771-EP2308855A1, 1771-EP2308861A1, 1771-EP2311453A1, 1771-EP2311807A1, 1771-EP2311808A1, 1771-EP2311825A1, 1771-EP2311827A1, 1771-EP2311829A1, 1771-EP2311840A1, 1771-EP2311842A2, 1771-EP2311850A1, 1771-EP2314590A1, 1771-EP2316459A1, 1771-EP2316832A1, 1771-EP2316833A1, 1771-EP2316834A1, 1771-EP2371811A2, 1771-EP2374454A1, 5947-EP0930075A1, 5947-EP2269994A1, 5947-EP2289892A1, 73M731, A-2190, C01937, D00142, J10045, DL-4-Amino-N10-methylpteroylglutamic acid hydrate, SR-01000597411, W-60383, (S)-2-(4-(((2,4-diaminopteridin-6-yl)methyl), I06-2098, Q-201366, SR-01000075682-1, SR-01000075682-2, SR-01000075682-6, SR-01000597411-1, W-105347, 2,2'-(9,10-anthracenediylidene)-bis-propanedinitrile, BRD-K59456551-001-09-3, BRD-K59456551-001-11-9, I14-18123, WLN: T66 BN DN GN JNJ CZ EZ H1N1&R DVMYVQ2VQ, Z1541638527, UNII-99ITO15X8S component FBOZXECLQNJBKD-ZDUSSCGKSA-N, Methotrexate, European Pharmacopoeia (EP) Reference Standard, Methotrexate, United States Pharmacopeia (USP) Reference Standard, Glutamic acid,4-diamino-6-pteridinyl)methyl] methylamino]benzoyl]-, L-(+)-, L-Glutamic acid,4-diamino-6-pteridinyl)methyl]- methylamino]benzoyl]-, L-Glutamic acid,N-[4-[[(2,4-diamino-6-pteridinyl)methyl]methylamino]benzoyl]-,hydrate(9ci), L-Glutamicacid, N-[4-[[(2,4-diamino-6-pteridinyl)methyl]methylamino]benzoyl]-, Methotrexate for peak identification, European Pharmacopoeia (EP) Reference Standard, Methotrexate for system suitability, European Pharmacopoeia (EP) Reference Standard, Methotrexate, Pharmaceutical Secondary Standard; Certified Reference Material, N-(4-(((2,4-DIAMINO-6-PTERIDINYL)METHYL)METHYLAMINO)BENZOYL)L-GLUTAMIC ACID, N-[4-[[(2,4-Diamino-6-pteridinyl)methyl] methylamino]benzoyl]-L-glutamic acid, (2S)-2-[[[4-[(2,4-diamino-6-pteridinyl)methyl-methylamino]phenyl]-oxomethyl]amino]pentanedioic acid;hydrate, (2S)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methyl-amino]benzoyl]amino]glutaric acid;hydrate, (2S)-2-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]pentanedioic acid;hydrate, (2S)-2-[[4-[[2,4-bis(azanyl)pteridin-6-yl]methyl-methyl-amino]phenyl]carbonylamino]pentanedioic acid;hydrate, (S)-2-(4-[(2,4-DIAMINO-PTERIDIN-6-YLMETHYL)-METHYL-AMINO]-BENZOYLAMINO)-PENTANEDIOIC ACID, 1082707-84-3, 70359-39-6, L-Glutamic acid,N-[4-[[(2,4-diamino-6-pteridinyl)methyl]methylamino]benzoyl]-, hydrate (9CI), Methotrexate, PharmaGrade, Manufactured under appropriate controls for use as a raw material in pharma or biopharmaceutical production, meets EP, USP testing specifications


ID: 553

chemical graph of compound 553



InChIKey: FBSMERQALIEGJT-UHFFFAOYSA-N
SMILES: CN(C)CCCN1C2=CC=CC=C2SC3=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:

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


CID is 6240
synonyms found at PubChem are:
Chlorpromazine hydrochloride, 69-09-0, Sonazine, Chlorpromazine Hcl, Chloractil, Klorpromex, Promacid, Hebanil, Propaphenin, Hibernal, Hybernal, Klorproman, Lomazine, Marazine, Neurazine, Norcozine, Plegomazin, Promachel, Promexin, Taroctyl, Tranzine, Promapar, Unitensen, Aminazinum, Hibanil, Megatil, Chlorpromazinium chloride, Aminazin monohydrochloride, Fenactil monohydrochloride, Chloropromazine monohydrochloride, Ampliactil monohydrochloride, Contomin hydrochloride, Megaphen hydrochloride, Chlorpromazine monohydrochloride, Largactil monohydrochloride, NCI-C05210, CHLOROPROMAZINE HYDROCHLORIDE, CPZ (VAN), Chlorpromazine, Hydrochloride, Chlorpromazine (hydrochloride), CCRIS 6221, UNII-9WP59609J6, EINECS 200-701-3, NSC 17479, [3-(2-Chloro-10H-phenothiazin-10-yl)propyl]-dimethylamine hydrochloride, 3-(2-chloro-10H-phenothiazin-10-yl)-N,N-dimethylpropan-1-amine hydrochloride, AI3-28023, MLS000069401, CHEBI:3649, 10-(3-Dimethylaminopropyl)-2-chlorophenothiazine monohydrochloride, 9WP59609J6, SMR000058254, 2-Chloro-10-(3-(dimethylamino)propyl)phenothiazine monohydrochloride, 10H-Phenothiazine-10-propanamine, 2-chloro-N,N-dimethyl-, monohydrochloride, 2-Chloro-10-[3-dimethylamino-propyl] phenothiazine, 4560 Rp hydrochloride, AC1LCWF1, Phenothiazine hydrochloride, [3-(2-chloro-10H-phenothiazin-10-yl)propyl]dimethylamine hydrochloride, Chlorpromazine-d6 Hydrochloride, 2-Chloro-10-(3-dimethylaminopropyl)phenothiazine hydrochloride, 2-Chloro-10-[3′-(dimethylamino)propyl]phenothiazine, HCl, Phenothiazine, 2-chloro-10-(3-(dimethylamino)propyl)-, monohydrochloride, 10H-Phenothiazine-10-propanamine, 2-chloro-N,N-dimethyl-, hydrochloride (1:1), CPD000058254, NSC17479, CAS-69-09-0, SR-01000000012, CPZ, Chloropromazin hydrochloride, Largaktyl, [3-(2-chlorophenothiazin-10-yl)propyl]dimethylamine, chloride, 3-(2-chlorophenothiazin-10-yl)-N,N-dimethylpropan-1-amine;hydrochloride, Prestwick_58, Sonazine (TN), Chlorpromazine Hydrochloride Intensol, Chlorpromazine chloride, AC1Q3BDA, Chlorpromazine hydrochloride [USP:BAN:JAN], Opera_ID_1294, Chlorpromazine hydrochloride [USAN:BAN:JAN], C17H19ClN2S.HCl, DSSTox_CID_4827, AC1L1M3I, CHEMBL1713, DSSTox_RID_77545, DSSTox_GSID_24827, SCHEMBL41771, MLS001148603, MLS002222157, ARONIS23911, ChlorpromazineHydrochloride,98%, DTXSID7024827, CTK8B3386, HY-B0407A, FBSMERQALIEGJT-UHFFFAOYSA-N, MolPort-003-928-768, Chlorpromazine hydrochloride, 98%, HMS1568M09, Tox21_300517, Tox21_500249, ANW-42443, MFCD00012654, NSC-17479, NSC226514, s2456, SBB057793, AKOS005111082, CCG-220064, CCG-221553, CS-2507, LP00249, LS-1585, MCULE-8792081568, NC00552, NSC-226514, KS-00000V46, Chlorpromazine hydrochloride (JP17/USP), NCGC00024409-09, NCGC00093711-01, NCGC00093711-02, NCGC00180973-01, NCGC00254272-01, NCGC00260934-01, AC-10573, AN-23781, H818, SAM002548952, SAM002564196, SC-18311, AB0013284, AB1009377, TR-031509, Chlorpromazine hydrochloride, >=98% (TLC), EU-0100249, FT-0623715, ST50331291, C 8138, C07952, D00789, MLS-0090820.0001, WLN: T C666 BN ISJ B3N1&1 EG &GH, 012C654, Q-200842, SR-01000000012-2, SR-01000000012-9, Z1259155914, 2-chloro-10-(3-dimethylaminopropyl) phenothiazine hydrochloride, 2-chloro-10-(3-dimethylaminopropyl)-phenothiazine hydrochloride, Chlorpromazine hydrochloride, meets USP testing specifications, Chlorpromazine hydrochloride, VETRANAL(TM), analytical standard, 10-[3-(dimethylamino)propyl]-2-chlorophenothiazine hydrochloride, 2-Chloro-10-(3-dimethylaminopropyl)phenothiazine monohydrochloride, 2-Chloro-10-[3-(dimethylamino)-1-propyl]phenothiazine Hydrochloride, Chlorpromazine Hydrochloride 1.0 mg/ml in Methanol (as free base), 10H-phenothiazine-10-propanamine hydrochloride, 2-chloro-N,N-dimethyl-, 3-(2-chlorophenothiazin-10-yl)-N,N-dimethyl-propan-1-amine hydrochloride, 3-(2-chlorophenothiazin-10-yl)-N,N-dimethylpropan-1-amine hydrochloride, Chlorpromazine hydrochloride, European Pharmacopoeia (EP) Reference Standard, 2-Chloro-10-(3-dimethylaminopropyl)phenothiazine hydrochloride; CPZ; Largactil, Chlorpromazine hydrochloride, United States Pharmacopeia (USP) Reference Standard, MLS000595399, SMR000149922, AC1LAWRW, Opera_ID_1263, HMS2234H07, HMS3370H01, [3-(2-Chloro-phenothiazin-10-yl)-propyl]-dimethyl-ammonium, 3-(2-chlorophenothiazin-10-yl)propyl-dimethylazanium chloride, AKOS015895975, I06-1260, 2-chloro-N,N-dimethyl-10H-phenothiazine-10-propanamine monohydrochloride, 3-(2-chlorophenothiazin-10-yl)-N,N-dimethylpropan-1-amine; hydron; chloride


ID: 554

chemical graph of compound 554



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

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 66654
synonyms found at PubChem are:
Xanthoxylin, 90-24-4, Xanthoxyline, 2'-Hydroxy-4',6'-dimethoxyacetophenone, 2-Hydroxy-4,6-dimethoxyacetophenone, Brevifolin, 1-(2-Hydroxy-4,6-dimethoxyphenyl)ethanone, Brevifolin (Zanthoxylum), Phloracetophenone dimethyl ether, Brevifolin (VAN), 1-(2-Hydroxy-4,6-dimethoxyphenyl)ethan-1-one, 2,4-Di-O-methylphloroacetophenone, 4,6-Dimethoxy-2-hydroxyacetophenone, Phloroacetophenone 2,4-dimethyl ether, UNII-Z8RSY5TZPA, Acetophenone der., Ethanone, 1-(2-hydroxy-4,6-dimethoxyphenyl)-, 1-Acetyl-2-hydroxy-4,6-dimethoxybenzene, Z8RSY5TZPA, NSC 17392, 4',6'-dimethoxy-2'-hydroxyacetophenone, CHEBI:10070, FBUBVLUPUDBFME-UHFFFAOYSA-N, 2-Hydroxyl-4,6-dimethoxy-acetophenone, 1-(2-hydroxy-4,6-dimethoxy-phenyl)ethanone, Acetophenone, 2'-hydroxy-4',6'-dimethoxy-, AQ-358/42007313, Acetophenone, 2'-hydroxy-4',6'-dimethoxy- (8CI), brevifolin(van), 6-Methoxypaeonol, EINECS 201-978-3, Spectrum_000577, SpecPlus_000713, AI3-26010, Spectrum2_000463, Spectrum3_000181, Spectrum4_001499, Spectrum5_000237, ACMC-209r5b, AC1L25UT, AC1Q5D4Z, Acetophenone,6'-dimethoxy-, SCHEMBL44708, BSPBio_001701, KBioGR_002137, KBioSS_001057, SPECTRUM200441, MLS002207182, DivK1c_006809, SPBio_000566, 2-Acetyl-3,5-dimethoxyphenol, CHEMBL450288, CTK3J0177, KBio1_001753, KBio2_001057, KBio2_003625, KBio2_006193, KBio3_001201, DTXSID10237981, MolPort-001-762-282, ZINC157077, KS-000012GK, NSC17392, ZX-AT021196, ANW-39453, CCG-38702, NSC-17392, SBB071509, 2-Hydroxy-4, 6-dimethoxyacetophenone, 4, 6-Dimethoxy-2-hydroxyacetophenone, AKOS015856339, FCH1116672, MCULE-4292389127, OR22374, RTR-030636, SDCCGMLS-0066937.P001, TRA0050729, 2'-hyroxy-4',6'-dimethoxyacetophenone, NCGC00095824-01, NCGC00095824-02, 4CN-0948, AJ-14872, AK135500, AS-40799, SC-69796, SMR001306755, ST098711, ZB006545, 2'-Hydroxy-4',6'-dimethoxy-Acetophenone, (2-hydroxy-4,6-dimethoxy-phenyl)-ethanone, AB1004782, AX8000172, KB-146755, TR-030636, 1-(2-hydroxy-4,6-dimethoxyphenyl)-ethanone, D2683, FT-0612544, ST24037116, 1-(2-Hydroxy-4,6-dimethoxyphenyl)ethanone #, 2'-Hydroxy-4',6'-dimethoxyacetophenone, 97%, A-8021, C10726, Ethanone,1-(2-hydroxy-4,6-dimethoxyphenyl)-, SR-05000002434, 2''-HYDROXY-4'',6''-DIMETHOXYACETOPHENONE, Brevifolin; 4',6'-Dimethoxy-2'-hydroxyacetophenone, SR-05000002434-1, BRD-K12260308-001-02-6, BRD-K12260308-001-04-2, I14-19971


ID: 555

chemical graph of compound 555



InChIKey: FBWNMEQMRUMQSO-UHFFFAOYSA-N
SMILES: CCCCCCCCCC1=CC=C(C=C1)OCCOCCOCCOCCOCCOCCOCCOCCOCCO

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 72385
synonyms found at PubChem are:
Nonoxynol-9, Nonoxynol 9, Delfen, ToDay, Nonoxynol, n=9, 14409-72-4, PEG-9 Nonyl phenyl ether, Tergitol NP9, Nonaethylene glycol nonylphenyl ether, Nonylphenol octa(oxyethylene) ethanol, Tergitol NP-9, Nonaethylene glycol mono(nonylphenyl) ether, 26-(Nonylphenoxy)-3,6,9,12,15,18,21,24-octaoxahexacosan-1-ol, 26571-11-9, CHEBI:53775, 26-(4-nonylphenoxy)-3,6,9,12,15,18,21,24-octaoxahexacosan-1-ol, Polyethylene Glycol Mono-4-nonylphenyl Ether, N-9, 2-[2-[2-[2-[2-[2-[2-[2-[2-(4-nonylphenoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol, Staycept, Gynoll, HSDB 8094, C-Film, Tergitol TP-9, EINECS 247-816-5, K-Y plus nonoxynol-9, NONOXINOL-9, Spectrum2_001247, Spectrum3_001946, AC1L2HZ4, AC1Q56ZY, CHEMBL1410, SCHEMBL36844, BSPBio_003546, SPECTRUM1505292, SPBio_001154, Dowfax 9N9, Neutronyx 611, CO-630SP, CTK8B3251, KBio3_002833, DTXSID00858720, HMS2093O22, Pharmakon1600-01505292, ZINC8214629, 3,6,9,12,15,18,21,24-Octaoxahexacosan-1-ol, 26-(nonylphenoxy)-, ANW-42093, BDBM50442874, CCG-39124, NSC758941, AKOS015910808, DB06804, NSC-758941, NCGC00095907-02, NCGC00095907-03, N 9, SBI-0206761.P001, TR-011783, AB01563056_01, SR-05000001885, J-016227, Q-201490, SR-05000001885-1, BRD-K88625236-001-01-8, I14-40150, 1-(4-nonylphenyl)-1,4,7,10,13,16,19,22,25-nonaoxaheptacosan-27-ol, 41257-07-2, N9, VCF


ID: 556

chemical graph of compound 556



InChIKey: FBZONXHGGPHHIY-UHFFFAOYSA-N
SMILES: C1=CC2=C(C(=C1)O)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:

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


CID is 5699
synonyms found at PubChem are:
xanthurenic acid, 59-00-7, 4,8-Dihydroxyquinoline-2-carboxylic acid, Xanthuric acid, 8-Hydroxykynurenic acid, 4,8-Dihydroxyquinaldic acid, 4,8-Dihydroxyquinaldinic acid, Xanthurenate, 2-Quinolinecarboxylic acid, 4,8-dihydroxy-, UNII-58LAB1BG8J, NSC 401570, 8-hydroxy-4-oxo-1H-quinoline-2-carboxylic acid, C10H7NO4, CCRIS 4429, 4,8-Dihydroxy-2-quinolinecarboxylic acid, EINECS 200-410-1, NSC401570, BRN 0185954, 58LAB1BG8J, QUINALDIC ACID, 4,8-DIHYDROXY-, CHEMBL312535, CHEBI:10072, FBZONXHGGPHHIY-UHFFFAOYSA-N, X-1500, 4,8-Dihydroxyquinoline-2-carboxylate, Oxoxanthurenate, Xanthurate, gametocyte activating factor (GAF), 8-Hydroxykynurenate, 4-oxoxanthurenic acid, Spectrum_000253, 4,8-Dihydroxyquinaldate, Xanthurenic acid, 96%, AC1L1KXT, Spectrum2_000158, Spectrum3_000143, Spectrum4_000117, Spectrum5_001562, 4,8-dihydroxy-Quinaldate, 4,8-Dihydroxyquinaldinate, Quinaldic acid,8-dihydroxy-, Oprea1_107134, BSPBio_001846, KBioGR_000474, KBioSS_000733, 4,8-dihydroxy-Quinaldic acid, BIDD:GT0640, DivK1c_000262, SCHEMBL379760, SPECTRUM1500754, SPBio_000296, CTK1H0426, HMS500N04, KBio1_000262, KBio2_000733, KBio2_003301, KBio2_005869, KBio3_001046, DTXSID90207728, MolPort-001-792-867, MolPort-019-999-046, NINDS_000262, HMS1921G08, WLN: T66 BNJ CVQ EQ JQ, 4,8-DIHYDROXYGUINALDIC ACID, AC1Q7330, ZINC8738372, 4,8-dihydroxyquinoline-2-carboxylic, 5527AH, ANW-43693, BDBM50113313, CCG-38363, KM0268, SBB003498, 4,8-Dihydroxy-2-quinolinecarboxylate, AKOS003237896, AKOS015894330, 4,8-dihydroxyquinolinium-2-carboxylate, ACN-049214, API0004623, CS-W015382, HY-W014666, MCULE-1038310399, NSC-401570, RTR-020475, SDCCGMLS-0066616.P001, TRA0094822, 2-Quinolinecarboxylic acid,8-dihydroxy-, IDI1_000262, NCGC00094846-01, NCGC00094846-02, NCGC00094846-03, NCGC00094846-04, NCGC00094846-05, AJ-73368, AJ-73369, AN-41776, BP-10912, CC-17435, KB-62283, 2-Quinolinecarboxylicacid, 4,8-dihydroxy-, AX8000398, DB-053303, LS-139872, TR-020475, AM20061355, B7593, FT-0631263, ST24042681, ST45025626, Quinoline-2-carboxylic acid, 4,8-dihydroxy-, C02470, 4,8-Dihydroxy-quinoline-2-carboxylic acid anion, 059D007, A832107, C-10125, SR-05000002445, 2-Quinolinecarboxylic acid, 4,8-dihydroxy- (9CI), CU-01000012491-3, I04-9457, SR-05000002445-1, BRD-K07327532-001-03-6, 4,8-Dihydroxy-quinoline-2-carboxylic acid(Xanthurenate), 8-hydroxy-4-oxo-1,4-dihydroquinoline-2-carboxylic acid, 8-oxidanyl-4-oxidanylidene-1H-quinoline-2-carboxylic acid, B5FF212D-76CB-4875-8A36-C67D8E69489C, 4KL


ID: 557

chemical graph of compound 557



InChIKey: FCEVNJIUIMLVML-QPSVUOIXSA-N
SMILES: C/C=C\1/CC(=C)[C@@](C(=O)OCC2=CCN3[C@H]2[C@@H](CC3)OC1=O)(C)O

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 5281750
synonyms found at PubChem are:
SENECIPHYLLINE, 480-81-9, Seneciphyllin, Jacodine, NSC30622, UNII-0ZYZ9L5454, Seniciphylline, MLS000737616, CHEBI:9108, 0ZYZ9L5454, 13,19-Didehydro-12-hydroxysenecionan-11,16-dione, NSC 30622, CCRIS 4336, HSDB 5188, Seneciphylline, analytical standard, (1R,7R,17R)-4-ethylidene-7-hydroxy-7-methyl-6-methylene-2,9-dioxa-14-azatricyc lo[9.5.1.0<14,17>]heptadec-11-ene-3,8-dione, SMR000393787, NCI-C61165, Senecionan-11,16-dione, 13,19-didehydro-12-hydroxy-, trans-15-Ethylidene-12beta-hydroxy-12alpha-methyl-13-methylenesenec-1-enine, Prestwick_446, Prestwick2_000599, Prestwick3_000599, BSPBio_000478, MLS002222214, SCHEMBL177867, BPBio1_000526, CHEMBL523911, DTXSID8026016, CHEBI:92677, MolPort-004-955-368, HMS1569H20, HMS2096H20, HMS2763J21, (1,6)Dioxacyclododecino(2,3,4-gh)pyrrolizine-2,7-dione, 3-ethylidene-3,4,5,6,9,11,13,14,14a,14b-decahydro-6-hydroxy-6-methyl-5-methylene-, (3Z,6R,14aR,14bR)-, NSC-30622, ZINC95627757, AKOS024282719, NCGC00017384-04, NCGC00142562-03, 4CN-1935, ST057705, C10391, Senecionan-11, 13,19-didehydro-12-hydroxy-, (Z)-ethylidene-hydroxy-methyl-methylene-[?]dione, BRD-K38449220-001-03-8, Senecionan-11,16-dione, 13,19-didehydro-12-hydroxy- (9CI), 2H-Pyran-2-carboxylicacid,5-ethyltetrahydro-2,3-dimethyl-6-oxo-(9ci), (3Z,6R,14aR,14bR)-3-ethylidene-6-hydroxy-6-methyl-5-methylene-3,4,5,6,9,11,13,14,14a,14b-decahydro[1,6]dioxacyclododecino[2,3,4-gh]pyrrolizine-2,7-dione, (6R,9a1R,14aR,Z)-3-ethylidene-6-hydroxy-6-methyl-5-methylene-3,4,5,6,9,9a1,11,13,14,14a-decahydro-[1,6]dioxacyclododecino[2,3,4-gh]pyrrolizine-2,7-dione, [1,6]Dioxacyclododecino[2,3,4-gh]pyrrolizine-2,7-dione,3-ethylidene-3,4,5,6,9,11,13,14,14a,14b-decahydro-6-hydroxy-6-methyl-5-methylene-,(3Z,6R,14aR,14bR)-, Pyrrolizine-2, 3-ethylidene-3,4,5,6,9,11,13,14,14a,14b-decahydro-6-hydroxy-6-methyl-5-methylene(1,6)dioxacyclododecino[2,3,4-gh]-


ID: 558

chemical graph of compound 558



InChIKey: FCFZKAVCDNTYID-UHFFFAOYSA-M
SMILES: C1=CC=C2C(=C1)C3=CC=CC=C3[I+]2.[Cl-]

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 2733504
synonyms found at PubChem are:
Diphenyleneiodonium chloride, 4673-26-1, Dibenziodolium chloride, UNII-7M9D81YZ2N, DPI, 7M9D81YZ2N, CHEBI:77967, CHEMBL397686, SR-01000075494, Dibenziodolium, chloride, D0N0GJ, AC1MBZ20, C12H8I.Cl, dibenzo[b,d]iodolium chloride, SCHEMBL159318, GTPL7802, CTK8F9249, DTXSID00196932, MolPort-003-983-758, MolPort-023-275-892, HMS3261I15, HMS3266G10, 2,2'-biphenylyleneiodonium chloride, BCP08692, Tox21_500367, 1726AH, Diphenyleneiodonium chloride, >=98%, MFCD00214165, AKOS015903219, CCG-221671, LP00367, NCGC00093801-01, NCGC00093801-02, NCGC00261052-01, HY-100965, CS-0020645, EU-0100367, [1,1'-Biphenyl]-2,2'-diyiodonium chloride, [1,1'-Biphenyl]-2,2'-diyliodonium chloride, KS-00001873, D 2926, SR-01000075494-1, SR-01000075494-3, I14-18990, I14-41043, 8$l^{3}-iodatricyclo[7.4.0.0^{2,7}]trideca-1(9),2,4,6,10,12-hexaen-8-ylium chloride, 8|E3-iodatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaen-8-ylium chloride, 8lambda(3)-iodatricyclo[7.4.0.0(2),]trideca-1(13),2,4,6,9,11-hexaen-8-ylium chloride


ID: 559

chemical graph of compound 559



InChIKey: FCPVYOBCFFNJFS-LQDWTQKMSA-M
SMILES: CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)CC3=CC=CC=C3)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:

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


CID is 6250
synonyms found at PubChem are:
Penicillin G sodium, Penicillin G sodium salt, 69-57-8, Benzylpenicillin sodium, Crystapen, American penicillin, Pencillin G sodium, Sodium penicillin G, BENZYLPENICILLIN SODIUM SALT, Sodium penicillin, Sodium benzylpenicillinate, Sodium penicillin II, Mycofarm, Novocillin, Penilaryn, Veticillin, Sodium benzylpenicillin, Kesso-Pen, Pen-A-Brasive, Sodium benzylpenicillin G, Monosodium benzylpenicillin, Benzylpenicillinic acid sodium salt, Penicillin G, sodium, Sugracillin sodium salt, Penicillin G Sodium, Crystalline, Sodium benzylpenicyllinate, UNII-YS5LY7JF4N, Penicillin-G, monosodium salt, Sodium 6-(phenylacetamido)penicillanate, EINECS 200-710-2, OK 431, YS5LY7JF4N, Penicillin, NSC 402815, Penicillin G sodium [USP], CHEBI:51765, Penicillin G sodium (USP), 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 3,3-dimethyl-7-oxo-6-((phenylacetyl)amino)-, (2S-(2alpha,5alpha,6beta))-, monosodium salt, Monosodium (2S,5R,6R)-3,3-dimethyl-7-oxo-6-(2-phenylacetamido)-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylate, 61-33-6 (Parent), 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 3,3-dimethyl-7-oxo-6-(2-phenylacetamido)-, monosodium salt, Sodium (2S-(2alpha,5alpha,6beta))-3,3-dimethyl-7-oxo-6-(phenylacetamido)-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylate, PenicillinGsodiumsalt, 61-33-6 (FREE ACID), Penicillin G Sodium [USAN], CHEMBL1126, D0K5OT, Penicillin G sodium (TN), sodium benzylpenicillin(1-), C16H17N2NaO4S, SCHEMBL34218, C16H17N2O4S.Na, DTXSID6040581, KS-00000WAN, BIP0142, BENZYL PENICILLIN POTASSIUM, FCPVYOBCFFNJFS-LQDWTQKMSA-M, MolPort-003-926-371, ZX-AFC000647, Benzylpenicillin sodium salt AAENI, HMS1571G18, HMS2098G18, HMS3715G18, 4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 3,3-dimethyl-7-oxo-6-((phenylacetyl)amino)-(2S,5R,6R)-, monosodium salt, HY-B1463, MFCD00069666, s4160, AKOS015961217, CCG-221078, CS-7971, LS-1587, CAS-69-57-8, NCGC00017015-01, Penicillin G sodium salt, ~1650 U/mg, AC-13436, AN-23784, E706, K162, SC-16403, Penicillin G sodium salt, 96.0-102.0%, FT-0603271, P1770, D05408, P-1200, F0001-2583, Pencillin G sodium salt, Antibiotic for Culture Media Use Only, sodium 2,2-dimethyl-6beta-(phenylacetamido)penam-3alpha-carboxylate, Benzylpenicillin sodium, European Pharmacopoeia (EP) Reference Standard, Penicillin G sodium salt, powder, BioReagent, suitable for cell culture, Penicillin G sodium, United States Pharmacopeia (USP) Reference Standard, PENICILLIN G, SODIUM SALT (ALSO SEE: 1538-09-6 BENZATHINE PEN. G), 1406-09-3, 8049-60-3, sodium (2S,5R,6R)-3,3-dimethyl-7-oxo-6-(2-phenylacetamido)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate, sodium (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(2-phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate, Sodium (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0] heptane-2-carboxylate


ID: 560

chemical graph of compound 560



InChIKey: FDAYLTPAFBGXAB-UHFFFAOYSA-N
SMILES: C(CCl)N(CCCl)CCCl

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 5561
synonyms found at PubChem are:
trichlormethine, TRIS(2-CHLOROETHYL)AMINE, 555-77-1, Sinalost base, Trimitan base, Tris-(2-chloroethyl)-amine, Trimustine, 2-Chloro-N,N-bis(2-chloroethyl)ethanamine, Agent HN3, SK 100, TL 145, TS 160, 2,2',2''-Trichlorotriethylamine, Tri-(2-chloroethyl)amine, Nitrogen mustard (HN-3), UNII-66WBM7N0NM, Tris(beta-chloroethyl)amine, C6H12Cl3N, Triclormetina [INN-Spanish], Trichlormethinum [INN-Latin], A 8729, Ethanamine, 2-chloro-N,N-bis(2-chloroethyl)-, trichlorotriethylamine, Triethylamine, 2,2',2''-trichloro-, CCRIS 7606, HN 3, HN-3, HSDB 6395, Tri-2-chloroethylamine, NSC 30211, BRN 1739647, 66WBM7N0NM, Tris(.beta.-chloroethyl)amine, AI3-16198, FDAYLTPAFBGXAB-UHFFFAOYSA-N, DSSTox_CID_28670, DSSTox_RID_82940, DSSTox_GSID_48744, Triclormetina, Trichlormethinum, CAS-555-77-1, TS-160, Trichlormethine [INN], NSC-260424, NCGC00095905-01, Trichlormethine [INN:BAN], trichloromethine, Triethylamine, 2,2',2"-trichloro-, Sinalost (Salt/Mix), Trimitan (Salt/Mix), Trillekamin (Salt/Mix), HN3 (nitrogen mustard), AC1L1KME, R 47 (Salt/Mix), Spectrum2_000780, Spectrum3_001231, Spectrum4_000113, Spectrum5_000965, tris-(2-chloroethyl)amine, Tris-N-lost (Salt/Mix), Tris(2-chloroethyl)-amine, SCHEMBL8224, Tris-.beta.-Chloroethylamine, WLN: G2N2G2G, BSPBio_002702, KBioGR_000466, tris-(2-chloro-ethyl)-amine, 2,2''-Trichlorotriethylamine, DivK1c_000728, SPBio_000860, 817-09-4 (hydrochloride), CHEMBL443613, 2,2',2''-trichloroethylamine, 6138-32-5 (monopicrate), DTXSID7048744, 2,2',2'-Trichlorotriethylamine, CTK5A3818, HMS502E10, KBio1_000728, KBio3_002202, NINDS_000728, Ethanamine,N-bis(2-chloroethyl)-, Triethylamine,2',2''-trichloro-, 2, 2',2''-trichlorotriethylamine, HY-B1249, NSC30211, Tox21_113198, 4698AJ, ZINC38139367, AKOS022145597, Tox21_113198_1, CS-4959, FCH1321619, NE63177, IDI1_000728, NCGC00178521-01, NCGC00178521-03, SBI-0051749.P002, LS-157415, FT-0706146, 2-chloranyl-N,N-bis(2-chloroethyl)ethanamine, 2-Chloro-N,N-bis(2-chloroethyl)ethanamine #, Ethanamine,2-chloro-N,N-bis(2-chloroethyl)-, AB00053635_02, A830707, C-50085


ID: 561

chemical graph of compound 561



InChIKey: FDDDEECHVMSUSB-UHFFFAOYSA-N
SMILES: C1=CC(=CC=C1N)S(=O)(=O)N

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 5333
synonyms found at PubChem are:
sulfanilamide, 4-Aminobenzenesulfonamide, 63-74-1, Sulphanilamide, Sulfamine, Sulphonamide, p-Aminobenzenesulfonamide, Sulfonylamide, Sulfonamide, p-Aminobenzenesulfamide, Bacteramid, Streptasol, p-Sulfamoylaniline, Prontosil Album, Sulfonamide P, Estreptocida, Exoseptoplix, Streptoclase, p-Sulfamidoaniline, Streptocide, Sulfamidyl, Sulfanalone, Sulfanidyl, Sulfanil, Sulfocidine, Sulfana, Sulfanilimidic acid, p-Anilinesulfonamide, p-Aminophenylsulfonamide, Ambeside, Antistrept, Astreptine, Astrocid, Bactesid, Collomide, Colsulanyde, Copticide, Deseptyl, Ergaseptine, Erysipan, Gombardol, Lysococcine, Neococcyl, Orgaseptine, Prontalbin, Prontylin, Proseptal, Proseptine, Proseptol, Pysococcine, Septanilam, Septinal, Septolix, Septoplex, Septoplix, Strepamide, Strepsan, Streptagol, Streptamid, Streptamin, Streptocid, Streptocom, Strepton, Streptopan, Streptosil, Streptozol, Streptozone, Streptrocide, Sulfocidin, Therapol, 4-Sulfamoylaniline, Albexan, Albosal, Dipron, Gerison, Infepan, Sanamid, Stramid, Tolder, Benzenesulfonamide, 4-amino-, Lusil, 4-Aminobenzene-1-Sulfonamide, Prontosil White, Pronzin Album, Septamide Album, Stopton Album, Streptocid album, Prontosil I, Rubiazol A, White streptocide, PABS, Streptocide White, p-Aminobenzenesulfonylamide, 4-Aminophenylsulfonamide, Fourneau 1162, Streptocidum, Sulfanilamide Vaginal Cream, Aniline-p-sulfonic amide, Sulfanilamida, Sulfanilamidum, Benzenesulfonamide, p-amino-, 4-Amino-benzenesulfonamide, Streptocide (VAN), Solfanilamide [DCIT], Caswell No. 809A, p-Aminobenzensulfonamide, HSDB 223, 1162 F, 4-azanylbenzenesulfonamide, A-349, Sulfanilamidum [INN-Latin], Sulfanilamida [INN-Spanish], C6H8N2O2S, CCRIS 764, F 1162, UNII-21240MF57M, CHEBI:45373, NSC 7618, CHEMBL21, EINECS 200-563-4, p-amino benzene sulfonamide, para-aminobenzenesulfonamide, EPA Pesticide Chemical Code 077902, BRN 0511852, AI3-00952, NSC7618, FDDDEECHVMSUSB-UHFFFAOYSA-N, 4-aminobenzene sulfonic acid amide, 21240MF57M, AVC, CAS-63-74-1, NCGC00016285-02, NCGC00016285-05, Sulfanilamide, >=99%, DSSTox_CID_3622, 3-ACTOXYMERCURI-4-AMINOBENZENESULFONAMIDE, DSSTox_RID_77115, DSSTox_GSID_23622, 1337-39-9, SMR000059035, SR-01000763435, sulfanilamine, Sulfanimide, Sulfanilamide [INN:DCF:NF], sulphanilic amide, 4-sulphanilamide, Sulfanimide,(S), Prestwick_36, 4-sulfamoyl-aniline, sulfanilamide reagent, sulfanilamide-reagent, 4-sulphamoyl aniline, Spectrum_000489, 4-aminobenzensulfonamide, WLN: ZSWR DZ, 4-(Aminosulfonyl)aniline, 4-aminobenzenesulphonamide, p-aminobenzene sulfonamide, Prestwick0_000729, Prestwick1_000729, Prestwick2_000729, Prestwick3_000729, Spectrum2_000846, Spectrum3_001406, Spectrum4_000398, Spectrum5_001081, 4-aminobenzene sulfonamide, 4-aminobenzene-sulfonamide, ACMC-1AYS4, p-aminosulfonyl phenylamine, SCHEMBL740, 4-amino-benzenesulphonamide, D0T8BA, Epitope ID:122232, AC1L1K4E, Oprea1_273157, p-aminobenzene sulfonyl amide, BSPBio_000658, BSPBio_003052, KBioGR_000955, KBioSS_000969, 4-14-00-02658 (Beilstein Handbook Reference), KSC490E8T, MLS001074682, MLS002152940, BIDD:GT0170, DivK1c_000528, SPECTRUM1500646, SPBio_000831, SPBio_002597, Sulfanilamide, 98% 100g, AC1Q51Y6, aromatic sulfonamide compound 5, BPBio1_000724, halogenosulfanilamide deriv. 5a, ZINC2101, (4-(Aminosulfonyl)phenyl)amine, DTXSID4023622, SCHEMBL11880061, 6101-31-1 (hydrochloride), BDBM10857, CTK3J0289, HMS501K10, KBio1_000528, KBio2_000969, KBio2_003537, KBio2_006105, KBio3_002272, Sulfanilamide, p.a., 99.0%, MolPort-000-871-476, NINDS_000528, HMS1570A20, HMS1921O07, HMS2092E20, HMS2097A20, HMS2233B19, HMS3370J16, HMS3655K19, HMS3714A20, Pharmakon1600-01500646, EBD35543, HY-B0242, KS-00000V0E, NSC-7618, Tox21_110351, Tox21_201331, Tox21_303336, ANW-43069, BBL005257, c1264, CCG-40302, LS-274, MFCD00007939, NSC757404, s1685, SBB008928, STK298902, 10103-15-8 (hydrochloride salt), AKOS000119305, Tox21_110351_1, CS-2221, DB00259, MCULE-8746683155, NSC-757404, RP23455, RTR-021919, IDI1_000528, NCGC00016285-01, NCGC00016285-03, NCGC00016285-04, NCGC00016285-06, NCGC00016285-08, NCGC00091144-01, NCGC00091144-02, NCGC00091144-03, NCGC00257174-01, NCGC00258883-01, AJ-08134, AN-23733, AS-13239, BP-12552, CJ-00080, H701, KB-36489, SC-16246, ST079295, Sulfanilamide (4-Aminobenzenesulfonamide), ZB000483, SBI-0051575.P002, 4-Aminobenzenesulphonamide (Sulphanilamide), AB1002011, KB-303071, ST2411104, TR-021919, AB00052138, FT-0657032, S0119, S0381, S0833, Sulfanilamide, JIS special grade, >=99.7%, Sulfanilamide, Vetec(TM) reagent grade, 97%, C07458, D08543, M-3994, 36799-EP2272517A1, 36799-EP2272834A1, 36799-EP2289871A1, 36799-EP2301923A1, 36799-EP2301929A1, 36799-EP2301935A1, 36799-EP2305250A1, 36799-EP2305640A2, 36799-EP2305674A1, 36799-EP2305808A1, 36799-EP2311796A1, 36799-EP2311797A1, 36799-EP2311798A1, 36799-EP2311799A1, 36799-EP2311801A1, 91143-EP2295053A1, 91143-EP2305219A1, AB00052138-10, AB00052138_11, AB00052138_12, A834498, AC-907/25014139, Sulfanilamide, VETRANAL(TM), analytical standard, I06-0505, SR-01000763435-2, SR-01000763435-3, SR-01000763435-4, F2190-0451, BENZENESULFONIC ACID,4-AMINO,AMIDE SULFANILAMIDE, Sulfanilamide, European Pharmacopoeia (EP) Reference Standard, Sulfanilamide, puriss. p.a., >=99% (calc. to the dried substance), Sulfanilamide, United States Pharmacopeia (USP) Reference Standard, InChI=1/C6H8N2O2S/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4H,7H2,(H2,8,9,10, Sulfanilamide Melting Point Standard, United States Pharmacopeia (USP) Reference Standard, 102489-34-9, 12765-80-9, 1337-36-6, 24706-25-0, Sulfanilamide melting point standard, Pharmaceutical Secondary Standard; Certified Reference Material


ID: 562

chemical graph of compound 562



InChIKey: FDEACFAXFCKCHZ-MOROJQBDSA-N
SMILES: CCCCC#CC1=NC2=C(C(=N1)N)N=CN2[C@H]3[C@@H]([C@@H]([C@H](O3)C(=O)NCC)O)O

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 164437
synonyms found at PubChem are:
HE-NECA, 2-Hexynyl-NECA, Heneca, CHEMBL410873, 2-Hexynyl-5'-N-ethylcarboxamidoadenosine, 141018-30-6, (2S,3S,4R,5R)-5-(6-Amino-2-hex-1-ynyl-purin-9-yl)-N-ethyl-3,4-dihydroxy-oxolane-2-carboxamide, (2S,3S,4R,5R)-5-(6-amino-2-hex-1-ynylpurin-9-yl)-N-ethyl-3,4-dihydroxyoxolane-2-carboxamide, 2-Hexynyladenosine-5'-N-ethylcarboxamide, AC1Q5OOO, AC1L4US1, Lopac0_000635, GTPL373, (2s,3s,4r,5r)-5-[6-amino-2-(hex-1-yn-1-yl)-9h-purin-9-yl]-n-ethyl-3,4-dihydroxytetrahydrofuran-2-carboxamide(non-preferred name), SCHEMBL8102867, ZINC3779696, BDBM50453224, PDSP1_000292, PDSP1_000974, PDSP1_001061, PDSP2_000291, PDSP2_000958, PDSP2_001045, 2-Hexynyl-5'-ethylcarboxamidoadenosine, CCG-204723, 2-Hexynyl-5-N-ethylcarboxamidoadenosine, HE-NECA, solid, >=98% (HPLC), NCGC00094002-01, NCGC00094002-02, EU-0100635, H 8034, SR-01000075918, SR-01000075918-1, 2-Hexynyl-5 inverted exclamation marka-ethylcarboxamidoadenosine, 2-(1-Hexyn-1-yl)adenosine-5 inverted exclamation marka-N-ethyluronamide, beta-D-Ribosuranuronamide, 1-(6-amino-2-(1-hexynyl)-9H-purin-9-yl)-1-deoxy-N-ethyl-, (2S,3S,4R,5R)-5-(6-amino-2-hex-1-ynyl-purin-9-yl)-N-ethyl-3,4-dihydroxy-tetrahydrofuran-2-carboxamide


ID: 563

chemical graph of compound 563



InChIKey: FDGHZUQYDACRTA-UHFFFAOYSA-N
SMILES: CCOC(=O)CCCCCCCCCCCCC1CCC=C1

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 2700
synonyms found at PubChem are:
Chaulmoogric acid, ethyl ester, Chaulmoogric acid ethyl ester, NSC38010, Ethy6l chaulmoograte, 2-Cyclopentene-1-tridecanoic acid, ethyl ester, EINECS 210-786-9, Ethyl 2-cyclopentene-1-tridecanoate, NSC 38010, 2-Cyclopentene-1-tridecanoic acid, ethyl ester, (S)-, Ethyl 13-(cyclopent-2-enyl)tridecanoate, ETHYL CHAULMOOGRATE, 623-32-5, Spectrum_001411, Spectrum2_000511, Spectrum3_001357, Spectrum4_000118, Spectrum5_000724, ethyl 13-(cyclopent-2-en-1-yl)tridecanoate, AC1L1E9N, BSPBio_003173, KBioGR_000476, KBioSS_001891, SPECTRUM310017, DivK1c_000627, SPBio_000461, CHEMBL1329881, CTK5B4913, HMS501P09, KBio1_000627, KBio2_001891, KBio2_004459, KBio2_007027, KBio3_002393, NINDS_000627, AC1Q6578, CCG-39563, NSC-38010, IDI1_000627, NCGC00095864-01, NCGC00095864-02, LS-58339, ethyl 13-cyclopent-2-en-1-yltridecanoate, 2-Cyclopentene-1-tridecanoicacid, ethyl ester, (1S)-


ID: 564

chemical graph of compound 564



InChIKey: FDGQSTZJBFJUBT-UHFFFAOYSA-N
SMILES: C1=NC2=C(N1)C(=O)N=CN2

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 790
synonyms found at PubChem are:
hypoxanthine, 68-94-0, 6-Hydroxypurine, 9H-Purin-6-ol, 6-Oxopurine, Sarkin, Sarcine, Sarkine, Purin-6(1H)-one, Purin-6-ol, Hypoxanthine enol, 6(1H)-Purinone, 7H-Purin-6-ol, 9H-Purin-6(1H)-one, 3H-Purin-6-ol, Purin-6(3H)-one, 6-Hydroxy-1H-purine, Purine-6-ol, 1,7-Dihydro-6H-purin-6-one, 6H-Purin-6-one, 1,7-dihydro-, 1H-Purin-6(9H)-one, 9H-Purin-6-ol (VAN), 1,9-dihydro-6H-purin-6-one, 3,7-dihydropurin-6-one, 6H-Purin-6-one, 1,9-dihydro-, NSC 14665, 1H-Purin-6-ol (9CI), 3H-Purin-6-ol (9CI), UNII-2TN51YD919, 6,7-dihydro-3H-purin-6-one, 146469-94-5, 1,7-Dihydro-6H-purine-6-one, CHEBI:17368, AI3-52242, EINECS 200-697-3, 1,9-dihydropurin-6-one, HX, CHEMBL1427, 9H-Purin-6-ol (9CI), Hypoxanthine (VAN) (8CI), FDGQSTZJBFJUBT-UHFFFAOYSA-N, 2TN51YD919, 146469-95-6, 51953-04-9, 95121-06-5, NCGC00095622-01, DSSTox_CID_25983, DSSTox_RID_81271, DSSTox_GSID_45983, 146445-70-7, AG-670/31547063, Hypoxanthine-13C2,15N, CAS-68-94-0, 51953-23-2, purin-6(1H)-on, 3h-hypoxanthine, 6-hydroxypurin, 1vfn, 3nrz, InChI=1/C5H4N4O/c10-5-3-4(7-1-6-3)8-2-9-5/h1-2H,(H2,6,7,8,9,10, Hypoxanthine,(S), 1h-purin-6-ol, Hypoxanthine (VAN), NSC 129419, PubChem9283, 4-Hydroxy-1H-purine, Spectrum_001417, 1a9q, 7H-Purin-6-ol #, SpecPlus_000461, AC1Q6GPF, Spectrum2_001907, Spectrum3_001352, Spectrum4_001742, Spectrum5_000564, 3H-purin-6(7H)-one, ACMC-1AY8Z, ACMC-209o5e, bmse000094, D03HVE, Epitope ID:167471, AC1Q2AP6, 1,9-Dihydro-purin-6-one, Hypoxanthine, >=99.0%, ACMC-1C9T0, SCHEMBL25381, 7H-Purin-6-ol (9CI), BSPBio_003163, C5H3N4O, KBioGR_002184, KBioSS_001897, SPECTRUM310023, KSC353S0F, DivK1c_006557, SPBio_001874, AC1L1A12, GTPL4555, SCHEMBL1867923, DTXSID8045983, SCHEMBL17276814, BDBM82018, CTK0H0419, CTK0H0424, CTK1E4768, CTK1G8777, CTK2F3902, CTK3I5985, FDGQSTZJBFJUBT-UHFFFAOYSA-, KBio1_001501, KBio2_001897, KBio2_004465, KBio2_007033, KBio3_002383, CAS_790, NSC_790, MolPort-000-510-424, MolPort-000-799-859, MolPort-001-783-695, MolPort-002-640-011, MolPort-003-941-579, BCP22929, HY-N0091, NSC14665, Tox21_111511, ANW-35568, CCG-38478, CH0066, EBD130553, MFCD00005725, NSC-14665, PDSP1_000299, PDSP2_000297, s2424, SBB004203, STK804424, ZINC18153302, AKOS000267572, AKOS005221762, AKOS009159101, AKOS015888571, AKOS022168213, AKOS030544777, AKOS030619920, Tox21_111511_1, DB04076, MCULE-8326019285, PS-3167, RP20238, SDCCGMLS-0065594.P001, SDCCGMLS-0065594.P002, NCGC00095622-04, AC-10518, AJ-70362, AK-96690, AN-23780, CC-29453, CJ-15841, KB-73995, SC-06274, SY012477, 6H-Purin-6-one, 1,7-dihydro- (9CI), 6H-Purin-6-one, 3,7-dihydro- (9CI), AB0008347, DB-029904, KB-157893, KB-249883, LS-127207, TL8004832, CS-0007792, FT-0627170, ST50160486, 1,7-Dihydro-6H-purin-6-one (Hypoxanthine), Discontinued. See H998503 or H998504", EN300-37579, Hypoxanthine, Vetec(TM) reagent grade, 98%, Hypoxsanthine (1,7-Dihydro-6H-purin-6-one), 2899-EP2269996A1, 2899-EP2270008A1, 2899-EP2270505A1, 2899-EP2292617A1, 2899-EP2292630A1, 2899-EP2295503A1, 2899-EP2302382A2, 2899-EP2302383A2, 2899-EP2316974A1, 68H940, C00262, Z-4186, 30233-EP2277880A1, 30233-EP2284165A1, 30233-EP2287167A1, 30233-EP2292604A2, 30233-EP2292610A1, 30233-EP2292615A1, 30233-EP2295433A2, 30233-EP2305825A1, 30233-EP2311464A1, AB00674258-01, SR-05000002375, I01-1127, S14-2816, SR-05000002375-1, W-104648, F1386-0269, Hypoxanthine, powder, BioReagent, suitable for cell culture, 8C229956-6BE8-4F8D-91B7-0AD1EC294077, Didanosine impurity A,, European Pharmacopoeia (EP) Reference Standard, Didanosine Related Compound A, United States Pharmacopeia (USP) Reference Standard, InChI=1/C5H4N4O/c10-5-3-4(7-1-6-3)8-2-9-5/h1-2H,(H2,6,7,8,9,10), 184856-40-4, 184856-41-5, 25991-07-5, 25991-08-6, 25991-09-7, 39464-15-8, 39464-17-0, 480-99-9, 6535-89-3, Hypoxanthine, PharmaGrade, Manufactured under appropriate controls for use as a raw material in pharma or biopharmaceutical production.


ID: 565

chemical graph of compound 565



InChIKey: FDYFHDKFDSGDKM-MGPZMBRGSA-N
SMILES: CC(C)C1=CC2=C(C=C1)[C@]3(CCC[C@@](C3CC2)(C)CN)C.OS(=O)(=O)O

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 16725076
synonyms found at PubChem are:
18-AMINOABIETA-8,11,13-TRIENE SULFATE, CHEMBL3039097, CCG-39972


ID: 566

chemical graph of compound 566



InChIKey: FEBOTPHFXYHVPL-UHFFFAOYSA-N
SMILES: C1CN(CCC1N2C3=CC=CC=C3NC2=O)CCCC(=O)C4=CC=C(C=C4)F

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 16363
synonyms found at PubChem are:
BENPERIDOL, Anquil, 2062-84-2, Frenactil, Glianimon, Frenactyl, Concilium, Benzoperidol, McN-JR-4584, Benzperidol, Glianimon mite, R-4584, Anquil (VAN), Benperidolo [DCIT], Benperidol hydrochloride, Benzeridol, Benperidolum [INN-Latin], R 4584, Benperidol [USAN:INN:BAN], CB 8089, McN-JR 4584, UNII-97O6X78C53, 8089 C. B., EINECS 218-172-2, NSC 170982, BRN 0900981, 1-{1-[4-(4-fluorophenyl)-4-oxobutyl]piperidin-4-yl}-1h-benzo[d]imidazol-2(3h)-one, 8089 C.B., C22H24FN3O2, FEBOTPHFXYHVPL-UHFFFAOYSA-N, NSC170982, 2H-Benzimidazol-2-one, 1-(1-(4-(4-fluorophenyl)-4-oxobutyl)-4-piperidinyl)-1,3-dihydro-, 2H-Benzimidazol-2-one, 1-[1-[4-(4-fluorophenyl)-4-oxobutyl]-4-piperidinyl]-1,3-dihydro-, 97O6X78C53, NCGC00016602-01, CAS-2062-84-2, 1-(1-(3-(p-Fluorobenzoyl)propyl)-4-piperidyl)-2-benzimidazolinone, 4'-Fluor-4-(4-(2-oxo-1-benzimidazolinyl)piperidino)butyrophenon, 2-Benzimidazolinone, 1-[1-[3-(p-fluorobenzoyl)propyl]-4-piperidyl]-, 3-[1-[4-(4-fluorophenyl)-4-oxobutyl]piperidin-4-yl]-1H-benzimidazol-2-one, DSSTox_CID_25364, DSSTox_RID_80827, DSSTox_GSID_45364, Benzperidol hydrochloride, Benperidolo, Benperidolum, 1-[1-[3-(p-fluorobenzoyl)propyl]-4-piperidyl]-2-benzimidazolinone, 1-{1-(3-(p-Fluorobenzoyl)propyl)-4-piperidyl}-2-benzimidazolinone, 2-Benzimidazolinone, 1-(1-(3-(p-fluorobenzoyl)propyl)-4-piperidyl)-, 3-[1-[4-(4-fluorophenyl)-4-oxo-butyl]-4-piperidyl]-1H-benzimidazol-2-one, 3-[1-[4-(4-fluorophenyl)-4-oxobutyl]-4-piperidinyl]-1H-benzimidazol-2-one, 1-(1-(4-(4-fluorophenyl)-4-oxobutyl)piperidin-4-yl)-1H-benzo[d]imidazol-2(3H)-one, 1-[1-[4-(4-Fluorophenyl)-4-oxobutyl]-4-piperidinyl]-1,3-dihydro-2H-benzimidazol-2-one, 983-42-6, Benquil, 1-1-(3-(p-Fluorobenzoyl)propyl)-4-piperidyl-2-benzimidazolinone, 1-1-[3-(p-Fluorobenzoyl)propyl]-4-piperidyl-2-benzimidazolinone, 1-(1-(4-(4-Fluorophenyl)-4-oxobutyl)-4-piperidinyl)-1,3-dihydro-2H-benzimidazol-2-one, Anquil hydrochloride, Prestwick_778, Anquil (TN), Frenactyl hydrochloride, AC1Q4NJZ, Benperidol (USAN/INN), Prestwick0_000484, Prestwick1_000484, Prestwick2_000484, Prestwick3_000484, D0X7QQ, AC1L27SU, BSPBio_000347, 5-24-02-00375 (Beilstein Handbook Reference), MLS002153837, SCHEMBL122650, SPBio_002268, BPBio1_000383, CHEMBL297302, GTPL9215, DTXSID7045364, BDBM81492, CHEBI:93403, CTK4E4730, KS-00002WVI, MolPort-019-993-885, 2-Benzimidazolinone, hydrochloride, HMS1569B09, HMS2096B09, HMS2235H20, HMS3374B03, HMS3713B09, ZINC9232411, Tox21_110517, BDBM50183266, NSC_16363, NSC169873, PDSP1_000835, PDSP2_000822, AKOS016339645, Tox21_110517_1, API0001507, CCG-220484, DB12867, KS-1335, MCULE-4111012284, NSC-169873, NSC-170982, VZ21069, NCGC00016602-02, NCGC00016602-04, 8089 C.B, AC-12200, AN-50195, LS-33249, SC-75880, SMR001233200, CAS_2062-84-2, 8089 C. B, DB-045313, KB-151621, 2-Benzimidazolinone, hydrochloridemonohydrate, FT-0634013, ST50993924, WLN: T56 BMVNJ D- DT6NTJ A3VR DF, D02627, 062B842, A814756, L000947, SR-01000841254, 2H-Benzimidazol-2-one,3-dihydro-, monohydrochloride, SR-01000841254-2, BRD-K79425933-001-03-6, {1-1-[3-(p-Fluorobenzoyl)propyl]-4-piperidyl-2-benzimidazolinone}, 1-[1-[3-(p-Fluorbenzoyl)propyl]-4-piperidyl]-2-benzimidazolinon, 2-Benzimidazolinone, {1-[1-[3-(p-fluorobenzoyl)propyl]-4-piperidyl]-}, gamma-[4-(2-oxo-1-benzimidazolinyl)-piperidino]-p-fluorobutyrophenone, 1-[1-[4-(4-fluorophenyl)-4-oxo-butyl]-4-piperidyl]-3H-benzoimidazol-2-one, 1-{1-[4-(4-fluorophenyl)-4-oxobutyl]-4-piperidyl}-3-hydrobenzimidazol-2-one, 1-{1-[4-(4-Fluorophenyl)-4-oxobutyl]piperidin-4-yl}-1H-benzo[d] imidazol-2(3H)-one, 2H-Benzimidazol-2-one,1-[1-[4-(4-fluorophenyl)-4-oxobutyl]-4-piperidinyl]-1,3-dihydro-, 3-[1-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]piperidin-4-yl]-1H-benzimidazol-2-one, 2-Benzimidazolinone, {1-[1-[3-(p-fluorobenzoyl)propyl]-4-piperidyl]-,} hydrochloridemonohydrate, 2H-Benzimidazol-2-one, {1-[1-[4-(4-fluorophenyl)-4-oxobutyl]-4-piperidinyl]-1,3-dihydro-}


ID: 567

chemical graph of compound 567



InChIKey: FEFFSKLJNYRHQN-UHFFFAOYSA-N
SMILES: C1=CC=C2C(=C1)C(=O)N(C2=O)C(CCC(=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:

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


CID is 92225
synonyms found at PubChem are:
Phthalyl-DL-glutamic Acid, 2-Phthalimidoglutaric acid, 2301-52-2, 6349-98-0, 2-(1,3-dioxoisoindolin-2-yl)pentanedioic acid, Glutamic acid, phthalyl-, Phthaloyl-dl-glutamic acid, NPLG, Glutaric acid, 2-phthalimido-, N-Phthalylglutamic acid, Ba 2733, N-Phthalyl-dl-glutaminsaure, L-Glutamic acid, N-phthaloyl-, NSC43131, Glutaric acid, 2-phthalimido-, DL-, Pentanedioic acid, 2-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)-, 2-(1,3-Dioxo-1,3-dihydro-2H-isoindol-2-yl)pentanedioic acid, Phthalylglutamic acid, C13H11NO6, N-Phthalyl-dl-glutamate, N-Phthalyl-D,L-glutamic acid, PHTHALYL-DL-GLUTAMICACID, NSC-43131, EINECS 218-952-2, EINECS 228-754-8, NSC 43131, N-Phthalyl-DL-glutaminsaure [German], N-Phtaloylglutamic acid, 2-Phthalimidoglutaricacid, AC1L3NOG, AC1Q5SBN, Maybridge1_001721, N-Phtaloyl-DL-glutamic acid, N-Phthalyl-DL-glutamic acid, Oprea1_496228, CHEMBL71315, SCHEMBL411110, 2-Phthalimidylpentanedioic acid, CTK8B4029, HMS546G05, FEFFSKLJNYRHQN-UHFFFAOYSA-N, MolPort-001-840-723, 2-(1,3-Dihydro-1,3-dioxo-2H-isoindol-2-yl)glutaric acid, HMS3262P14, HMS3371P17, 2-(1,3-Dihydro-1,3-dioxy-2H-isoindole-2-yl)pentanedioicacid, AC1Q7573, ALBB-024228, KS-000017WI, Tox21_500956, 7639AH, ANW-43724, NSC120849, AKOS003236965, AKOS016050349, (L)-2-PHTHALIMIDOGLUTARIC ACID, CCG-205037, LP00956, MCULE-3857234778, NSC 120849, NSC-120849, TRA0084664, NCGC00261641-01, LS-72003, NCI60_003999, KB-285749, TR-010757, A8743, EU-0100956, FT-0634187, P0338, R1478, ST45002105, 2-(1,3-dioxo-2-isoindolyl)pentanedioic acid, 2-(1,3-dioxoisoindol-2-yl)pentanedioic acid, P 1801, A816489, SR-01000075452, I14-5745, SR-01000075452-1, 2-(1,3-dioxobenzo[c]azolidin-2-yl)pentanedioic acid, 2-[1,3-bis(oxidanylidene)isoindol-2-yl]pentanedioic acid, Pentanedioic acid,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)-, 2-(1,3-Dihydro-1,3-dioxy-2H-isoindole-2-yl)pentanedioic acid, 2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)pentanedioic acid, (1)-2-(1,3-Dihydro-1,3-dioxo-2H-isoindol-2-yl)glutaric acid, 942911-47-9


ID: 568

chemical graph of compound 568



InChIKey: FEGCPHIPSRBREU-HVATVPOCSA-N
SMILES: C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(C=C[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:

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


CID is 5283972
synonyms found at PubChem are:
Lithocholenic acid, UNII-BAO73Q70IY, BAO73Q70IY, 3alpha-Hydroxy-5beta-chol-11-en-24-oic Acid, 11,(5beta)-Cholenic acid-3alpha-ol, 1053-37-8, LITHOCHOL-11-ENIC ACID, AC1NR3GI, CHEMBL3138720, 11-Cholenic acid, 3alpha-hydroxy-, LMST04010210, CHOL-11-EN-24-oic acid, 3-hydroxy-, (3alpha,5beta)-, (4R)-4-[(3R,5R,8S,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid


ID: 569

chemical graph of compound 569



InChIKey: FEGVSPGUHMGGBO-VOTSOKGWSA-N
SMILES: COC1=CC=CC=C1/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:

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


CID is 734154
synonyms found at PubChem are:
2-Methoxycinnamic acid, 6099-03-2, 1011-54-7, 3-(2-Methoxyphenyl)acrylic acid, trans-2-Methoxycinnamic acid, (2E)-3-(2-methoxyphenyl)acrylic acid, (E)-3-(2-Methoxyphenyl)acrylic acid, (2E)-3-(2-methoxyphenyl)prop-2-enoic acid, o-Methoxycinnamic acid, (E)-3-(2-Methoxyphenyl)-2-propenoic acid, (E)-o-Methoxycinnamic acid, trans-O-Methyl-o-coumaric Acid, Cinnamic acid, o-methoxy-, UNII-J77SK1Y4MY, 3-(2-methoxyphenyl)prop-2-enoic acid, J77SK1Y4MY, 2-Propenoic acid, 3-(2-methoxyphenyl)-, FEGVSPGUHMGGBO-VOTSOKGWSA-N, 2-Propenoic acid, 3-(2-methoxyphenyl)-, (E)-, COUMARINIC ACID METHYL ETHER, NSC638141, 2-Methoxy-cinnamic acid, (E)-3-(2-methoxyphenyl)prop-2-enoic acid, 3-(2-Methoxyphenyl)-2-propenoic acid, (2E)-3-(2-Methoxyphenyl)-2-propenoic acid #, FEGVSPGUHMGGBO-UHFFFAOYSA-N, 3-(2-Methoxy-phenyl)-acrylic acid, EINECS 213-785-1, 2-Methoxy-zimtsaure, 2-Propenoic acid, 3-(2-methoxyphenyl)-, (2E)-, AI3-11206, AC1Q5RAW, AC1LED48, AC1Q5T9F, 2-Methoxybenzeneacrylic acid, (E)-2-methoxycinnamic acid, CHEMBL95203, trans-O-Methyl-o-cumaric Acid, ARONIS023687, trans-ortho-methoxycinnamic acid, 3-(2-Methoxyphenyl)acrylicacid, CHEBI:93692, NSC8135, CHEBI:136676, MolPort-000-860-922, MolPort-004-288-328, HMS1748N22, ZINC149577, ALBB-007553, NSC-8135, EINECS 228-047-4, 2-Methoxycinnamic acid, >=97.0%, 7327AC, BBL013998, HTS001422, SBB043620, STK411567, AKOS000120225, BS-3963, NE10312, NSC 638141, NSC-638141, RL00073, RP16856, RTR-000333, (E)-3-(2-Methoxy-phenyl)-acrylic acid, AJ-12583, KB-26646, KB-68941, AB0047012, TC-170475, TR-000333, M0449, R1906, ST24041404, ST45026678, trans-3-(2-Methoxyphenyl)prop-2-enoic acid, Y1994, 2-Methoxycinnamic acid, predominantly trans, 98%, I04-1667, I04-9969, J-008350, J-509858, I04-13686, CD9AA602-23B3-4A72-B198-69C984F1152A


ID: 570

chemical graph of compound 570



InChIKey: FEGZBVFKDOUDFN-UHFFFAOYSA-N
SMILES: C1=CC=C(C=C1)CN(CC2=NC=CN2)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:

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


CID is 11957448
synonyms found at PubChem are:
Antozoline hydrochloride, EU-0100105, CHEMBL1487371, Tox21_500105, CCG-221409, LP00105, NCGC00093602-01, NCGC00260790-01, A 9899, SR-01000075257, SR-01000075257-1


ID: 571

chemical graph of compound 571



InChIKey: FEWJPZIEWOKRBE-UHFFFAOYSA-N
SMILES: 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:

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


CID is 875
synonyms found at PubChem are:
DL-Tartaric acid, 2,3-Dihydroxysuccinic acid, 2,3-Dihydroxybutanedioic acid, tartaric acid, 133-37-9, Racemic acid, Uvic acid, 526-83-0, Traubensaure, Paratartaric acid, Paratartaric aicd, DL-Tartrate, Racemic tartaric acid, Resolvable tartaric acid, Tartaric acid D,L, (2R,3R)-Tartaric acid, BUTANEDIOIC ACID, 2,3-DIHYDROXY-, Threaric acid, (+)-Tartaric acid, Acidum tartaricum, CADAVERINE TARTRATE, (.+-.)-Tartaric acid, NSC62778, (2RS,3RS)-Tartaric acid, NSC 148314, CHEBI:15674, tartrate, (2R,3R)-2,3-Dihydroxybernsteinsaeure, Weinsteinsaeure, dl-2,3-dihydroxybutanedioic acid, Butanedioic acid, 2,3-dihydroxy-, (R*,R*)-, FEWJPZIEWOKRBE-UHFFFAOYSA-N, Natural tartaric acid, (+-)-Tartaric acid, 2,3-Dihydrosuccinic acid, Tartaric acid, L-(+)-, Butanedioic acid, 2,3-dihydroxy-, (2R,3R)-rel-, FEMA No. 3044, CCRIS 8978, Butanedioic acid, 2,3-dihydroxy-(R*,R*)-(.+/-.)-, EINECS 205-105-7, L-(+)-TARTARIC ACID, ACS, NSC155080, d-2,3-dihydroxysuccinic acid, (R,R)-(+)-Tartaric acid, L-2,3-Dihydroxybutanedioic acid, (+)-(2R,3R)-Tartaric acid, (+) tartaric acid, (-) tartaric acid, 1,2-Dihydroxyethane-1,2-dicarboxylic acid, 1,2-dicarboxylic acid, WLN: QVYQYQVQ, (-) D-Tartaric acid, ACMC-209qpg, Sal tartar (Salt/Mix), Tartaric acid, (DL)-, Butanedioic acid, 2,3-dihydroxy-, (2R,3S)-rel-, Butanedioic acid, 2,3-dihydroxy-, [S-(R*,R*)]-, Malic acid, 3-hydroxy-, laevo-(+)-tartaric acid, dextro,laevo-tartaric acid, Succinic acid,3-dihydroxy, Butanedioic acid, 2,3-dihydroxy-, (R*,R*)-(+-)-, SCHEMBL848, ACMC-209cz3, bmse000167, AC1Q76KC, Succinic acid,3-dihydroxy-, (.+/-.)-Tartaric acid, Butanedioic acid, 2,3-dihydroxy-, (theta,theta)-(+-)-, DSSTox_CID_26986, DSSTox_RID_82036, 2,3-dihydroxy-succinic acid, DSSTox_GSID_46986, Oprea1_827092, TARTARIC ACID, (L), 2-Aminoethanethiol Bitartrate, Tartaric acid, (.+-.)-, Butanedioic acid,3-dihydroxy-, AC1L1A82, CHEMBL333714, Dihydroxysuccinic acid, (DL)-, Tartaric acid, (.+/-.)-, DTXSID5046986, CTK7J6041, L+Tartaric Acid FCC, NF, USP, MolPort-001-779-714, 2,3-bis(oxidanyl)butanedioic acid, D -2,3-Dihydroxybutanedioic acid, HMS3370M15, L -2,3-Dihydroxybutanedioic acid, DL-Tartaric acid, 99% 250g, (+)-2,3-dihydroxybutanedioic acid, (S,S)-Tartaric acid;Tartaric acid, BCP14303, Tox21_302052, BBL011588, MFCD00071626, NSC-62778, NSC133735, NSC148314, NSC608773, STK387106, 2,3-Dihydroxysuccinic acid, (DL)-, 3-carboxy-2,3-dihydroxypropanoic acid, AKOS000120086, AKOS016844048, L-(+)-Tartaric acid, ACS 100g, MCULE-3867000095, NE11122, NSC-133735, NSC-148314, NSC-608773, RL01525, RL03940, RP21326, TRA0007150, TRA0043481, SMP2_000051, d-.alpha.,.beta.-Dihydroxysuccinic acid, NCGC00256063-01, AN-20550, AN-23077, AN-23285, AN-23531, AN-24126, AS-10983, BC204248, CAS-133-37-9, NCI60_001102, (+)-2,3-dihydroxy-1,4-butanedioic acid, DB-053495, KB-164119, LS-164466, AM20110247, FT-0625514, FT-0656080, ST24027285, (+/-)-2,3-dihydroxy-1,4-butanedioic acid, 1467-EP2269610A2, 1467-EP2269986A1, 1467-EP2269988A2, 1467-EP2269989A1, 1467-EP2269990A1, 1467-EP2270003A1, 1467-EP2270006A1, 1467-EP2270008A1, 1467-EP2270011A1, 1467-EP2270014A1, 1467-EP2270505A1, 1467-EP2272516A2, 1467-EP2272537A2, 1467-EP2272822A1, 1467-EP2272827A1, 1467-EP2272835A1, 1467-EP2272843A1, 1467-EP2272844A1, 1467-EP2275401A1, 1467-EP2275411A2, 1467-EP2275413A1, 1467-EP2275414A1, 1467-EP2277507A1, 1467-EP2277848A1, 1467-EP2277858A1, 1467-EP2277866A1, 1467-EP2277867A2, 1467-EP2280003A2, 1467-EP2280009A1, 1467-EP2281559A1, 1467-EP2281563A1, 1467-EP2281817A1, 1467-EP2281819A1, 1467-EP2281823A2, 1467-EP2284149A1, 1467-EP2284160A1, 1467-EP2284169A1, 1467-EP2284178A2, 1467-EP2284179A2, 1467-EP2286795A1, 1467-EP2287147A2, 1467-EP2287154A1, 1467-EP2287155A1, 1467-EP2287156A1, 1467-EP2287160A1, 1467-EP2287161A1, 1467-EP2287162A1, 1467-EP2289510A1, 1467-EP2289518A1, 1467-EP2289879A1, 1467-EP2289883A1, 1467-EP2289885A1, 1467-EP2289890A1, 1467-EP2289893A1, 1467-EP2292227A2, 1467-EP2292231A1, 1467-EP2292234A1, 1467-EP2292592A1, 1467-EP2292611A1, 1467-EP2292612A2, 1467-EP2292617A1, 1467-EP2292619A1, 1467-EP2295055A2, 1467-EP2295402A2, 1467-EP2295406A1, 1467-EP2295414A1, 1467-EP2295416A2, 1467-EP2295418A1, 1467-EP2295424A1, 1467-EP2295433A2, 1467-EP2298731A1, 1467-EP2298734A2, 1467-EP2298735A1, 1467-EP2298742A1, 1467-EP2298746A1, 1467-EP2298747A1, 1467-EP2298748A2, 1467-EP2298755A1, 1467-EP2298758A1, 1467-EP2298759A1, 1467-EP2298763A1, 1467-EP2298767A1, 1467-EP2298768A1, 1467-EP2298772A1, 1467-EP2298777A2, 1467-EP2298779A1, 1467-EP2301544A1, 1467-EP2301922A1, 1467-EP2301931A1, 1467-EP2301937A1, 1467-EP2301940A1, 1467-EP2305219A1, 1467-EP2305248A1, 1467-EP2305257A1, 1467-EP2305633A1, 1467-EP2305636A1, 1467-EP2305641A1, 1467-EP2305646A1, 1467-EP2305651A1, 1467-EP2305653A1, 1467-EP2305655A2, 1467-EP2305659A1, 1467-EP2305663A1, 1467-EP2305664A1, 1467-EP2305672A1, 1467-EP2305673A1, 1467-EP2305675A1, 1467-EP2305676A1, 1467-EP2305679A1, 1467-EP2305683A1, 1467-EP2308839A1, 1467-EP2308841A2, 1467-EP2308849A1, 1467-EP2308850A1, 1467-EP2308851A1, 1467-EP2308854A1, 1467-EP2308857A1, 1467-EP2308861A1, 1467-EP2308869A1, 1467-EP2308871A1, 1467-EP2308872A1, 1467-EP2308873A1, 1467-EP2308875A1, 1467-EP2311453A1, 1467-EP2311801A1, 1467-EP2311802A1, 1467-EP2311803A1, 1467-EP2311807A1, 1467-EP2311809A1, 1467-EP2311810A1, 1467-EP2311811A1, 1467-EP2311818A1, 1467-EP2311821A1, 1467-EP2311831A1, 1467-EP2311834A1, 1467-EP2311837A1, 1467-EP2311839A1, 1467-EP2311842A2, 1467-EP2314295A1, 1467-EP2314574A1, 1467-EP2314575A1, 1467-EP2314576A1, 1467-EP2314584A1, 1467-EP2314585A1, 1467-EP2314586A1, 1467-EP2314587A1, 1467-EP2314588A1, 1467-EP2314589A1, 1467-EP2314593A1, 1467-EP2316457A1, 1467-EP2316458A1, 1467-EP2316459A1, 1467-EP2316470A2, 1467-EP2316825A1, 1467-EP2316826A1, 1467-EP2316827A1, 1467-EP2316828A1, 1467-EP2316829A1, 1467-EP2316831A1, 1467-EP2316832A1, 1467-EP2316833A1, 1467-EP2316834A1, 1467-EP2316835A1, 1467-EP2316836A1, 1467-EP2316837A1, 1467-EP2371814A1, 1467-EP2374454A1, 1467-EP2374780A1, 1467-EP2374781A1, 1467-EP2380874A2, A22830, A22866, Butanedioic acid,3-dihydroxy- [R-(R*,R*)]-, 133D379, A829202, I04-0225, I04-1071, I04-1113, Butanedioic acid,3-dihydroxy-, (R*,R*)-(.+-.)-, I14-11535, F2191-0230, Z1258943354, 1,2-Dihydroxyethane-1,2-dicarboxylic acid;2,3-Dihydrosuccinic acid, Copper, mixt. with [R-(R*,R*)]-2,3-dihydroxybutanedioic acid monopotassium salt


ID: 572

chemical graph of compound 572



InChIKey: FFGPTBGBLSHEPO-UHFFFAOYSA-N
SMILES: C1=CC=C2C(=C1)C=CC3=CC=CC=C3N2C(=O)N

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 2554
synonyms found at PubChem are:
carbamazepine, 298-46-4, Tegretol, 5H-Dibenzo[b,f]azepine-5-carboxamide, Carbamazepen, Carbazepine, Finlepsin, Biston, Equetro, Carbamezepine, Tegretal, Epitol, Carbatrol, Neurotol, Timonil, 5H-Dibenz[b,f]azepine-5-carboxamide, Karbamazepin, Stazepine, Telesmin, Lexin, Tegretol-Xr, Carbamazepina, Carbamazepinum, Carbamazepin, Amizepin, Bipotrol, Teril, 5-Carbamyl-5H-dibenzo(b,f)azepine, 5-Carbamoyl-5H-dibenzo(b,f)azepine, Geigy 32883, Calepsin, Carnexiv, Stazepin, 5-Carbamoyl-5H-dibenz(b,f)azepine, 5H-Dibenz(b,f)azepine-5-carboxamide, benzo[b][1]benzazepine-11-carboxamide, 5-Carbamoyl-5H-dibenz[b,f]azepine, G 32883, G-32883, Carbamazepan, Carbelan, Sirtal, Tegretol Cr, Carbamazepinum [INN-Latin], Carbamazepina [INN-Spanish], NSC 169864, CHEBI:3387, UNII-33CM23913M, HSDB 3019, FFGPTBGBLSHEPO-UHFFFAOYSA-N, EINECS 206-062-7, CHEMBL108, BRN 1246090, 5-Carbamyldibenzo(b,f)azepine, MLS000069652, 5-Carbamoyldibenzo(b,f)azepine, Carbamazepine Hydrochloride, dibenzo[b,f]azepine-5-carboxamide, NSC169864, 33CM23913M, NCGC00015234-11, CAS-298-46-4, SMR000058201, carbamazepine hydrate, DSSTox_CID_2731, DSSTox_RID_76704, DSSTox_GSID_22731, Q-200792, Carbazepin, Amizepine, 2-azatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3(8),4,6,9,12,14-heptaene-2-carboxamide, SMR001227191, Carbamazepine Anhydrous, Carbamazepine Phosphate, SR-01000000229, Carbatrol extended-release, Atretol, Trimonil, Neurotop retard, Novo-Carbamaz, Nu-Carbamazepine, Apo-Carbamazepine, Tegretol Chewtabs, Taro-Carbamazepine, Tegretol (TN), Prestwick_104, carbamazepine sulfate, Equetro (TN), Carbamazepine [USAN:INN:BAN:JAN], carbamazepine tartrate, Carbamazepine, powder, Taro-Carbamazepine Cr, Opera_ID_72, Spectrum_000096, Carbamazepine [USAN:USP:INN:BAN:JAN], carbamazepine (Tegretol), AC1L1DXT, AC1Q4ZSU, AC1Q4ZSV, Prestwick0_000052, Prestwick1_000052, Prestwick2_000052, Prestwick3_000052, Spectrum2_000125, Spectrum3_000325, Spectrum4_000262, Spectrum5_000936, Carbamazepine (Carbatrol), Lopac-C-4024, ChemDiv1_018966, CBChromo1_000350, D04MSM, Epitope ID:174842, Iminostilbene-N-carboxamide, Lopac0_000292, Oprea1_790775, SCHEMBL21639, BSPBio_000203, BSPBio_001929, Carbamazepine (iv, epilepsy), KBioGR_000724, KBioSS_000516, MLS001055475, MLS001074172, MLS002548877, BIDD:GT0479, DivK1c_000388, DivK1c_003750, SPECTRUM1500159, SPBio_000170, SPBio_002124, CARBAMAZEPINE, U.S.P., BPBio1_000225, GTPL5339, ZINC4785, DTXSID4022731, SCHEMBL19838283, HMS501D10, HMS640O02, KBio1_000388, KBio2_000516, KBio2_003084, KBio2_005652, KBio3_001149, WLN: T C676 BNJ BVZ, AOB5783, Carbamazepine (JP17/USP/INN), SPD-417, Carbamazepine, analytical standard, MolPort-000-710-574, MolPort-023-220-275, NINDS_000388, HMS1568K05, HMS1920I17, HMS2090M07, HMS2091O19, HMS2095K05, HMS2233G16, HMS3039K09, HMS3259B21, HMS3260L06, HMS3372J13, HMS3657G03, HMS3712K05, Pharmakon1600-01500159, 85756-57-6 (di-hydrate), ACT02606, BCP21380, HY-B0246, KS-00000KI8, 5-Carbomoyl-5H-dibenzo(b,f)azepine, Tox21_110104, Tox21_202273, Tox21_300195, Tox21_500292, BBL005372, BDBM50003659, BG0497, CCG-38931, GP8250, MFCD00005073, NSC755920, s1693, STK177357, STL453548, 11-benzo[b][1]benzazepinecarboxamide, 5H-Dibenz[b,f]azepine-5-carboxamine, Carbamazepine 1.0 mg/ml in Methanol, AKOS003235644, AKOS025397243, IMED104589831, Tox21_110104_1, 5H-Dibenz[b,f]azepine-5- carboxamide, AC-9538, AN-6325, Carbamazepine (iv, epilepsy), Lundbeck, CS-2225, DB00564, KS-5146, LP00292, MCULE-9121567287, NC00679, NSC-169864, NSC-755920, 5H-Dibenz[ b, f]azepine-5-carboxamide, CDS1_002710, IDI1_000388, 5H-Dibenzo[b,f]azepine-5-carboxamide #, NCGC00015234-01, NCGC00015234-02, NCGC00015234-03, NCGC00015234-04, NCGC00015234-05, NCGC00015234-06, NCGC00015234-07, NCGC00015234-08, NCGC00015234-09, NCGC00015234-10, NCGC00015234-12, NCGC00015234-13, NCGC00015234-14, NCGC00015234-15, NCGC00015234-16, NCGC00015234-19, NCGC00023877-03, NCGC00023877-04, NCGC00023877-05, NCGC00023877-06, NCGC00023877-07, NCGC00023877-08, NCGC00253982-01, NCGC00259822-01, NCGC00260977-01, AJ-08227, AJ-08230, AK116064, BC200975, CC-25382, CC-25383, CPD001227191, H495, LS-60362, SAM002264603, SC-16243, ST075773, ZB000594, (z)-5h-dibenzo[b,f]azepine-5-carboxamide, SBI-0050280.P004, 5H-dibenzo[b,f]azepine-5-carboximidic acid, AB0070254, AB1009530, KB-246109, ST2418853, EU-0100292, FT-0602927, FT-0696814, H2605, EN300-21678, BIM-0050280.0001, C 4024, C06868, Carbamazepine, meets USP testing specifications, D00252, AB00051931-17, AB00051931-18, AB00051931_19, AB00051931_20, A820074, C-13993, I06-0863, SR-01000000229-2, SR-01000000229-4, SR-01000000229-7, BRD-K71799949-001-06-7, Carbamazepine (iv, epilepsy), Ovation Pharmaceuticals, F0348-2551, Z2199879032, Dibenzo[b,f]azepine-5-carboxylic acid amide(Carbamazepine), 5H-dibenzo[b,f]azepine-5-carboxamide;Oxcarbazepine IMpurity A, Carbamazepine, British Pharmacopoeia (BP) Reference Standard, Carbamazepine, European Pharmacopoeia (EP) Reference Standard, Carbamazepine, United States Pharmacopeia (USP) Reference Standard, 2-azatricyclo[9.4.0.0;{3,8}]pentadeca-1(11),3(8),4,6,9,12,14-heptaene-2-carboxamide, Carbamazepine solution, 1.0 mg/mL in methanol, ampule of 1 mL, certified reference material, Carbamazepine, Pharmaceutical Secondary Standard; Certified Reference Material, Azapentacene; Sodium 5,12-dihydroazapentacene disulfonate; 5,12-Dihydroquinoxalino[2,3-b]phenazine sulfonate sodium salt


ID: 573

chemical graph of compound 573



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

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 3418
synonyms found at PubChem are:
fosfosal, 2-(Phosphonooxy)benzoic acid, 6064-83-1, Disdolen, Salicyl phosphate, o-Carboxyphenyl phosphate, 2-Carboxyphenyl phosphate, 2-Phosphonoxybenzoic acid, Phosphonoxybenzoic acid, o-(Phosphonooxy)benzoic acid, 2-Phosphonooxybenzoic acid, Fosfosal [INN], Benzoic acid, o-(phosphonooxy)-, Salicylic acid dihydrogen phosphate, UR 1521, 2-Phosphonoxybenzoesaeure, Fosfosalum [INN-Latin], Benzoic acid, 2-(phosphonooxy)-, NSC 46475, UR 1522, UNII-124X2V25W4, Salicylic acid phosphate, 2-Phosphonoxybenzoesaeure [German], EINECS 227-993-5, 2-Phosphonooxy-benzoic acid, BRN 2619142, CHEMBL287275, Fosfosal (INN), Salicylic acid, dihydrogen phosphate, 124X2V25W4, NCGC00016668-02, CAS-6064-83-1, DSSTox_CID_25394, DSSTox_RID_80851, DSSTox_GSID_45394, Fosfosalum, SR-01000872625, Aydolid, C7H7O6P, o-cpp cpd, Prestwick_30, Disdolen (TN), Aydolid (TN), o-carboxyphenylphosphate, Spectrum_001347, WLN: QVR BOPQQO, AC1Q6SKP, Prestwick0_000815, Prestwick1_000815, Prestwick2_000815, Prestwick3_000815, Spectrum2_001458, Spectrum3_000940, Spectrum4_001039, Spectrum5_001180, D0N3UL, AC1L1FW2, SCHEMBL23401, BSPBio_000709, KBioGR_001597, KBioSS_001827, 4-10-00-00142 (Beilstein Handbook Reference), 2-Carboxyphenylphosphoric acid, DivK1c_000048, SPECTRUM1502012, SPBio_001355, SPBio_002630, BPBio1_000781, Benzoic acid,2-(phosphonooxy)-, DTXSID9045394, CHEBI:94564, CTK5B1978, HMS500C10, KBio1_000048, KBio2_001827, KBio2_004395, KBio2_006963, KBio3_001980, FFKUDWZICMJVPA-UHFFFAOYSA-N, MolPort-003-666-393, NINDS_000048, HMS1570D11, HMS1921D06, HMS2097D11, HMS3714D11, Pharmakon1600-01502012, NSC46475, ZINC1678159, 2-Carboxyphenyl dihydrogen phosphate, Tox21_110554, BDBM50112448, CCG-39194, NSC-46475, NSC758155, phosphoric acid o-carboxyphenyl ester, AKOS015958782, Tox21_110554_1, MCULE-1086101121, NSC-758155, UR-1521, VZ33514, IDI1_000048, NCGC00016668-01, NCGC00016668-03, NCGC00016668-06, NCGC00094938-01, NCGC00094938-02, Benzoic acid, 2-(phosphonooxy)- (9CI), SBI-0051697.P002, LS-144311, AB00052254, FT-0626545, P1952, VU0243472-2, D07991, AB00052254_04, SR-01000872625-1, SR-01000872625-2, BRD-K28687144-001-02-0, F9995-1274, Ethanone, 1-[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-(1-pyrrolidinyl)-


ID: 574

chemical graph of compound 574



InChIKey: FFNMBRCFFADNAO-UHFFFAOYSA-N
SMILES: CN1CCN(CC1)CC(=O)N2C3=CC=CC=C3C(=O)NC4=C2N=CC=C4.Cl.Cl

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 71405
synonyms found at PubChem are:
Pirenzepine dihydrochloride, Pirenzepine hydrochloride, 29868-97-1, Tabe, Pirenzepine HCl, Bisvanil, Leblon, Maghen, Pirenzepine 2HCl, Pirenzepinehydrochloride, LS 519 dihydrochloride, UNII-10YM403FLS, LS 519 cl2, LS 519Cl2, EINECS 249-907-5, Pirenzepine hydrochloride [USAN:JAN], Pirenzepine (dihydrochloride), 10YM403FLS, 5,11-Dihydro-11-((4-methyl-1-piperazinyl)acetyl)-6H-pyrido(2,3-b)(1,4)benzodiazepin-6-one dihydrochloride, 5,11-Dihydro-11-[(4-methyl-1-piperazinyl)acetyl]-6H-pyrido[2,3-b][1,4]benzodiazepin-6-one dihydrochloride, 6,11-Dihydro-11-((4-methyl-1-piperazinyl)acetyl)-5H-pyrido(2,3-b)(1,4)benzodiazepin-6-on dihydrochlorid, pircfar, CHEBI:32014, 11-(2-(4-methylpiperazin-1-yl)acetyl)-5H-benzo[e]pyrido[3,2-b][1,4]diazepin-6(11H)-one dihydrochloride, 11-[2-(4-methylpiperazin-1-yl)acetyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one dihydrochloride, 5,11-Dihydro-11-((4-methylpiperazin-1-yl)acetyl)-6H-pyrido(2,3-b)(1,4)benzodiazepin-6-one dihydrochloride, 6H-Pyrido(2,3-b)(1,4)benzodiazepin-6-one, 5,11-dihydro-11-((4-methyl-1-piperazinyl)acetyl)-, dihydrochloride, SR-01000000220, Prestwick_400, 5,11-Dihydro-11-, AC1L2G3Q, AC1Q3B3J, Pirenzepine, Dihydrochloride, SCHEMBL41704, SPECTRUM1501138, C19H21N5O2.2HCl, CHEMBL1531864, CTK8G2443, KS-00000GXM, C19H21N5O2.HCl.H2O, Pirenzepine hydrochloride (USAN), FFNMBRCFFADNAO-UHFFFAOYSA-N, MolPort-003-666-363, HMS1568I20, HMS1921J05, BCP12435, Tox21_500962, BG0383, CCG-38974, GP0823, LS 519, MFCD00055214, AKOS024456369, CS-6975, LP00962, LS-519-C12, NCGC00094263-01, NCGC00094263-02, NCGC00094263-03, NCGC00261647-01, AK162585, AN-14256, AS-15182, CC-33823, HY-17037, O383, LS-133129, B6582, EU-0100962, FT-0619757, ST24048937, D01297, M-1036, P 7412, 868P971, J-017673, Pirenzepine dihydrochloride, >=98% (TLC), powder, SR-01000000220-2, SR-01000000220-4, SR-01000000220-7, [(4-methyl-1-piperazinyl)acetyl]-6H-pyrido[2,3-b][1,4]benzodiazepin-6-one dihydrochloride, (5,11-Dihydro-11-[(4-methyl-1-piperazinyl)-acetyl]-6H-pyrido[2,3-b][1,4]benzodiazepin-6-one), 5,11-Dihydro-11-[(4-methyl-1-piperazinyl)-acetyl]-6H-pyrido[2,3-b][1,4]benzodiazepin-6-one, 6H-Pyrido(2,3-b)(1,4)benzodiazepin-6-one, 5,11-dihydro-11-((4-methyl-1-piperazinyl)acetyl)-,dihydrochloride, AKOS015896140, I06-1655, 11-[(4-methylpiperazin-1-yl)acetyl]-5,11-dihydro-6H-pyrido[2,3-b][1,4]benzodiazepin-6-one dihydrochloride


ID: 575

chemical graph of compound 575



InChIKey: FFWOKTFYGVYKIR-UHFFFAOYSA-N
SMILES: CC1=CC(=C2C(=C1)C(=O)C3=CC(=CC(=C3C2=O)O)OC)O

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 10639
synonyms found at PubChem are:
Physcion, 521-61-9, Physcione, Parietin, Rheochrysidin, Emodin 3-methyl ether, 1,8-Dihydroxy-3-methoxy-6-methylanthraquinone, 1,8-dihydroxy-3-methoxy-6-methylanthracene-9,10-dione, NSC 251670, Emodin monomethyl ether, Emodin-3-methyl ether, Methoxyemodin, Parienin, UNII-H6PT94IV61, 1,8-Dihydroxy-3-methyl-6-methoxyanthraquinone, CCRIS 4399, 1,8-Dihydroxy-3-methoxy-6-methyl-9,10-anthracenedione, EINECS 208-315-7, Rheochrysidin (Physcione), NSC251670, BRN 1915778, 1,8-Dihydroxy-3-methyl-6-methoxy-9,10-anthraquinone, CHEMBL42624, H6PT94IV61, ANTHRAQUINONE, 1,8-DIHYDROXY-3-METHOXY-6-METHYL-, 1,8-Dihydroxy-3-methoxy-6-methyl-anthraquinone, Q-100587, 1,8-dihydroxy-3-methoxy-6-methyl-anthracene-9,10-dione, 9,10-Anthracenedione, 1,8-dihydroxy-3-methoxy-6-methyl-, fischione, rheochrysidi), Physcion(e), Physcion,(S), Spectrum_001782, 9,10-dione, SpecPlus_000471, AC1L1VMS, PHYSCION (SENNA), Spectrum2_000503, Spectrum3_001829, Spectrum4_000909, Spectrum5_001742, Rheochrysidin - Physcione, BSPBio_003477, KBioGR_001378, KBioSS_002265, Physcion, analytical standard, DivK1c_006567, SCHEMBL486155, SPECTRUM1504070, SPBio_000425, MEGxm0_000018, CHEBI:38167, CTK8E3154, KBio1_001511, KBio2_002264, KBio2_004832, KBio2_007400, KBio3_002981, DTXSID20200101, FFWOKTFYGVYKIR-UHFFFAOYSA-N, MolPort-000-165-355, HMS3656I15, Physcion, >=98.0% (TLC), KS-00000NK5, ZINC3978794, BDBM50005886, CCG-38713, CP-228, CP0083, MFCD00017374, s2395, AKOS015905689, AC-7979, AN-8462, KS-5385, LS-2148, NSC-251670, RL03921, SDCCGMLS-0066772.P001, NCGC00096075-01, NCGC00096075-02, NCGC00096075-03, 9, 1,8-dihydroxy-3-methoxy-6-methyl-, AJ-47575, AK160252, AS-15488, BC216289, NCI60_002011, P564, SC-46573, AX8008593, TR-018534, FT-0657510, N1853, ST24048914, 1,8-dihydroxy-3-methoxy-6-methylanthracene-, 1,8-dihydroxy-6-methoxy-3-methylanthraquinone, Anthraquinone,8-dihydroxy-3-methoxy-6-methyl-, C17045, 521P619, A828949, SR-05000002537, SR-05000002537-1, 8,9-dihydroxy-3-methyl-6-methoxy-1,10-anthraquinone, 8,9-dihydroxy-6-methyl-3-methoxy-1,10-anthraquinone, BRD-K67772619-001-03-6, Physcion; Physcione; Parietin; Emodin 3-methyl ether, 1,8-Dihydroxy-3-methoxy-6-methylanthra-9,10-quinone #, 3-methoxy-6-methyl-1,8-bis(oxidanyl)anthracene-9,10-dione, 9,10-Anthracenedione, 1,8-dihydroxy-3-methoxy-6-methyl- (9CI)


ID: 576

chemical graph of compound 576



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

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 73416
synonyms found at PubChem are:
EVOXINE, NSC94653, 522-11-2, CHEBI:4952, 1-[(4,8-dimethoxyfuro[2,3-b]quinolin-7-yl)oxy]-3-methylbutane-2,3-diol, 2,3-Butanediol, 1-((4,8-dimethoxyfuro(2,3-b)quinolin-7-yl)oxy)-3-methyl-, (+)-, 1-(4,8-dimethoxyfurano[2,3-b]quinolin-7-yloxy)-3-methylbutane-2,3-diol, 1-(4,8-dimethoxyfuro[2,3-b]quinolin-7-yl)oxy-3-methyl-butane-2,3-diol, Haplophytin B, 2,3-Butanediol, 1-[(4,8-dimethoxyfuro[2,3-b]quinolin-7-yl)oxy]-3-methyl-, (+)-, Prestwick_160, NSC 94653, Spectrum_001734, SpecPlus_000604, AC1L2JTP, Prestwick0_000665, Prestwick1_000665, Prestwick2_000665, Spectrum2_001625, Spectrum3_000985, Spectrum4_001111, Spectrum5_001911, CBMicro_015580, C10670, Cambridge id 5255766, BSPBio_002649, KBioGR_001582, KBioSS_002214, MLS000104988, DivK1c_006700, SPECTRUM1504020, SPBio_001689, SPBio_002650, AC1Q4Y62, CHEMBL1416006, SCHEMBL10200371, CTK4J5605, KBio1_001644, KBio2_002214, KBio2_004782, KBio2_007350, KBio3_001869, 2,3-Butanediol,1-[(4,8-dimethoxyfuro[2,3-b]quinolin-7-yl)oxy]-3-methyl-, (2R)-, MolPort-002-507-400, HMS1570E11, HMS2330P21, HMS3373D19, BBL028782, CCG-38745, NSC-94653, STL372642, AKOS005224064, MCULE-3132893909, SDCCGMLS-0005807.P002, (+)-1-((4,8-Dimethoxyfuro(2,3-b)quinolin-7-yl)oxy)-3-methyl-2,3-butanediol, NCGC00017284-02, NCGC00017284-03, NCGC00017284-04, NCGC00017284-05, NCGC00087752-02, NCGC00087752-03, 4CN-1332, NCI60_042106, SMR000054917, ST005174, BIM-0015493.P001, SR-01000624769, SR-01000624769-3, BRD-A99268498-001-03-5, BRD-A99268498-001-06-8, 1-(4,8-dimethoxyfuro[2,3-b]quinolin-7-yl)oxy-3-methylbutane-2,3-diol, 1-[(4,8-dimethoxyfuro[2,3-b]quinolin-7-yl)oxy]-3-methyl-2,3-butanediol


ID: 577

chemical graph of compound 577



InChIKey: FGICTAQFCLUOBH-UHFFFAOYSA-N
SMILES: CN(C1=CC(=O)C=CC1=O)NO

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 5353574
synonyms found at PubChem are:
dephostatin, 151606-30-3, 2-(Methylnitrosoamino)-1,4-benzenediol, 1,4-Benzenediol, 2-(methylnitrosoamino)-, 2-[(hydroxyamino)-methylamino]cyclohexa-2,5-diene-1,4-dione, Lopac-D-8065, AC1NS4C2, Lopac0_000403, CHEMBL269733, SCHEMBL3893046, SCHEMBL12305062, CTK8E8374, HMS3261A08, ZINC3872250, 2-(N-methyl-N-nitroso)hydroquinone, Tox21_500403, HSCI1_000163, AKOS006271953, 2-(N-methyl-N-nitroso)-hydro-quinone, CCG-204496, LP00403, 1,4-Dihydroxy-N-methyl-N-nitrosoaniline, NCGC00015372-01, NCGC00015372-02, NCGC00015372-03, NCGC00015372-04, NCGC00093830-01, NCGC00093830-02, NCGC00261088-01, 1,4-Benzenediol,2-(methylnitrosoamino)-, KB-49655, LS-30000, 1,4-Dihydroxy-N-methyl-N-nitroso-aniline, RT-012251, D8065, EU-0100403, FT-0694317, D 8065, N-(2,5-dihydroxyphenyl)-N-methylnitrous amide, SR-01000075834, J-008825, SR-01000075834-1


ID: 578

chemical graph of compound 578



InChIKey: FGNUNVVTHHKDAM-UHFFFAOYSA-N
SMILES: C1CNCC(=C1)C(=O)O.Cl

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 11957555
synonyms found at PubChem are:
Guvacine hydrochloride, 6027-91-4, 1,2,5,6-tetrahydropyridine-3-carboxylic acid hydrochloride, 1,2,5,6-Tetrahydro-pyridine-3-carboxylic acid hydrochloride, MLS000859975, SR-01000075614, SMR000326834, Guvacine HCl, SPECTRUM1502126, SCHEMBL1057880, CHEMBL1256362, CTK7I6002, FGNUNVVTHHKDAM-UHFFFAOYSA-N, MolPort-003-665-602, ZX-CM014693, Tox21_500571, 8985AB, ACM498964, ANW-67778, BN0243, CCG-38871, MFCD00055191, AKOS015849631, AKOS025243938, LP00571, MCULE-9382105537, TRA0072680, NCGC00093955-01, NCGC00093955-02, NCGC00093955-03, NCGC00261256-01, CS-13242, EN000938, AX8236874, HY-100809, KB-123426, TR-020835, B6229, CS-0020452, EU-0100571, FT-0669083, G-007, Y1163, Guvacine hydrochloride, >=97% (NMR), solid, 1,2,5,6-Tetrahydronicotinic acid hydrochloride, Z-2043, GUVACINE HYDROCHLORIDE >96% \ GABA UPTAK, GUVACINE HYDROCHLORIDE gt96% \ GABA UPTAK, SR-01000075614-1, SR-01000075614-3, SR-01000075614-6, 1,2,5,6-Terahydropyridine-3-carboxylic acid hydrochloride, 1,2,5,6-tetrahydro-3-pyridinecarboxylic acid, hydrochloride salt


ID: 579

chemical graph of compound 579



InChIKey: FHHSEFRSDKWJKJ-UHFFFAOYSA-N
SMILES: COC1=C(C=C2C(=C1O)C(=O)C=C(O2)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:

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


CID is 5317284
synonyms found at PubChem are:
6-Methoxyluteolin, 520-11-6, Nepetin, EUPAFOLIN, 2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-6-methoxy-4H-chromen-4-one, Eurafolin, UNII-I3O7LF3GED, I3O7LF3GED, CHEMBL172350, NSC122416, 4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-6-methoxy-, 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-6-methoxychromen-4-one, SMR000440634, Pedaltin, NSC 122416, AC1NSVCV, D03MLC, MLS000728561, MLS000877025, SCHEMBL828390, MEGxp0_000458, ACon1_000516, BDBM23412, cid_5317284, DTXSID10199959, FHHSEFRSDKWJKJ-UHFFFAOYSA-N, MolPort-000-774-377, REGID_for_CID_5317284, HMS2218H11, ZINC5998557, 7300AB, LMPK12111230, AKOS016009654, MCULE-7564407072, VA10871, NCGC00163594-01, NCGC00163594-02, NCGC00169005-01, AJ-55455, AK111278, Flavone,4',5,7-tetrahydroxy-6-methoxy-, ST081374, 6-methoxy 5,7,3',4'-tetrahydroxyflavone, AX8109560, KB-221429, 4CH-024481, FT-0632276, ST24039237, Flavone, 3',4',5,7-tetrahydroxy-6-methoxy-, A828884, C-19474, SR-01000777526, SR-01000777526-3, BRD-K05728858-001-01-7, Flavone, 3',4',5,7-tetrahydroxy-6-methoxy- (8CI), 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-6-methoxy-chromen-4-one, 4H-1-Benzopyran-4-one,4-dihydroxyphenyl)-5,7-dihydroxy-6-methoxy-, 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-6-methoxy-1-benzopyran-4-one, 2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-6-methoxy-4H-chromen-4-one #, 2-[3,4-bis(oxidanyl)phenyl]-6-methoxy-5,7-bis(oxidanyl)chromen-4-one, 4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-6-methoxy- (9CI)


ID: 580

chemical graph of compound 580



InChIKey: FHIKZROVIDCMJA-UHFFFAOYSA-N
SMILES: CCCC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)OCCN(CC)CC.Cl

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 65341
synonyms found at PubChem are:
Proadifen hydrochloride, 62-68-0, Proadifen HCl, Propyladiphenin, SKF-525A hydrochloride, SKF 525A, Proadifen (hydrochloride), SK&F 525-A, RP 5171, Proadifen hydrochloride [USAN], UNII-30624AA6X2, SKF 525-A, NSC 39690, U 5446, NSC 170997, SKF-525A, Hydrochloride, 5171 RP, 2-Diethylaminoethyl 2,2-diphenylvalerate hydrochloride, 2-(Diethylamino)ethyl-2,2-diphenylvalerate hydrochloride, AI3-22677, 2'-Diethylaminoethyl 2,2-diphenylpentanoate hydrochloride, SKF-525A, 5171 R. P., Diethylaminoethanol ester of diphenylpropylacetic acid hydrochloride, 30624AA6X2, beta-Diethylaminoethyl diphenylpropylacetate hydrochloride, Proafiden hydrochloride, NCGC00094220-02, 2-Diethylaminoethyl alpha,alpha-diphenyl valerate hydrochloride, Pentanoic acid, 2,2-diphenyl-, 2-(N,N-diethylamino)ethyl ester, hydrochloride, Benzeneacetic acid, alpha-phenyl-alpha-propyl-, 2-(diethylamino)ethyl ester hydrochloride, DSSTox_CID_25792, DSSTox_RID_81133, DSSTox_GSID_45792, Proadifen hydrochloride (USAN), 2-(diethylamino)ethyl 2,2-diphenylpentanoate hydrochloride, Valeric acid, 2,2-diphenyl-, 2-(diethylamino)ethyl ester, hydrochloride, WLN: 3XR&R&VO2N2&2 &GH, Benzeneacetic acid, alpha-phenyl-alpha-propyl-, 2-(diethylamino)ethyl ester, hydrochloride, Benzeneacetic acid, alpha-phenyl-alpha-propyl-, 2-(diethylamino)ethyl ester, monohydrochloride, SMR000326771, NSC39690, NSC170997, CAS-62-68-0, SR-01000075627, .beta.-Diethylaminoethyl diphenylpropylacetate hydrochloride, .beta.-Diethylaminoethyldiphenylpropylacetate hydrochloride, 2-(diethylamino)ethyl 2,2-diphenylpentanoate;hydrochloride, C23H31NO2.ClH, Benzeneacetic acid, 2-(diethylamino)ethyl ester hydrochloride, Valeric acid,2-diphenyl-, 2-(diethylamino)ethyl ester hydrochloride, Valeric acid,2-diphenyl-, 2-diethylaminoethyl ester, hydrochloride, Pentanoic acid,2-diphenyl, 2-(N,N-diethylamino)ethyl ester, hydrochloride, 2-(Diethylamino)ethyl 2,2-diphenylvalerate hydrochloride, Prestwick_124, 2-Diethylaminoethyl .alpha.,.alpha.-diphenyl valerate hydrochloride, Proadifen(hydrochloride), PROADIFENHYDROCHLORIDE, MLS000859910, MLS002222169, SCHEMBL122629, SPECTRUM1502084, SKF-525A HCl (Proadifen), CHEMBL347036, 302-33-0 (Parent), DTXSID1045792, CTK8G3113, KS-00001FBK, SK&F-525A, AOB5207, MolPort-002-218-942, [SKF-525A], HMS1570K18, HMS1921J04, Pharmakon1600-01502084, AC1L2331, HY-B1311, SK & F 525A, Tox21_111260, Tox21_500906, 2670AH, CCG-39663, MFCD00055151, NSC-39690, NSC758181, AKOS024463904, Tox21_111260_1, CS-4907, LP00906, MCULE-3342860303, NSC-170997, NSC-758181, RP-5171, NCGC00015799-06, NCGC00094220-01, NCGC00094220-03, NCGC00094220-04, NCGC00094220-05, NCGC00261591-01, AK161755, 5171 R. P, AX8149084, LS-161094, N,N-Diethylaminoethyl 2,2-diphenylvalerate, 4CH-023228, EU-0100906, FT-0603261, ST24049038, VU0244505-3, D05614, C-21528, Proadifen hydrochloride, analytical standard, >=95%, SR-01000075627-1, SR-01000075627-6, 2-diethylaminoethyl-2,2-diphenylvalerate hydrochloride, 2-diethylaminoethyl 2,2-diphenylpentanoate hydrochloride, Pentanoic acid,2,2-diphenyl-,diethylaminoethyl ester, hydrochloride, alpha-Phenyl-alpha-propylbenzeneacetic acid 2-(diethylamino)ethyl ester, Benzeneacetic acid, a-phenyl-a-propyl-, 2-(diethylamino)ethylester, hydrochloride (1:1), N,N- paragraph signthornOO degrees +/-OO>>u-2,2- paragraph signthorn+/-(1/2)IiEao yen, AKOS026750150


ID: 581

chemical graph of compound 581



InChIKey: FHIVAFMUCKRCQO-UHFFFAOYSA-N
SMILES: CCOP(=S)(OCC)OC1=NC(=NC(=C1)C)C(C)C

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 3017
synonyms found at PubChem are:
diazinon, Dimpylate, 333-41-5, Diazinone, Oleodiazinon, Neocidol, Ciazinon, Dassitox, Diazitol, Ektoband, Nedcidol, Spectracide, Antigal, Basudin, Bazuden, Dacutox, Dazzel, Diazide, Diazol, Exodin, Flytrol, Galesan, Nucidol, Sarolex, Dicid, Alfa-tox, Diazajet, Dimpylat, Garden Tox, Neocidol (oil), Bassadinon, Terminator, Compass, Disonex, Dizinon, Drawizon, Kayazinon, Kayazol, Meodinon, Dyzol, Nipsan, Diazinon ag 500, Knox-out, Delzinon, Dimpylatum, Dipofene, Dizictol, Neodinon, Optimizer, Bazudin, Dizinil, Srolex, Basudin 10 G, Geigy 24480, Basudin S, Knox Out 2FM, Bazudine, Diagran, Fezudin, Neotsidol, NCI-C08673, Kleen-Dok, AG-500, ENT 19,507, Isopropylmethylpyrimidyl diethyl thiophosphate, G-24480, KFM Blowfly Dressing, Compass (insecticide), Caswell No. 342, gardentox, Diziktol, Diaterr-fos, Dimpylatum [INN-Latin], O,O-Diethyl 2-isopropyl-4-methylpyrimidyl-6-thiophosphate, Cooper's Flystrike Powder, Dimpilato [INN-Spanish], NSC 8938, G 301, O,O-Diethyl O-(2-isopropyl-6-methyl-4-pyrimidinyl) phosphorothioate, UNII-YUS1M1Q929, Dimpylate [INN], Diazinon [ANSI:BSI:ISO], CCRIS 204, Diethyl 4-(2-isopropyl-6-methylpyrimidinyl)phosphorothionate, O-2-Isopropyl-4-methylpyrimidyl-O,O-diethyl phosphorothioate, HSDB 303, Knox Out Yellow Jacket Contorl, O,O-Diethyl O-(2-isopropyl-4-methyl-6-pyrimidyl) thionophosphate, CHEBI:34682, O,O-Diethyl O-6-methyl-2-isopropyl-4-pyrimidinyl phosphorothioate, OMS 469, EINECS 206-373-8, PT 265, EPA Pesticide Chemical Code 057801, Phosphorothioate, O,O-diethyl O-6-(2-isopropyl-4-methylpyrimidyl), BRN 0273790, Thiophosphate de O,O-diethyle et de O-2-isopropyl-4-methyl-6-pyrimidyle, 4-Pyrimidinol, 2-isopropyl-6-methyl-, O-ester with O,O-diethyl phosphorothioate, AI3-19507, Phosphorothioic acid, O,O-diethyl O-(6-methyl-2-(1-methylethyl)-4-pyrimidinyl) ester, YUS1M1Q929, Diethyl 2-isopropyl-4-methyl-6-pyrimidinyl phosphorothionate, NSC8938, Dimpylate (INN), O,O-Diethyl-O-(2-isopropyl-4-methyl-pyrimidin-6-yl)-monothiofosfaat, G 24480, Phosphorothioic acid, O,O-diethyl O-(2-isopropyl-6-methyl-4-pyrimidinyl) ester, Diethyl 2-isopropyl-4-methyl-6-pyrimidyl thionophosphate, NCGC00091073-01, O,O-Diethyl 2-isopropyl-6-methyl-4-pyrimidinylphosphorothioate, DSSTox_CID_407, O,O-Diethyl O-(2-isopropyl-6-methyl-4-pyrimidinyl)phosphorothioate, O,O-Diethyl-O-(2-isopropyl-4-methyl-6-pyrimidyl)phosphorothioate, Thiophosphoric acid 2-isopropyl-4-methyl-6-pyrimidyl diethyl ester, O,O-Diethyl O-(2-isopropyl-4-methyl-6-pyrimidinyl) phosphorothioate, O,O-diethyl O-[6-methyl-2-(1-methylethyl)pyrimidin-4-yl] thiophosphate, O,O-Diethyl-O-(2-isopropyl-4-methyl-6-pyrimidinyl)-phosphorothioate, Phosphorothioic acid, O,O-diethyl O-(isopropylmethylpyrimidinyl) ester, O,O-Diaethyl-O-(2-isopropyl-4-methyl)-6-pyrimidyl-thionophosphat [German], O,O-Diaethyl-O-(2-isopropyl-4-methyl-pyrimidin-6-yl)-monothiophosphat [German], O,O-Diethyl O-(6-methyl-2-(1-methylethyl)-4-pyrimidinyl)phosphorothioate, O,O-Diethyl-O-(2-isopropyl-4-methyl-pyrimidin-6-yl)-monothiofosfaat [Dutch], O,O-Dietil-O-(2-isopropil-4-metil-pirimidin-6-il)-monotiofosfato [Italian], DSSTox_RID_75567, Phosphorothioic acid, O,O-diethyl O-[6-methyl-2-(1-methylethyl)-4-pyrimidinyl] ester, Thiophosphate de O,O-diethyle et de O-2-isopropyl-4-methyl-6-pyrimidyle [French], DSSTox_GSID_20407, Diazinon, analytical standard, Q-200952, Dimpilato, O,O-Diaethyl-O-(2-isopropyl-4-methyl-pyrinidin-6-yl)-monothiophosphat, O,O-Diethyl O-(2-isopropyl-4-methyl-6-pyrimidyl) phosphorothioate, diethoxy-(2-isopropyl-6-methyl-pyrimidin-4-yl)oxy-thioxo-$l^{5}-phosphane, CAS-333-41-5, Spertacide, Bazanon, Antlak, C12H21N2O3PS, Root guard, Fl ytrol, Diazinon solution, Di aterr-fos, Knox Out, Diethyl dimpylatum, diethoxy-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxy-sulfanylidene-?^{5}-phosphane, Dimpylate, INN, Basudin 5G, Spectracide 25EC, Agridin 60, Basudin 10G, 250MG - Diazinon, Spectrum_001777, Dimpylate [INN:BAN], New Z Diazinon (TN), SpecPlus_000344, AC1L1EZH, Spectrum2_001226, Spectrum3_000802, Spectrum4_000642, Spectrum5_001929, Optimizer Insecticide (TN), SCHEMBL17453, BSPBio_002263, KBioGR_000983, KBioSS_002258, 5-23-11-00187 (Beilstein Handbook Reference), MLS002207243, BIDD:ER0457, DivK1c_006440, SPBio_001072, CHEMBL388560, ZINC1309, DTXSID9020407, CTK1C2496, FHIVAFMUCKRCQO-UHFFFAOYSA-, KBio1_001384, KBio2_002257, KBio2_004825, KBio2_007393, KBio3_001763, FHIVAFMUCKRCQO-UHFFFAOYSA-N, HMS3264I04, Pharmakon1600-00330017, EBD29972, HY-B1113, NSC-8938, O,O-Diaethyl-O-(2-isopropyl-4-methyl)-6-pyrimidyl-thionophosphat, o,o-diethyl o-2-isopropyl-6-methylpyrimidin-4-yl phosphorothioate, Tox21_111077, Tox21_201409, Tox21_300730, ACM333415, BDBM50005409, CCG-39143, ENT 19507, NSC755893, O,O-Diaethyl-O-(2-isopropyl-4-methyl-pyrimidin-6-yl)-monothiophosphat, O,O-Dietil-O-(2-isopropil-4-metil-pirimidin-6-il)-monotiofosfato, Diazinon 10 microg/mL in Cyclohexane, AKOS025311513, Tox21_111077_1, CS-4712, Diazinon 10 microg/mL in Acetonitrile, Diazinon 100 microg/mL in Cyclohexane, LS-1209, NSC-755893, PST0000180, Diazinon 100 microg/mL in Acetonitrile, Phosphorothioic acid O,O-diethyl O-[6-methyl-2-(1-methylethyl)-4-pyrimidinyl] ester, NCGC00091073-02, NCGC00091073-03, NCGC00091073-04, NCGC00091073-05, NCGC00091073-06, NCGC00091073-07, NCGC00254636-01, NCGC00258960-01, AN-44362, BC225665, CC-26452, SMR000777921, ZB000307, SBI-0052498.P002, DB-048387, Diazinon, PESTANAL(R), analytical standard, FT-0603088, C14324, D07856, AB00053004_04, 333D415, C-18970, SR-01000872734, SR-01000872734-1, BRD-K60567437-001-04-5, Diazinon, certified reference material, TraceCERT(R), 4-Pyrimidinol, O-ester with O,O-diethyl phosphorothioate, WLN: T6N CNJ BY1 & 1 DOPS & O2 & O2 F1, Diethyl 2-isopropyl-4-met hyl-6-pyrimidyl thionophosphate, O, O-Diethyl 2-isopropyl-4-methylpyrimidyl-6-thiophosphate, O,O-Diethyl-O-(2-isopropyl-4-methylpyrimidyl)thiophosphate, diethyl 2-isopropyl-6-methyl-4-pyrimidinyl phosphorothionate, O,O-diethyl O-2-isopropyl-4-methyl-6-pyrimidyl thiophosphate, o,o-Dietil-o-(2-isopropil-4-metil-pirimidin-il)-monotiofosato, Phosphorothioate,O-diethyl O-6-(2-isopropyl-4-methylpyrimidyl), Diethyl O-(2-isopropyl-6-methyl-4-pyrimidinyl) phosphorothioate, O,O-Diethyl O-(2-isopropyl-6-methyl-4-primidinyl)phosphorothioate, O,O-Diethyl O-(2-isopropyl-6-methyl-4-pyrimidinyl) thiophosphate, O,O-Diethyl o-(2-isopropyl-6-methyl-4-pyrimidinyl) thiophosphate #, O,O-diethyl O-(2-isopropyl-6-methylpyrimidin-4-yl) thiophosphate, O,O-Diethyl-O-(2-isopropyl-4-methyl-6-pyrimidyl) thiophosphate, diethoxy-(6-methyl-2-propan-2-ylpyrimidin-4-yl)oxy-sulfanylidenephosphorane, Diethoxy-[(2-isopropyl-6-methyl-4-pyrimidinyl)oxy]-thioxophosphorane, O,O-Diethyl O-(2-isopropyl-4-methyl-6-pyrimidinyl) thiophosphoric acid, O,O-Diethyl O-(2-isopropyl-6-methyl-4-pyrimidinyl), phosphorothioa te, O,O-Diethyl O-(2-isopropyl-6-methyl-4-pyrimidinyl), phosphorothioate, O,O-Diethyl O-(6-methyl-2-(1-methylethyl)-4-pyrimidinyl) phosophorothioate, O,O-diethyl O-(6-methyl-2-(1-methylethyl)-4-pyrimidinyl) phosphorothioate, O,O-diethyl O-[6-methyl-2-(propan-2-yl)pyrimidin-4-yl] phosphorothioate, o,o-Diethyl-O-(6-methyl-2-(1-methylethyl)-4-pyrimidinyl)phosophorothioate, Phosphorothioic acid, O,O-diethyl 2-isopropyl-6-methyl-4-pyrimidinyl ester, Phosphorothioic acid,O-diethyl O-(2-isopropyl-6-methyl-4-pyrimidinyl) ester, Diazinon solution, 100 mug/mL in acetonitrile, PESTANAL(R), analytical standard, ethyl 6-methyl-2-(propan-2-yl)pyrimidin-4-yl ethoxy(sulfanylidene)phosphonite, Phosphorothioc Acid O,O-Diethyl O-[6-Methyl-2-(1-methylethyl)-4-pyrimidinyl] Ester, Phosphorothioic acid O,O-diethyl O-[6-methyl- 2-(1-methylethyl)-4-pyrimidinyl] ester, Phosphorothioic acid, O,O-diethyl {O-[6-methyl-2-(1-methylethyl)-4-pyrimidinyl]} ester, PHOSPHOROTHIOIC ACID,O-DIETHYL O-[6-METHYL-2-(1-METHYLETHYL)-4-PYRIMIDINYL] ESTER, 27936-40-9, 30583-38-1, 65863-03-8, InChI=1/C12H21N2O3PS/c1-6-15-18(19,16-7-2)17-11-8-10(5)13-12(14-11)9(3)4/h8-9H,6-7H2,1-5H3, O,O-Diethyl O-2-isopropyl-4-methyl-6-pyrimidyl thiophosphate; O,O-Diethyl O-(6-methyl-2-(1-methylethyl)-4-pyrimidinyl) phosophorothioate


ID: 582

chemical graph of compound 582



InChIKey: FHYWNBUFNGHNCP-UHFFFAOYSA-N
SMILES: CC1=CC=CC(=C1)C2CN(CCC3=C(C(=C(C=C23)O)O)Cl)C.Br

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 11957685
synonyms found at PubChem are:
SKF 83959 hydrobromide, SKF-83959 hydrobromide, 67287-95-0, CHEBI:63996, 6-chloro-7,8-dihydroxy-3-methyl-1-(3-methylphenyl)-2,3,4,5-tetrahydro-1H-3-benzazepine hydrobromide, 80751-85-5, CHEMBL520992, 6-chloro-3-methyl-1-(3-methylphenyl)-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol hydrobromide, SR-01000076126, EU-0101067, 6-CHLORO-2,3,4,5-TETRAHYDRO-3-METHYL-1-(3-METHYLPHENYL)-1H-3-BENZAZEPINE-7,8-DIOL HYDROBROMIDE, MLS002153381, DTXSID9042629, SCHEMBL12610614, CTK8G3112, MolPort-003-959-525, Tox21_501067, BN0488, MFCD03792727, AKOS024456929, API0007826, CCG-222371, LP01067, SKF-83,959, NCGC00094346-01, NCGC00261752-01, 1H-3-Benzazepine-7,8-diol, 6-chloro-2,3,4,5-tetrahydro-3-methyl-1-(3-methylphenyl)-, hydrobromide, 1H-3-Benzazepine-7,8-diol, 6-chloro-2,3,4,5-tetrahydro-3-methyl-1-(3-methylphenyl)-, hydrobromide (1:1), LS-27995, SMR001230770, S 2816, SKF-83959 hydrobromide, >=98% (HPLC), solid, SR-01000076126-2, SR-01000076126-3, 6-Chloro-2,3,4,5-tetrahydro-3-methyl-1-(3-methylphenyl)-1H-3-benzazepine-7,8-diol, 6-chloro-7,8-dihydroxy-3-methyl-1-(3-methylphenyl)-2,3,4,5-tetrahydro-1H-3-benzazepinium bromide, N-methyl-6-chloro-1-(3-methylphenyl)-2,3,4,5-tetrahydro-3-benzazepine-7,8-diol hydrobromide


ID: 583

chemical graph of compound 583



InChIKey: FIKFLLIUPUVONI-UHFFFAOYSA-N
SMILES: C1CN(CCC12CNC(=O)O2)CCC3=CC=CC=C3.Cl

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 68626
synonyms found at PubChem are:
Fenspiride hydrochloride, Fenspiride HCl, 5053-08-7, Decaspiride, Fluiden, Pneumorel, Fenspiride (Hydrochloride), Espiran, Tegencia hydrochloride, Viarespan hydrochloride, NDR-5998A, NAT-333, JP 428, UNII-832NBX878V, Fenspiride hydrochloride [USAN], 832NBX878V, 8-(2-Phenylethyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one hydrochloride, EINECS 225-752-9, NCGC00093898-02, DSSTox_CID_25770, DSSTox_RID_81112, DSSTox_GSID_45770, Fenspiride hydrochloride (USAN), 8-Phenethyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one hydrochloride, Phenethyl-8-oxa-1-diaza-3,8-spiro(4,5)decanone-2-hydrochloride, 8-Phenethyl-1-oxa-3,8-diazaspiro(4.5)decan-2-one monohydrochloride, 1-Oxa-3,8-diazaspiro(4.5)decan-2-one, 8-phenethyl-, monohydrochloride, 8-(2-Phenylethyl)-1-oxa-3,8-diazaspiro(4.5)decan-2-one hydrochloride, 8-N-Fenetil-1-oxa-2-oxo-3,8-diazaspiro-(4,5)-decano cloridrato [Italian], Chlorhydrate de phenethyl-8-oxa-1-diaza-3,8-spiro(4,5)decanone-2 [French], 1-Oxa-3,8-diazaspiro(4,5)decan-2-one, 8-(2-phenylethyl)-, monohydrochloride, 1-Oxa-3,8-diazaspiro(4.5)decan-2-one, 8-(2-phenylethyl)-, monohydrochloride, CAS-5053-08-7, SR-01000075878, Decaspir, Erespal, Tegencia, zlchem 11, Prestwick_218, D0V8KI, AC1L2A4D, AC1Q3ES9, MLS001056735, C15H20N2O2.ClH, SCHEMBL613462, SPECTRUM1501021, CHEMBL1256849, DTXSID3045770, CTK4J2764, NDR 5998A, KSP-193, NAT 333, ZLA0013, MolPort-003-666-347, HMS1568L07, HMS1921D09, Pharmakon1600-01501021, BCP13398, HY-A0027, Tox21_111230, Tox21_500496, 2410AH, CCG-39014, MFCD00133315, NSC757825, s4090, 8-(2-phenylethyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one hydrochloride(1:1), AKOS027326501, Tox21_111230_1, API0002692, CS-0764, EBD3062809, LP00496, NSC-757825, NCGC00015438-07, NCGC00093898-01, NCGC00093898-03, NCGC00093898-04, NCGC00093898-05, NCGC00261181-01, LS-98946, SMR000326706, EU-0100496, D04163, F 6145, W-5078, 5053-08-7, 5053-06-5(free base), SR-01000075878-1, SR-01000075878-6, Fenspiride hydrochloride, analytical standard, for drug analysis, 8-N-Fenetil-1-oxa-2-oxo-3,8-diazaspiro-(4,5)-decano cloridrato, 8-phenethyl-4-oxa-2,8-diazaspiro[4.5]decan-3-one hydrochloride, Chlorhydrate de phenethyl-8-oxa-1-diaza-3,8-spiro(4,5)decanone-2, 8-(2-phenylethyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one,hydrochloride, 1-Oxa-3,8-diazaspiro[4.5]decan-2-one,8-(2-phenylethyl)-, hydrochloride (1:1), 2-OXAZOLIDINONE-5-SPIRO-4'-[N-(2-PHENYLETHYL)PIPERIDINE] HYDROCHLORIDE, SCHEMBL17006239, AKOS026749884


ID: 584

chemical graph of compound 584



InChIKey: FIMUDWRKPYKTJN-UHFFFAOYSA-N
SMILES: C1C[N+]2=CC=CC=C2N1.[Br-]

biological descriptors:

CFTR relevance: inactive

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

reference list:

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


CID is 44887158
synonyms found at PubChem are:
2,3-Dihydro-imidazo[1,2-a]pyridine Hydrobromide, AKOS027447857


ID: 585

chemical graph of compound 585



InChIKey: FIQGIOAELHTLHM-UHFFFAOYSA-N
SMILES: CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C3=CC=C(C=C3)OCC(=O)NCCN

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 5697
synonyms found at PubChem are:
Xanthine amine congener, Papaxac, 96865-92-8, XAC, [3H]xanthine amine congener, [3H]XAC, CHEMBL273094, 8-(4-((2-aminoethyl)aminocarbonylmethyloxy)phenyl)-1,3-dipropylxanthine, N-(2-aminoethyl)-2-[4-(2,6-dioxo-1,3-dipropyl-7H-purin-8-yl)phenoxy]acetamide, n-(2-aminoethyl)-2-[4-(2,6-dioxo-1,3-dipropyl-2,3,6,7-tetrahydro-1h-purin-8-yl)phenoxy]acetamide, Xanthine amine congener xac, 8-[4-[[[[(2-Aminoethyl)amino]carbonyl]methyl]oxy]phenyl]-1,3-dipropylxanthine, N-(2-aminoethyl)-2-(4-(2,6-dioxo-1,3-dipropyl-2,3,6,7-tetrahydro-1H-purin-8-yl)phenoxy)acetamide, Lopac-X-103, AC1L1KXN, AC1Q5PIP, D09HUM, D0H9BP, 8-(4-(((2-(4-Aminophenylacetylamino)ethyl)carbonyl)methyl)oxy)phenyl-1,3-dipropylxanthine, Lopac0_001279, GTPL404, GTPL432, SCHEMBL1000686, CTK8G3788, DTXSID10242595, FIQGIOAELHTLHM-UHFFFAOYSA-N, ZINC9210767, BDBM50207816, PDSP1_000319, PDSP1_000445, PDSP2_000317, PDSP2_000443, CCG-205352, LP01279, NCGC00016097-01, NCGC00016097-02, NCGC00016097-03, NCGC00016097-04, NCGC00094514-01, NCGC00094514-02, Xanthine amine congener, >=96% (HPLC), EU-0101279, X-103, L000963, SR-01000075243, SR-01000075243-1, 3,7-diethyl-9-(4-(N-2-aminoethylcarboxamidomethoxy))phenylxanthine, Xanthine, 8-[4-[(2-aminoethyl)aminocarbonyl]methoxyphenyl]-1,3-dipropyl, 8-[4-[[[[(2-Aminoethyl)amino] carbonyl]methyl]oxy]phenyl]-1,3-dipropylxanthine, XAC(8-[4-[[[[(2-Aminoethyl)amino] carbonyl]methyl]oxy]phenyl]-1,3-dipropylxanthine, Acetamide, N-(2-aminoethyl)-2-(4-(2,3,6,7-tetrahydro-2,6-dioxo-1,3-dipropyl-1H-purin-8-yl)phenoxy)-, N-(2-Amino-ethyl)-2-[4-(2,6-dioxo-1,3-dipropyl-2,3,6,7-tetrahydro-1H-purin-8-yl)-phenoxy]-acetamide, N-(2-Amino-ethyl)-2-[4-(2,6-dioxo-1,3-dipropyl-2,3,6,7-tetrahydro-1H-purin-8-yl)-phenoxy]-acetamide (xanthine amine congenere, XAC), N-(2-Amino-ethyl)-2-[4-(2,6-dioxo-1,3-dipropyl-2,3,6,7-tetrahydro-1H-purin-8-yl)-phenoxy]-acetamide(XAC), N-(2-Amino-ethyl)-2-[4-(2,6-dioxo-1,3-dipropyl-2,3,6,9-tetrahydro-1H-purin-8-yl)-phenoxy]-acetamide, N-(2-Aminoethyl)-2-[4-(2,3,6,7-tetrahydro-2,6-dioxo-1,3-dipropyl-1H-purin-8-yl)phenoxy]-acetamide hydrochloride, N-(2-Aminoethyl)-2-[4-(2,6-dioxo-1,3-dipropyl-2,3,6,9-tetrahydro-1H-purin-8-yl)phenoxy]acetamide #


ID: 586

chemical graph of compound 586



InChIKey: FIVHOHCAXWQPGC-UHFFFAOYSA-N
SMILES: CN(C)CCOC(=O)COC1=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:

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


CID is 19379
synonyms found at PubChem are:
Meclofenoxate hydrochloride, 3685-84-5, Centrophenoxine hydrochloride, Meclofenoxate HCl, Lucidril, Cerutil, Atsefen, Helfergin, Marucotol, Acefen, Brenal, Centrophenoxine, Centrofenoxin, Amipolen, Cellative, Proserout, Lutiaron, Meclophenoxate hydrochloride, Methoxynal, 235 Anp hydrochloride, Centrophenoxine (VAN), 2-(dimethylamino)ethyl 2-(4-chlorophenoxy)acetate hydrochloride, UNII-5BK3070BDY, Meclofenoxate (hydrochloride), Lucidryl hydrochloride, Dimethylaminoethyl p-chlorophenoxyacetate hydrochloride, NSC 4268, EINECS 222-975-3, 2-(dimethylamino)ethyl (4-chlorophenoxy)acetate hydrochloride, Chlorowodorki centrofenoksyna [Polish], NSC 113619, Dimethylaminoethyl 4-chlorophenoxyacetate hydrochloride, 5BK3070BDY, p-Chlorphenoxyessigsaeure-beta-dimethylaminoaethylesters [German], Dimethylaminoethyl ester of p-chlorophenoxyacetic acid hydrochloride, (p-Chlorophenoxy)acetic acid 2-(dimethylamino)ethyl ester hydrochloride, C12H16ClNO3, DSSTox_CID_25141, DSSTox_RID_80699, DSSTox_GSID_45141, 2-(Dimethylamino)ethyl (p-chlorophenoxy)acetate hydrochloride, 4-chlorophenoxy-acetic acid 2-(dimethylamino)ethyl ester hydrochloride, WLN: GR DO1VO2N1&1 &GH, 2-(4-Chlorophenoxy)acetic Acid 2-(Dimethylamino)ethyl Ester Hydrochloride, ACETIC ACID, (p-CHLOROPHENOXY)-, 2-DIMETHYLAMINOETHYL ESTER, HYDROCHLORIDE, SR-01000075788, NCGC00015279-02, CAS-3685-84-5, Acetic acid, 2-(dimethylamino)ethyl ester hydrochloride, Chlorowodorki centrofenoksyna, Methocynal, 2-(dimethylamino)ethyl 2-(4-chlorophenoxy)acetate;hydrochloride, (Dimethylamino)ethyl ester of (p-chlorophenoxy)acetic acid hydrochloride, Meclofenoxate hydrochloride [JAN], Centrophenoxine HCl, Lucidril (TN), Prestwick_978, PubChem23391, AC1Q3BLJ, Meclofenoxat hydrochloride, Acetic acid, (4-chlorophenoxy)-, 2-(dimethylamino)ethyl ester, hydrochloride, C12H17Cl2NO3, MLS002153989, SCHEMBL218322, SPECTRUM1503226, AC1L2E01, p-Chlorphenoxyessigsaeure-beta-dimethylaminoaethylesters, CHEMBL1256131, DTXSID8045141, CTK8F3645, NSC4268, HMS1570I08, HMS1922K09, Pharmakon1600-01503226, Centrophenoxine hydrochloride, 99%, BCP21567, Meclofenoxate (Centrophenoxine) HCl, Meclofenoxate hydrochloride (JP17), NSC-4268, Tox21_110123, Tox21_302398, Tox21_500250, CCG-39961, NSC113619, NSC758420, s4280, AKOS008968424, Tox21_110123_1, AC-1680, AN-6971, CS-2216, KS-1179, LP00250, MCULE-1367655174, NSC-113619, NSC-758420, NCGC00015279-08, NCGC00093712-01, NCGC00093712-02, NCGC00093712-03, NCGC00093712-04, NCGC00180932-01, NCGC00256151-01, NCGC00260935-01, BC213252, H907, HY-17555, LS-11345, SC-15165, SMR001233323, AB0013350, EU-0100250, FT-0603646, M2460, EN300-35717, C 8773, D02243, K-8196, I01-1863, SR-01000075788-1, SR-01000075788-5, SR-01000075788-6, W-106584, Dimethylaminoethyl 4-Clorophenoxyacetate Hydrochloride, Z57281900, 2-dimethylaminoethyl 2-(4-chlorophenoxy)acetate hydrochloride, Meclofenoxate Hydrochloride 1.0 mg/ml in Acetonitrile (as free base), Acetic acid, (4-chlorophenoxy)-, 2-(dimethylamino)ethyl ester, hydrochloride (9CI), 1334-20-9, AKOS026750100


ID: 587

chemical graph of compound 587



InChIKey: FIVPIPIDMRVLAY-RBJBARPLSA-N
SMILES: CN1C(=O)[C@]23CC4=CC=C[C@@H]([C@H]4N2C(=O)[C@]1(SS3)CO)O

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 6223
synonyms found at PubChem are:
gliotoxin, 67-99-2, Aspergillin, UNII-5L648PH06K, CCRIS 4025, Gliotoxin from Gliocladium fimbriatum, NSC 102866, BRN 0050675, AI3-62383, CHEBI:5385, CHEMBL331627, S.N. 12870, 5L648PH06K, Gliotoxin, Gladiocladium fimbriatum, 10H-3,10a-Epidithiopyrazino(1,2-a)indole-1,4-dione, 2,3,5a,6-tetrahydro-6-hydroxy-3-(hydroxymethyl)-2-methyl-, Gliotoxins, (3R,5aS,6S,10aR)-6-hydroxy-3-(hydroxymethyl)-2-methyl-2,3,6,10-tetrahydro-5aH-3,10a-epidithiopyrazino[1,2-a]indole-1,4-dione, 10H-3,10a-Epidithiopyrazino(1,2-a)indole-1,4-dione, 2,3,5a,6-hydroxy-3- (hydroxymethyl)-2-methyl-, (3R-(3-alpha,5a-beta,6-beta,10a-alpha))-, 2,3,5a,6-Tetrahydro-6-hydroxy-3(hyroxymethyl)-2-methyl-10H-3a,10a-epidithio-pyrazinol[1,2alpha]indole-1,4-dione, NSC102866, D0N1XD, SCHEMBL54420, BSPBio_001237, 4-27-00-08902 (Beilstein Handbook Reference), AC1L1M29, MolPort-008-268-260, ZX-AFC000329, HMS1792M19, HMS1990M19, HMS3403M19, PI129, ZINC3875454, BDBM50134315, CCG-35318, CCG-36058, MFCD00058534, AKOS024457211, QTL1_000040, NCGC00163466-01, NCGC00163466-02, LS-63988, C10595, C-46242, SR-05000002340, SR-05000002340-2, Gliotoxin solution, 100 mug/mL in acetonitrile, analytical standard, (3R,5aS,6S,10aR)-2,3,5a,6-Tetrahydro-6-hydroxy-3-(hydroxymethyl)-2-methyl-10H-3,10a-epidithiopyrazino[1,2-a]indole-1,4-dione, 6-Hydroxy-3-(hydroxymethyl)-2-methyl-2,3,6,10-tetrahydro-5aH-3,10a-epidithiopyrazino[1,2-a]indole-1,4-dione, 7-hydroxy-11-hydroxymethyl-12-methyl-14,15-dithia-9,12-diazatetracyclo[9.2.2.01,9.03,8]pentadeca-3,5-diene-10,13-dione


ID: 588

chemical graph of compound 588



InChIKey: FJDDSMSDZHURBJ-UHFFFAOYSA-N
SMILES: CC(=O)NCCC1=C(NC2=C1C=C(C=C2)OC)I

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 115348
synonyms found at PubChem are:
2-Iodomelatonin, 93515-00-5, 2-iodo-melatonin, n-[2-(2-iodo-5-methoxy-1h-indol-3-yl)ethyl]acetamide, 2-I-MLT, CHEMBL289233, N-(2-(2-Iodo-5-methoxy-1H-indol-3-yl)ethyl)acetamide, acetamide,n-[2-(2-iodo-5-methoxy-1h-indol-3-yl)ethyl]-, Acetamide, N-(2-(2-iodo-5-methoxy-1H-indol-3-yl)ethyl)-, (3beta)-, Acetamide, N-(2-(2-iodo-5-methoxy-1H-indol-3-yl)ethyl)-, SR-01000075935, Melatonin,2-Iodo, ML2, Tocris-0737, Lopac-I-1899, D08VEJ, D0H6YF, AC1L3GZ8, AC1Q5P6Z, Lopac0_000610, SCHEMBL163451, GTPL1343, BDBM29611, CTK8F4316, DTXSID30239462, CHEBI:109558, FJDDSMSDZHURBJ-UHFFFAOYSA-N, MolPort-003-983-480, HMS3266P03, ZINC2516056, BN0011, N-acetyl-2-iodo-5-methoxytriptamine, N-Acetyl-2-iodo-5-methoxytryptamine, PDSP1_001785, PDSP2_001768, AKOS024458623, CCG-204699, DB08190, LS-9790, NCGC00015552-01, NCGC00015552-02, NCGC00015552-03, NCGC00024758-01, NCGC00024758-02, KB-270628, B6428, EU-0100610, FT-0737435, A15343, I 1899, L000060, SR-01000075935-1, SR-01000075935-3, BRD-K25649279-001-01-2, N-[2-(2-IODO-5-METHOXYINDOL-3-YL)ETHYL]ACETAMIDE


ID: 589

chemical graph of compound 589



InChIKey: FJIKEFFDENQLIH-UHFFFAOYSA-M
SMILES: CC1=C2C=C(C(=CC2=CC3=[N+]1C=CC4=CC(=C(C=C43)OC)OC)OC)OC.O.[Cl-]

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 6419900
synonyms found at PubChem are:
Coralyne chloride hydrate, 1031265-39-0, Prestwick_129, AC1O4WG2, MLS002153808, SCHEMBL4022544, CHEMBL1444353, FJIKEFFDENQLIH-UHFFFAOYSA-M, MolPort-000-698-746, HMS1569G04, HMS2096G04, AKOS024374919, NCGC00017109-01, NCGC00017109-02, SMR001233180, CAS-38989-38-7, ST51014955, 2,3,10,11-tetramethoxy-8-methylisoquinolino[2,1-b]isoquinolin-7-ium chloride hydrate, 2,3,10,11-tetramethoxy-8-methylisoquinolino[2,1-b]isoquinoline, oxamethane, ch loride


ID: 590

chemical graph of compound 590



InChIKey: FJLBFSROUSIWMA-UHFFFAOYSA-N
SMILES: CC(C)(C1=CN=CC=C1)C(=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:

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


CID is 4174
synonyms found at PubChem are:
metyrapone, 54-36-4, Metopirone, 2-Methyl-1,2-di-3-pyridyl-1-propanone, Methopyrapone, Metopiron, Methapyrapone, Methopirapone, Methopyrinine, Methopyrone, Metyrapon, Methbipyranone, Metopyrone, Mepyrapone, Metroprione, Metapirone, Metapyron, Metirapona, Metyraponum, Su 4885, Metapyrone, 1-Propanone, 2-methyl-1,2-di-3-pyridinyl-, Metyraponum [INN-Latin], Metirapona [INN-Spanish], 2-Methyl-1,2-di-3-pyridinyl-1-propanone, 2-methyl-1,2-dipyridin-3-ylpropan-1-one, UNII-ZS9KD92H6V, 2-Methyl-1,2-bis(3-pyridyl)-1-propanone, NSC 25265, 1,2-Di-3-pyridyl-2-methyl-1-propanone, C14H14N2O, HSDB 2500, 1-Propanone, 2-methyl-1,2-di-3-pyridyl-, Metyrapone [USAN:INN:BAN:JAN], METOPIRONE (TN), Su-4885, EINECS 200-206-2, CHEMBL934, ZS9KD92H6V, 1-Propanone, 1,2-di-3-pyridyl-2-methyl-, 2-methyl-1,2-dipyridin-3-yl-propan-1-one, CHEBI:44241, 2-methyl-1,2-bis(pyridin-3-yl)propan-1-one, FJLBFSROUSIWMA-UHFFFAOYSA-N, CAS-54-36-4, NCGC00016242-01, DSSTox_CID_3314, DSSTox_RID_76971, DSSTox_GSID_23314, MYT, SMR000059134, Metyrapone [USAN:USP:INN:BAN:JAN], PubChem16052, AC1L1HKV, AC1Q1LHX, Metyrapone Alliance Brand, Metyrapone Novartis Brand, Prestwick0_000904, Prestwick1_000904, Prestwick2_000904, Prestwick3_000904, D0Q9JT, Alliance Brand of Metyrapone, Novartis Brand of Metyrapone, BIDD:PXR0082, BSPBio_000748, MLS001066377, MLS001335881, MLS001335882, SCHEMBL637432, SPBio_002947, 1-Propanone,2-di-3-pyridyl-, BPBio1_000824, GTPL5224, Metyrapone (JP15/USP/INN), Metyrapone (JP17/USP/INN), ZINC1728, DTXSID1023314, 1-Propanone,2-di-3-pyridinyl-, CTK8B5187, KS-00001FBF, MolPort-001-794-644, HMS1570F10, HMS2094I07, HMS2097F10, HMS2235E16, HMS3259O05, HMS3371B16, HMS3714F10, Pharmakon1600-01506014, BCP19099, EX-A1403, HY-B1232, NSC25265, Tox21_110323, ANW-47874, BDBM50028166, BG0427, MFCD00006397, NSC-25265, NSC760076, AKOS015919707, Metyrapone, >=98% (HPLC), solid, Tox21_110323_1, API0003315, CCG-213598, CS-4879, DB01011, MCULE-7018205003, NC00462, NSC-760076, NCGC00016242-02, NCGC00016242-03, NCGC00016242-05, NCGC00161837-01, AJ-08075, AN-41656, BR-51541, CC-30940, CPD000059134, SAM002297829, SC-49180, ZB000400, 2-methyl-1,2-di(3-pyridyl)propan-1-one, 2-methyl-1,2-bis(3-pyridyl)propan-1-one, AX8140081, LS-123097, TC-136619, 2-methyl-1,2-bis(3-pyridinyl)-1-propanone, AB00513955, B7347, EU-0009322, FT-0603230, ST24028079, ST51006925, W6860, 2-methyl-1,2-di(pyridin-3-yl)propan-1-one, 2-Methyl-1,2-di(3-pyridinyl)-1-propanone #, C07205, D00410, S-6399, 2-Methyl-1,2-di-3-pyridyl-1-propanone, 96%, AB00513955_07, 054M364, A830124, C-12887, SR-01000765398, SR-01000765398-2, BRD-K46862739-001-03-6, I14-92873, Metyrapone, United States Pharmacopeia (USP) Reference Standard, 37245-80-0


ID: 591

chemical graph of compound 591



InChIKey: FKJIJBSJQSMPTI-CAOXKPNISA-M
SMILES: C[C@H](CCC(=O)[O-])[C@H]1CC[C@@H]2[C@@]1(C(=O)C[C@H]3[C@H]2C(=O)C[C@H]4[C@@]3(CCC(=O)C4)C)C.[Na+]

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 13338976
synonyms found at PubChem are:
Sodium dehydrocholate, 145-41-5, DEHYDROCHOLATE SODIUM, Dehydrocholate (sodium), Biliron, Carachol, Dehydrocholic acid sodium salt, UNII-W4193719XR, Biliton, Dycholium, Suprachol, Dilabil sodium, Decholin Sodium, Decholin sodium salt, W4193719XR, Natriumdehydrocholat [German], Dehydrocholic acid, sodium salt, Sodium 3,7,12-triketocholanate, Natrii dehydrocholas [INN-Latin], Dehidrocolato sodico [INN-Spanish], EINECS 205-652-1, 81-23-2 (Parent), Dehydrocholate de sodium [INN-French], Natriumdehydrocholat, Sodium 3,7,12-trioxo-5-beta-cholanate, Dehidrocolato sodico, Natrii dehydrocholas, Triceto 3-7-12 cholanate de Na [French], Sodium 3,7,12-trioxo-5beta-cholan-24-oate, Sodium 3,7,12-trioxo-5-beta-cholan-24-oate, Dehydrocholate de sodium, Dehydrocholate sodium [USP], 5-beta-Cholan-24-oic acid, 3,7,12-trioxo-, monosodium salt, Cholan-24-oic acid, 3,7,12-trioxo-, sodium salt, (5-beta)-, Triceto 3-7-12 cholanate de Na, 3,7,12-Trioxo-5beta-cholanic acid sodium salt, E yenCamicro Ea AAENI, Dehydrocholic acid sodium, 5-beta-Cholan-24-oic acid, 3,7,12-trioxo-, sodium salt, Sodium dehydrocholate [INN], C24H33NaO5, Cholan-24-oic acid, 3,7,12-trioxo-, sodium salt, (5beta)-, SCHEMBL164693, CHEMBL2106184, FKJIJBSJQSMPTI-CAOXKPNISA-M, MolPort-003-929-781, HY-B0998, AKOS025311010, CS-4492, 3,7,12-EyNo-5|A-micro IeEa AAENI, O606, D0043, J-008101, I14-101286, 1510-17-4, sodium (4R)-4-[(1S,2S,7S,10R,11S,14R,15R)-2,15-dimethyl-5,9,16-trioxotetracyclo[8.7.0.0?,?.0??,??]heptadecan-14-yl]pentanoate, sodium (4R)-4-[(1S,2S,7S,10R,11S,14R,15R)-2,15-dimethyl-5,9,16-trioxotetracyclo[8.7.0.02,7.011,15]heptadecan-14-yl]pentanoate


ID: 592

chemical graph of compound 592



InChIKey: FKUVCCNCUAFKAH-UTONKHPSSA-N
SMILES: CCCN(CCC)[C@@H]1CCC2=C(C=CC(=C2C1)O)F.Cl

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 11957726
synonyms found at PubChem are:
R(+)-UH-301 hydrochloride, UNII-O8ROD11G06, O8ROD11G06, R(+)-5-Fluoro-8-Hydroxy-DPAT hydrochloride, SR-01000075591, 127126-18-5, CHEMBL1256996, (R)-5-Fluoro-8-hydroxy-2-(dipropylamino)tetralin hydrochloride, 5-Fluoro-8-hydroxy-2-(dipropylamino)tetralin hydrochloride, (R)-, (R)-(+)-5-Fluoro-8-hydroxy-2-(dipropylamino)tetralin hydrochloride, R(+)-UH-301 hydrochloride, solid, 1-Naphthalenol, 7-(dipropylamino)-4-fluoro-5,6,7,8-tetrahydro-, hydrochloride (1:1), (7R)-, NCGC00094487-01, 127126-20-9, EU-0101246, U-109, J-005466, SR-01000075591-1, SR-01000075591-2, R(+)-5-Fluoro-8-hydroxy-2-dipropylamino-1,2,3,4-tetrahydronaphthalene hydrochloride


ID: 593

chemical graph of compound 593



InChIKey: FLEXCYTURSFUNC-UHFFFAOYSA-N
SMILES: COC1=CC2=C(C=C1)C3=C(O2)C4=C(C=C(C=C4)OC)OC3

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 624785
synonyms found at PubChem are:
Dehydrovariabilin, Anhydrovariabilin, 3,9-Dimethoxypterocarpene, 1433-08-5, FLEXCYTURSFUNC-UHFFFAOYSA-N, KBio2_000462, AC1LDQRU, Spectrum_000062, 3,9-Dimethoxypterocarpen, Spectrum2_000058, Spectrum3_000259, Spectrum4_001626, Spectrum5_000411, BSPBio_001678, KBioGR_002031, KBioSS_000462, SPECTRUM210658, 3,9-Dimethoxy-6H-benzofuro[3,2-c][1]benzopyran, SPBio_000215, 6H-Benzofuro[3,2-c][1]benzopyran, 3,9-dimethoxy-, CHEMBL1520512, SCHEMBL13657398, KBio2_003030, KBio2_005598, KBio3_001178, ZINC3473153, CCG-38365, LMPK12070150, 3,9-Dimethoxypterocarp-6a(11a)-en, AKOS000277249, SDCCGMLS-0066548.P001, NCGC00095524-01, NCGC00095524-02, NCGC00179096-01, 3,9-dimethoxy-6H-benzofuro[3,2-c]chromene, 3,9-Dimethoxy-6H-[1]benzofuro[3,2-c]chromene, SR-05000002528, 3,9-Dimethoxy-6H-[1]benzofuro[3,2-c]chromene #, SR-05000002528-1, NCGC00095524-04!3,9-dimethoxy-6H-[1]benzofuro[3,2-c]chromene


ID: 594

chemical graph of compound 594



InChIKey: FLGYCSPPJQJZCH-LCYFTJDESA-N
SMILES: C1=CC=C2C=C(C=CC2=C1)NCC(=O)NN/C=C\3/C=C(C(=C(C3=O)Br)O)Br

biological descriptors:

CFTR relevance: CFTR inhibitor

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

reference list:

"H Senderowitz" "DT Infield" "N Khazanov" "BB Stauffer" "G Cui" "NA McCarty" "BR Imhoff"


CID is 11260414
synonyms found at PubChem are:
GlyH-101, 328541-79-3, CFTR Inhibitor II, (Naphthalen-2-ylamino)-acetic acid (3,5-dibromo-2,4,-dihydroxy-benzylidene)-hydrazide, GlyH - 101, MolPort-006-416-077, N-(2-naphthalenyl)-[(3,5-dibromo-2,4-dihydroxyphenyl)methylene]glycine hydrazide, N-2-Naphthalenyl-glycine 2-[(3,5-dibromo-2,4-dihydroxyphenyl)methylene]hydrazide, 3698AH, AKOS025148694, ZINC100478919, CS-2098, BC600597, HY-18336, KB-02594, KB-52296, (Naphthalen-2-ylamino)-acetic acid (3,5-dibromo-2,4-dihydroxy-benzylidene)-hydrazide, (Naphthalen-2-ylamino)acetic acid (3,5-dibromo-2,4,-dihydroxybenzylidene)hydrazide


ID: 595

chemical graph of compound 595



InChIKey: FLGYCSPPJQJZCH-UHFFFAOYSA-N
SMILES: C1=CC=C2C=C(C=CC2=C1)NCC(=O)NNC=C3C=C(C(=C(C3=O)Br)O)Br

biological descriptors:

CFTR relevance: CFTR inhibitor

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

reference list:

"H Senderowitz" "DT Infield" "N Khazanov" "BB Stauffer" "G Cui" "NA McCarty" "BR Imhoff"


CID is 53397780
synonyms found at PubChem are:
GlyH-101, CTK8E9894, AGN-PC-005HH0, 328541-79-3, CFTR Inhibitor II, GlyH-101, CFTR Inhibitor II, D0S1FV, GTPL4202, N-2-Naphthalenyl-glycine 2-[(3,5-dibromo-2,4-dihydroxyphenyl)methylene]hydrazide, AOB87126, BCP10956, KS-00001DB4, ZINC22115071, AKOS026750493, N'-[(3,5-dibromo-4-hydroxy-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]-2-(naphthalen-2-ylamino)acetohydrazide


ID: 596

chemical graph of compound 596



InChIKey: FLGYCSPPJQJZCH-UKTHLTGXSA-N
SMILES: C1=CC=C2C=C(C=CC2=C1)NCC(=O)NN/C=C/3\C=C(C(=C(C3=O)Br)O)Br

biological descriptors:

CFTR relevance: CFTR inhibitor

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

reference list:

"H Senderowitz" "DT Infield" "N Khazanov" "BB Stauffer" "G Cui" "NA McCarty" "BR Imhoff"


CID is 16760366
synonyms found at PubChem are:
GlyH-101, GlyH 101, CFTR Inhibitor II, GlyH-101, CHEMBL1221576, 328541-79-3, N-(2-Naphthalenyl)-((3,5-dibromo-2,4-dihydroxyphenyl)methylene)glycine hydrazide, SCHEMBL12648530, BDBM50324733, AKOS032947331, ZINC100478920, S8094, EC-000.1907, J-018908, N''-(3,5-dibromo-2,4-dihydroxybenzylidene)-2-(naphthalen-2-ylamino)acetohydrazide, N'-[(3,5-dibromo-2,4-dihydroxyphenyl)methylidene]-2-[(naphthalen-2-yl)amino]acetohydrazide, N-2-Naphthalenyl-2-[(3,5-dibromo-2,4-dihydroxyphenyl)methylene]glycine hydrazide


ID: 597

chemical graph of compound 597



InChIKey: FLMOMVBGUCEQEW-UHFFFAOYSA-L
SMILES: C[N+](C)(C)CCCCCC[N+](C)(C)C.O.O.[Br-].[Br-]

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 6419940
synonyms found at PubChem are:
UNII-E010109G6B, Hexamethonium dibromide dihydrate, E010109G6B, Hexamethonium bromide dihydrate, Prestwick_259, AC1O4WGM, CHEMBL1405927, HMS1568G17, HMS2095G17, HMS3712G17, CCG-220038, 1,6-Hexanediaminium, N1,N1,N1,N6,N6,N6-hexamethyl-, bromide, hydrate (1:2:2), CAS-55-97-0, NCGC00017011-01, 5187-74-6, hexamethylene di(trimethylammonium) dibromide dihydrate, trimethyl-[6-(trimethylazaniumyl)hexyl]azanium dibromide dihydrate


ID: 598

chemical graph of compound 598



InChIKey: FLMPHRLJTGZEDL-UHFFFAOYSA-N
SMILES: C1=CC=[NH0+]2C3C=CC=CC=3C(O)=CC2=C1.[ClH0-]

biological descriptors:

CFTR relevance: inactive analogue

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

reference list:

"M Wilke" "S Noël" "C Rogier" "Y Mettey" "F Becq" "H DeJonge" "PO Strale" "L Dannhoffer"


CID is 11776085
synonyms found at PubChem are:
CHEMBL171993, 71711-67-6, DTXSID40472368, NSC368298, NSC-368298, benzo[c]quinolizin-11-ium-6-ol,chloride


ID: 599

chemical graph of compound 599



InChIKey: FLMSQRUGSHIKCT-DDZQJACLSA-N
SMILES: C[C@]12CC[C@@H](C[C@H]1CC[C@@H]3[C@@H]2[C@@H](C[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:

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


CID is 6437
synonyms found at PubChem are:
Sarmentogenin, 11-alpha-Hydroxydigitoxigenin, UNII-EX5655UIRZ, EX5655UIRZ, CHEBI:37665, 3beta,11alpha,14-Trihydroxy-5beta-card-20(22)-enolide, 76-28-8, 5-beta-CARD-20(22)-ENOLIDE, 3-beta,11-alpha,14-TRIHYDROXY-, Card-20(22)-enolide, 3,11,14-trihydroxy-, (3beta,5beta,11alpha)-, AC1L1MJ6, SCHEMBL1230965, CHEMBL1075814, LS-52504, 3-[(3S,5R,8R,9S,10S,11R,13R,14S,17R)-3,11,14-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


ID: 600

chemical graph of compound 600



InChIKey: FLOSMHQXBMRNHR-UHFFFAOYSA-N
SMILES: CC(=O)N=C1N(N=C(S1)S(=O)(=O)N)C

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 4100
synonyms found at PubChem are:
methazolamide, 554-57-4, Methenamide, Neptazane, Neptazaneat, Metazolamida, Metazolamide, Methazolamidum, Naptazane, Metazolamide [DCIT], Metazolamida [INN-Spanish], Methazolamidum [INN-Latin], UNII-W733B0S9SD, C5H8N4O3S2, CHEBI:6822, HSDB 3269, EINECS 209-066-7, N-(3-methyl-5-sulfamoyl-1,3,4-thiadiazol-2-ylidene)acetamide, BRN 0232387, UNII-DA43GW06P1, MLS000028532, CHEMBL288100, DA43GW06P1, W733B0S9SD, Acetamide, N-(5-(aminosulfonyl)-3-methyl-1,3,4-thiadiazol-2(3H)-ylidene)-, Acetamide, N-[5-(aminosulfonyl)-3-methyl-1,3,4-thiadiazol-2(3H)-ylidene]-, NCGC00016508-01, CAS-554-57-4, SMR000058287, 2-Acetylimino-3-methyl-delta(sup 4)-1,3,4-thiadiazoline-5-sulfonamide, 5-Acetylimino-4-methyl-delta(sup 2)-1,3,4-thiadiazoline-2-sulfonamide, N-(4-Methyl-2-sulfamoyl-delta(sup 2)-1,3,4-thiadiazolin-5-ylidene)acetamide, N-(3-methyl-5-sulfamoyl-2,3-dihydro-1,3,4-thiadiazol-2-ylidene)acetamide, Acetamide, N-(4-methyl-2-sulfamoyl-delta(sup 2)-1,3,4-thiadiazolin-5-ylidene)-, N-[(2E)-5-(aminosulfonyl)-3-methyl-1,3,4-thiadiazol-2(3H)-ylidene]acetamide, SR-05000001844, Methazolamid, Methazolamide [INN:BAN:JAN], 2-Acetylimino-3-methyl-.delta.(4)-1,3,4-thiadiazoline-5-sulfonamide, 3-methyl-2-(2-oxo-1-azapropylidene)-1,3,4-thiadiazoline-5-sulfonamide, 5-Acetylimino-4-methyl-.delta.(2)-1,3,4-thiadiazoline-2-sulfonamide, N-(4-Methyl-2-sulfamoyl-.delta.2-1,3,4-thiadiazolin-5-ylidene)acetamide, N-(5-(Aminosulfonyl)-3-methyl-1,3,4-thiadiazol-2(3H)-ylidene)acetamide #, Acetamide, N-(4-methyl-2-sulfamoyl-.delta.2-1,3,4-thiadiazolin-5-ylidene)-, Neptazane (TN), Methazolamide,(S), Methazolamide [USP:INN:BAN:JAN], Methazolamide, MZA, Prestwick_1007, Methazolamide (MZA), Methazolamide, (Z)-, Spectrum_001615, Opera_ID_717, AC1L1HEV, CHEMBL19, MZA3, Prestwick0_000802, Prestwick1_000802, Prestwick2_000802, Prestwick3_000802, Spectrum2_001543, Spectrum3_001914, Spectrum4_000190, Spectrum5_001006, DSSTox_CID_3281, D0C2II, cid_4100, DSSTox_RID_76956, DSSTox_GSID_23281, Oprea1_161738, SCHEMBL24686, SCHEMBL24687, BSPBio_000663, BSPBio_003508, KBioGR_000739, KBioSS_002095, 4-27-00-08221 (Beilstein Handbook Reference), MLS001146905, DivK1c_000582, SPECTRUM1503252, SPBio_001386, SPBio_002584, AC1Q40D8, AC1Q40D9, BPBio1_000731, GTPL6828, Methazolamide (JAN/USP/INN), CHEMBL1335656, DTXSID1023281, SCHEMBL13825893, BDBM10881, CHEBI:94513, CTK8G0825, HMS501N04, KBio1_000582, KBio2_002095, KBio2_004663, KBio2_007231, KBio3_003013, FLOSMHQXBMRNHR-DAXSKMNVSA-N, FLOSMHQXBMRNHR-QPJJXVBHSA-N, FLOSMHQXBMRNHR-UHFFFAOYSA-N, Methazolamide, >=98% (HPLC), MolPort-001-791-152, MolPort-019-998-640, NINDS_000582, HMS1570B05, HMS1922M19, HMS2093A05, HMS2097B05, HMS2234L03, HMS3259H05, HMS3372G12, HMS3652E21, HMS3714B05, Pharmakon1600-01503252, EBD27355, HY-B0553, KS-000010PT, Tox21_110464, BDBM50013792, CCG-39321, NSC758426, SBB037875, ZINC12503151, AKOS015897587, AKOS024464790, AKOS026749792, N-[5-(aminosulfonyl)-3-methyl-1,3,4-thiadiazol-2(3H)-ylidene]acetamide, ZINC100019188, ZINC253917094, CS-2658, DB00703, FCH4114988, KS-5328, MCULE-1665001985, NC00618, NSC-758426, IDI1_000582, Methazolamide (oral, sustained release), NCGC00018188-01, NCGC00018188-02, NCGC00018188-03, NCGC00018188-04, NCGC00018188-05, NCGC00018188-06, NCGC00018188-07, NCGC00022950-03, NCGC00022950-04, NCGC00178022-01, NCGC00178022-02, AN-45878, AS-13272, CC-30264, CPD001453721, CPD001496938, H773, LS-10006, SAM002548986, SAM002589943, ST081366, SBI-0051804.P002, AB0013250, A4364, AB00490015, FT-0603467, S4039, C07764, D00655, K-9905, AB00052336_04, 554M574, A830656, L584601, Methazolamide, VETRANAL(TM), analytical standard, I09-1225, L 584601, SR-05000001844-1, SR-05000001844-2, SR-05000001844-3, BRD-K13356952-001-15-2, BRD-K71053238-001-03-6, BRD-K71053238-001-04-4, (E)-N-(3-methyl-5-sulfamoyl-1,3,4-thiadiazol-2(3H)-ylidene, N-(3-methyl-5-sulfamoyl-1,3,4-thiadiazol-2-ylidene)ethanamide, Methazolamide, United States Pharmacopeia (USP) Reference Standard, (E)-N-(3-methyl-5-sulfamoyl-1,3,4-thiadiazol-2(3H)-ylidene)acetamide, 5-Acetylimino-4-methyl-| currency2-1,3,4-thiadiazoline-2-sulfonamide, Acetamide, N-(5-(aminosulfonyl)-3-methyl-1,3,4-thiadiazol-2(3H)-ylidene)-, (N(Z))-, N-(4-Methyl-2-sulfamoyl-| currency2-1,3,4-thiadiazolin-5-ylidene) acetamide, N-(4-Methyl-2-sulfamoyl-| currency2-1,3,4-thiadiazolin-5-ylidene)acetamide, N-[(2Z)-3-methyl-5-sulfamoyl-2,3-dihydro-1,3,4-thiadiazol-2-ylidene]acetamide, 1164547-86-7


ID: 601

chemical graph of compound 601



InChIKey: FLRUCNJMPLRHQE-MYAXKPMNSA-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)O)C)OC(O5)(O6)C)C)O)O)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:

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


CID is 54699399
synonyms found at PubChem are:
HYDROLYSIS PRODUCT OF BUSSEIN, Spectrum5_000139, BSPBio_001735, SPECTRUM100117, CHEMBL3039083, CCG-38539, SDCCGMLS-0066307.P001, NCGC00179047-01, SR-05000002773, SR-05000002773-1


ID: 602

chemical graph of compound 602



InChIKey: FLVRDMUHUXVRET-UHFFFAOYSA-N
SMILES: C1=CC=C(C=C1)OC2=CC=CC(=C2)C3=C(C4=C(C=C(C=C4)Cl)NC3=O)O

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 115113
synonyms found at PubChem are:
L-701324, 142326-59-8, L-701,324, L 701324, UNII-I9WY146163, C21H14ClNO3, L 701,324, CHEMBL31741, 7-Chloro-4-hydroxy-3-(3-phenoxy)phenyl-2(1H)-quinolone, I9WY146163, compund 13 [PMID: 8182696], 7-Chloro-4-hydroxy-3-(3-pheoxyphenyl)-2(1H)-quinolinone, 2(1H)-Quinolinone, 7-chloro-4-hydroxy-3-(3-pheoxyphenyl)-, SMR000326934, Tocris-0907, AC1L3GJN, Biomol-NT_000206, D0M1WN, MLS000860076, MLS002153302, BPBio1_001264, GTPL4240, SCHEMBL1998890, CHEBI:92140, DTXSID00162016, EX-A587, MolPort-003-941-887, 2(1H)-Quinolinone, 7-chloro-4-hydroxy-3-(3-phenoxyphenyl)-, 7-chloro-4-hydroxy-3-(3-phenoxyphenyl)quinolin-2(1H)-one, HMS2234A14, HMS3267A09, HMS3370N04, BCP14852, BDBM50038168, MFCD00910917, ZINC95541799, AKOS005067008, AKOS026750257, API0026404, CS-4968, NCGC00024864-01, NCGC00024864-02, 940943-34-0, HY-18698, KB-53089, LS-173140, B6499, FT-0687292, L-701, L-701,324, >=98% (HPLC), solid, L701324, SR-01000597439, J-007638, SR-01000597439-1, BRD-K08109516-001-01-1, BRD-K08109516-001-02-9, L-701 324, 7-chloro-2-hydroxy-3-(3-phenoxyphenyl)-1H-quinolin-4-one, 7-Chloro-2-hydroxy-3-(3-phenoxyphenyl)-4(1H)-quinolinone, 7-Chloro-4-hydroxy-3-(3-phenoxy-phenyl)-1H-quinolin-2-one, 7-chloro-2-hydroxy-3-(3-phenoxyphenyl)-1,4-dihydroquinolin-4-one, 7-CHLORO-4-HYDROXY-3-(3-PHENOXY)PHENYL-2(1H)-QUINOLINONE


ID: 603

chemical graph of compound 603



InChIKey: FMETVQKSDIOGPX-UHFFFAOYSA-N
SMILES: C1CCC(C1)N2C=C(C3=C2N=CN=C3N)C4=CC=C(C=C4)OC5=CC=CC=C5

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 6603792
synonyms found at PubChem are:
213743-31-8, 7-Cyclopentyl-5-(4-phenoxy)phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-ylamine, CHEMBL47940, IN1272, KIN001-051, RK-24466, 7-Cyclopentyl-5-(4-phenoxyphenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-ylamine, 7-CYCLOPENTYL-5-(4-PHENOXY)PHENYL-7H-PYR, 4-Amino-5-(4-Phenoxyphenyl)-7h-Pyrrolo[2,3-D]pyrimidin-7-Yl-Cyclopentane, 4-Amino-5-(4-phenoxyphenyl)-7H-pyrrolo[3,2-d]pyrimidin-7-yl-cyclopentane, 3gen, 3vry, B43, NCGC00015280-01, Lopac-C-8863, D0OZ2S, AC1O7G1S, Lopac0_000450, MLS002153184, SCHEMBL378454, GTPL6003, CTK8E9535, AOB5698, DTXSID90424958, FMETVQKSDIOGPX-UHFFFAOYSA-N, MolPort-003-940-860, HMS2232E04, HMS3229G15, HMS3261I22, HMS3371C06, ZINC2541690, Tox21_500450, BDBM50092228, MFCD04974490, CCG-204542, CS-8050, LP00450, NCGC00015280-02, NCGC00015280-03, NCGC00015280-04, NCGC00015280-05, NCGC00093866-01, NCGC00093866-02, NCGC00261135-01, ACM213743318, SMR001230675, HY-108318, RT-013564, EU-0100450, C 8863, SR-01000075852, J-014016, SR-01000075852-1, 7-cyclopentyl-5-(4-phenoxyphenyl)pyrrolo[2,3-d]pyrimidin-4-amine, 4-Amino-5-(4-phenoxyphenyl)-7-cyclopentyl-7H-pyrrolo[2,3-d]pyrimidine, 7-Cyclopentyl-5-(4-phenoxy-phenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-ylamine, 7-cyclopentyl-5-(4-phenoxyphenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine, 7-Cyclopentyl-5-(4-phenoxyphenyl)-7H-pyrrolo[2,3d]pyrimidin-4-ylamine, 7-Cyclopentyl-5-(4-phenoxyphenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-ylamine, >=98% (HPLC)


ID: 604

chemical graph of compound 604



InChIKey: FMGSKLZLMKYGDP-USOAJAOKSA-N
SMILES: C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CC=C4[C@@]3(CC[C@@H](C4)O)C

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 5881
synonyms found at PubChem are:
Dehydroepiandrosterone, DHEA, 53-43-0, PRASTERONE, Dehydroisoandrosterone, Androstenolone, trans-Dehydroandrosterone, 3beta-hydroxyandrost-5-en-17-one, Diandron, Diandrone, Psicosterone, 17-Hormoforin, 17-Chetovis, Prestara, 5-Dehydroepiandrosterone, Andrestenol, Intrarosa, Siscelar plus, 5,6-Didehydroisoandrosterone, Epiandrosterone, 5-dehydro-, dehydroepiandrosterone (dhea), Caswell No. 051F, 5,6-Dehydroisoandrosterone, 5,6-Dehydroisoandrostorone, CCRIS 3277, Prasteronum [INN-Latin], Prasterona [INN-Spanish], 3beta-hydroxy-5-androsten-17-one, (+)-Dehydroisoandrosterone, 3-beta-Hydroxy-5-androsten-17-one, GL 701, Prasterone [INN], Androst-5-en-17-one, 3-hydroxy-, (3beta)-, EPA Pesticide Chemical Code 126510, UNII-459AG36T1B, 5-Androsten-3beta-ol-17-one, Dehydro-epi-androsterone, (3-beta)-3-Hydroxyandrost-5-en-17-one, NSC 9896, EINECS 200-175-5, EM-760, BRN 2058110, (3beta)-3-hydroxyandrost-5-en-17-one, Prasterona, Prasteronum, Androst-5-en-17-one, 3-beta-hydroxy-, CHEMBL90593, (3S,8R,9S,10R,13S,14S)-3-hydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one, CHEBI:28689, NSC9896, FMGSKLZLMKYGDP-USOAJAOKSA-N, 459AG36T1B, Prasterone (INN), DSSTox_CID_379, Androst-5-en-17-one, 3-hydroxy-, (3b)-, Androst-5-en-17-one, 3beta-hydroxy- (8CI), DSSTox_RID_75553, DSSTox_GSID_20379, Astenile, Deandros, AND, Androst-5-en-17-one, 3-hydroxy-, (3.beta.)-, CAS-53-43-0, (1S,2R,5S,10R,11S,15S)-5-hydroxy-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-7-en-14-one, (1S,5S,11S,15S,2R,10R)-5-hydroxy-2,15-dimethyltetracyclo[8.7.0.0<2,7>.0<11,15> ]heptadec-7-en-14-one, SMR000059075, Androst-5-en-17-one, 3.beta.-hydroxy-, SR-01000075815, Prasterone [USAN:INN], D5-Androsten-3beta-ol-17-one, Androst-5-ene-3beta-ol-17-one, 5-Androsten-3.beta.-ol-17-one, Anastar, Fidelin, Inflabloc, Vaginorm, Aslera, 3-|A-hydroxy-5-androsten-17-one, 3-beta-hydroxyandrost-5-en-17-one, 3beta-Hydroxy-D5-androsten-17-one, Fidelin T, NCGC00093802-04, NCGC00093802-06, Biolaif (TN), Dehydroepiandrosternoe, DHEA, Paladin Labs, dehydroepiandrostenedione, trans-de-hydroandrosterone, bmse000665, D00OAW, D0K0EK, DHEA, Neuroscience Pharma, EC 200-175-5, AC1L1LC4, 5,6-didehydroepiandrosterone, BIDD:PXR0080, Lopac0_000368, SCHEMBL24156, Hydroxyandrost-5-en-17-one, 4-08-00-00994 (Beilstein Handbook Reference), MLS001066350, MLS001333231, MLS001333232, MLS001424274, GTPL2370, DTXSID4020379, BCPE00002, DHEA (trans-Dehydroandrosterone), MolPort-003-929-763, 3beta-Hyroxyandrost-5-en-17-one, BCPP000260, EL-10, GL701, HMS2052P11, HMS2090C04, HMS2232K11, IM 28, trans-Dehydroandrosterone, >=99%, 3-beta-hydroxy-5-androsten-17-on, ACT02646, BCP02453, Dehydroepiandrosterone, Paladin Labs, IPL-1001, NSC-9896, ZINC3807917, 3beta-Hydroxyandrost-5-ene-17-one, Tox21_111222, Tox21_201996, Tox21_302761, BDBM50223368, CMC_13435, Delta5-androsten-3-beta-ol-17-one, DL-373, GL-701, LMST02020021, MFCD00003613, PB-007, s2604, SBB012501, 3.beta.-Hydroxyandrost-5-en-17-one, 5-Androsten-3beta-ol-17-one; DHEA, AKOS007930299, AKOS015951378, Tox21_111222_1, BCP9000602, CCG-101190, CS-1667, DB01708, EBD1328208, GS-0906, IP-1001, LS-7296, NC00440, SH-K-04828, Androst-5-en-17-one, 3beta-hydroxy-, NCGC00093802-09, NCGC00256412-01, NCGC00259545-01, (3beta)-3-Hydroxyandrost-5-ene-17-one, AC-28716, AJ-45664, AK125048, AN-24410, CC-26313, HY-14650, NCI60_042215, Prasterone (DHEA; Dehydroepiandrosterone), ST069381, Dehydroepiandrosterone, Neuroscience Pharma, AB0007943, AB1009532, TR-018899, D0044, EU-0100368, C01227, D 4000, D-0340, D08409, J10065, M-1336, AB00375810-06, AB00375810_09, Androst-5-en-17-one, 3-hydroxy-, (3-beta)-, C-18147, SR-01000075815-1, SR-01000075815-4, BRD-K41256143-001-12-7, Androst-5-en-17-one, 3-hydroxy-, (3-beta)- (9CI), Androst-5-en-17-one, 3-hydroxy-, (3beta)- (9CI), Z2213891300, 1A9D2040-240C-427D-ADE4-0CB700B785CB, Prasterone (DHEA; Dehydroepiandrosterone) 1.0 mg/ml in Acetonitrile, (3S,8R,9S,10R,13S,14S)-3-hydroxy-10,13-dimethyl-1,2,3,4,7,8,9,10,11,12,13,14,15,16-tetradecahydro-17H-cyclopenta[a]phenanthren-17-one, (3S,8R,9S,10R,13S,14S)-3-hydroxy-10,13-dimethyl-3,4,7,8,9,10,11,12,13,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17(2H)-one, 105597-37-3, 108673-53-6, 9013-35-8


ID: 605

chemical graph of compound 605



InChIKey: FMHHVULEAZTJMA-UHFFFAOYSA-N
SMILES: CC1=CC(=O)OC2=C1C=C3C=C(OC3=C2C)C

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 5585
synonyms found at PubChem are:
trioxsalen, Trioxysalen, Trisoralen, 3902-71-4, Trimethylpsoralen, 4,5',8-Trimethylpsoralen, Elder 8011, Trioxisaleno, Trioxysalene, Trioxysalenum, 2',4,8-Trimethylpsoralen, 4,5',8-Trimethylpsoralene, NSC-71047, 2,5,9-Trimethyl-7H-furo[3,2-g]chromen-7-one, UNII-Y6UY8OV51T, NSC71047, Trioxysalene [INN-French], Trioxysalenum [INN-Latin], Trioxisaleno [INN-Spanish], NSC 71047, TRIOXSALIN, 7H-Furo[3,2-g][1]benzopyran-7-one, 2,5,9-trimethyl-, EINECS 223-459-0, 4,8,5'-Trimethylpsoralen, BRN 0221723, Y6UY8OV51T, 2,5,9-Trimethyl-7H-furo(3,2-g)(1)benzopyran-7-one, 2,5,9-trimethylfuro[3,2-g]chromen-7-one, CHEBI:28329, 2,5,9-Trimethylfuro[3,2-g]benzopyran-7-one, FMHHVULEAZTJMA-UHFFFAOYSA-N, 7-Oxo-2,5,9-Trimethyl-7H-furo(3,2-g)(1)benzopyron, 7H-Furo(3,2-g)(1)benzopyran-7-one, 2,5,9-trimethyl-, NCGC00016643-01, CAS-3902-71-4, 6-Hydroxy-beta,2,7-trimethyl-5-benzofuranacrylic acid gamma-lactone, DSSTox_CID_3716, DSSTox_RID_77160, DSSTox_GSID_23716, Trioxsalen [USAN], SR-01000812969, Trioxsalen [USAN:USP], 2,5,9-Trimethylpsoralen, 4,5,8-Trimethylpsoralen, antipsoriatic, Trioxalen, Trixsalen, Trisoralen (TN), Trioxsalen (USP), Prestwick_148, Trioxysalen [INN], LACTONE, 4,8-Trimethylpsoralen, Spectrum_000169, 4,8-Trimethylpsoralene, 2',8-Trimethylpsoralen, AC1L1KOB, Trioxysalen (JAN/INN), Prestwick0_000709, Prestwick1_000709, Prestwick2_000709, Prestwick3_000709, Spectrum2_001083, Spectrum3_001378, Spectrum4_000883, Spectrum5_001557, D0FA2O, SCHEMBL1252, CHEMBL1475, Oprea1_203343, BSPBio_000897, BSPBio_002936, KBioGR_001286, KBioSS_000649, 5-19-04-00472 (Beilstein Handbook Reference), MLS001173417, DivK1c_000380, SPECTRUM1500596, SPBio_001126, SPBio_002818, BPBio1_000987, MEGxm0_000462, ZINC2226, DTXSID3023716, ACon0_000603, ACon1_000251, HMS501C22, KBio1_000380, KBio2_000649, KBio2_003217, KBio2_005785, KBio3_002156, MolPort-001-740-054, NINDS_000380, HMS1570M19, HMS1921I05, HMS2092A12, HMS2097M19, HMS2879M06, HMS3714M19, Pharmakon1600-01500596, 7H-Furo[3, 2,5,9-trimethyl-, HY-B1157, Tox21_110541, ANW-41902, CCG-39937, MFCD00005010, NSC757371, AKOS015912601, Tox21_110541_1, Trioxsalen, >=98% (HPLC), powder, ACM3902714, CS-4760, DB04571, KS-5184, MCULE-5301264270, NSC-757371, SDCCGMLS-0066609.P001, IDI1_000380, NCGC00016643-02, NCGC00016643-03, NCGC00016643-04, NCGC00016643-05, NCGC00016643-06, NCGC00016643-09, NCGC00016643-10, NCGC00094804-01, NCGC00094804-02, NCGC00178384-01, NCGC00178384-02, NCGC00178384-03, CC-35440, LS-70743, NCI60_038883, SMR000538905, ST083486, ZB000511, SBI-0051547.P002, AB2000428, TR-015676, FT-0603651, W0082, 4,7,9-trimethylfurano[3,2-g]chromen-2-one, A-8462, BENZOFURANACRYLIC ACID,2,7-TRIMETHYL-,, C09314, D01034, EN300-122631, J10195, 4,7,9-trimethyl-2H-furo[3,2-g]chromen-2-one, AB00052119_09, 2,5,9-trimethyl-7-furo[3,2-g][1]benzopyranone, 902T714, A824380, C-13067, Trimethylpsoralen;Trioxysalen;Trisoralen;Trisoralen, 2,5,9-Trimethyl-7H-furo[3,2-g]chromen-7-one #, SR-01000812969-2, SR-01000812969-5, SR-01000812969-6, SR-01000812969-7, 2,9-Trimethyl-7H-furo[3,2-g][1]benzopyran-7-one, BRD-K54790157-001-06-4, BRD-K54790157-001-10-6, I14-48205, Z1551429738, 5-Benzofuranacrylic acid,2,7-trimethyl-, .delta.-lactone, Trioxsalen, United States Pharmacopeia (USP) Reference Standard, 5-Benzofuranacrylic acid, 6-hydroxy-.beta.,2,7-trimethyl-, .delta.-lactone, 6-hydroxy-beta,2,7-trimethyl-5-benzofuranacrylic acid, delta-lactone


ID: 606

chemical graph of compound 606



InChIKey: FMKJUUQOYOHLTF-OWOJBTEDSA-N
SMILES: C(/C=C/C(=O)O)N

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 5310987
synonyms found at PubChem are:
TACA, (E)-4-Amino-2-butenoic acid, 38090-53-8, TRANS-4-AMINOCROTONICACID, t-4-AMINOCROTONIC ACID (TACA), trans-4-Aminocrotonic acid, CHEMBL33086, NCGC00024485-02, 4-aminobut-2-enoic acid, DSSTox_CID_25648, DSSTox_RID_81026, DSSTox_GSID_45648, CAS-38090-53-8, 4-amino-2-butenoic acid, E-4-Amino-2-butenoic acid, 2-Butenoic acid, 4-amino-, SR-01000075646, 25747-40-4, 4 Aminocrotonic Acid, AC1NSJS2, Spectrum5_001675, Biomol-NT_000233, 4-Amino-but-2-enoic acid, Lopac0_001145, BSPBio_002528, SCHEMBL232135, SCHEMBL489325, SPECTRUM1502123, (E)-4-aminobut-2-enoic acid, BPBio1_000683, DTXSID8045648, (E)-4-amino-but-2-enoic acid, MolPort-003-959-679, HMS3263F11, ZINC2558023, Tox21_110902, Tox21_501145, BDBM50087271, CCG-39246, PDSP1_000613, PDSP2_000610, AKOS022632601, Tox21_110902_1, 2-Butenoic acid, 4-amino-, (2E)-, API0004306, LP01145, NCGC00024485-03, NCGC00024485-04, NCGC00024485-05, NCGC00024485-06, NCGC00024485-07, NCGC00024485-08, NCGC00261830-01, (E)-4-Amino-but-2-enoic acid (TACA), B6217, EU-0101145, EN300-188085, T 1694, SR-01000075646-1, SR-01000075646-3


ID: 607

chemical graph of compound 607



InChIKey: FMKJUUQOYOHLTF-UPHRSURJSA-N
SMILES: C(/C=C\C(=O)O)N

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 6603697
synonyms found at PubChem are:
cis-4-Aminocrotonic acid, CACA, 4-aminocrotonic acid, (Z)-4-aminobut-2-enoic acid, cis-aminocrotonic acid, CHEMBL32307, 55199-25-2, 4-aminobut-2-enoic acid, Tocris-0181, Lopac-A-201, AC1O7FZA, Lopac-T-1694, Biomol-NT_000234, D0O9UH, Lopac0_000108, 4-Amino-cis-2-butenoic acid, SCHEMBL339699, BPBio1_000376, GTPL4148, (Z)-4-Amino-2-butenoic acid, (Z)-4-Amino-but-2-enoic acid, HMS3260E18, Tox21_500108, BDBM50087277, PDSP1_000243, PDSP2_000242, ZINC29227709, AKOS006272743, CCG-204203, LP00108, NCGC00015016-01, NCGC00015016-02, NCGC00015016-03, NCGC00015016-04, NCGC00015016-05, NCGC00015016-06, NCGC00024485-01, NCGC00093605-01, NCGC00093605-02, NCGC00093605-03, NCGC00260793-01, A-201, EU-0100108, SR-01000076226, SR-01000076226-1


ID: 608

chemical graph of compound 608



InChIKey: FMMWHPNWAFZXNH-UHFFFAOYSA-N
SMILES: C1=CC=C2C3=C4C(=CC2=C1)C=CC5=C4C(=CC=C5)C=C3

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 2336
synonyms found at PubChem are:
benzo[a]pyrene, 50-32-8, 3,4-Benzopyrene, BENZO(A)PYRENE, benzo[pqr]tetraphene, 3,4-Benzpyrene, Benzpyrene, benzo[def]chrysene, 6,7-Benzopyrene, Benz[a]pyrene, 3,4-BP, 3,4-Benz[a]pyrene, 3,4-Benzopirene, 3,4-Benzpyren, Benzo[d,e,f]chrysene, Benz(a)pyrene, (B(a)P), B(a)P, BP, 3,4 Benzpyrene, RCRA waste number U022, 3,4-Benz(a)pyrene, Benzo(d,e,f)chrysene, NSC 21914, 3,4-Benzo(a)pyrene, B[a]p, 3,4-Benzpyren [German], Benzo[A]-Pyrene, CCRIS 76, Benzo(def)chrysene, 3,4-benzylpyrene, 3,4-Benzopirene [Italian], UNII-3417WMA06D, CHEBI:29865, HSDB 2554, FMMWHPNWAFZXNH-UHFFFAOYSA-N, EINECS 200-028-5, RCRA waste no. U022, CHEMBL31184, AI3-50461, 3417WMA06D, Coal tar pitch volatiles: benzo(a)pyrene, Benzo(a)pyrene [Polycyclic aromatic compounds], Benzo(a)pyrene [Polycyclic aromatic hydrocarbons], 3,4 Benzopyrene, Benzo[a]pyrene (BaP), Benzo(a)pyrene radical cation, 3,4-Benzypyrene, Benzo(a)pyrene, radical ion(1+), Benzo(a)pyrene, radical ion(1-), Benzo[d,f]chrysene, Benzo(a)pyrene, labeled with tritium, Benzo Pyrene[BAP], Benzo(3,4)pyrene, radical ion(1+), Spectrum_001871, Benzo[a]pyrene solution, ACMC-209sok, SpecPlus_000953, AC1Q1HKZ, DSSTox_CID_139, Spectrum2_001081, Spectrum3_001695, Spectrum4_000609, Spectrum5_001824, Epitope ID:117721, AC1L1DG9, DSSTox_RID_75392, DSSTox_GSID_20139, BSPBio_003250, KBioGR_001138, KBioSS_002390, KSC269M1J, MLS002695983, BIDD:ER0497, DivK1c_007049, SPBio_001122, 3,4-Benzopyrene (carcinogen), DTXSID2020139, CTK1G9614, KBio1_001993, KBio2_002385, KBio2_004953, KBio2_007521, KBio3_002470, Benzo[a]pyrene, 96% 100mg, MolPort-001-785-827, HMS3089C04, NSC21914, ZINC1530818, Benzo[a]pyrene, >=96% (HPLC), Tox21_200710, ANW-41442, BDBM50137506, CCG-39759, LS-139, NSC-21914, SBB061395, AKOS015907666, 3,4-Benzopyrene(purifiedbysublimation), AM61580, CB-1807, CS-7789, MCULE-1109963029, RTR-017988, CAS-50-32-8, WLN: L D6 B6666 2AB TJ, NCGC00178185-01, NCGC00178185-02, NCGC00258264-01, 34505-58-3, 42299-33-2, 6699-27-0, AJ-26702, AK-49838, AN-41549, BR-49838, CC-24344, CJ-05216, CJ-24042, EN002216, KB-47598, NCI60_001824, SC-08054, SMR000393676, AX8115689, DB-071166, HY-107377, TR-017988, 4CH-007056, B0085, Benzo(a)pyrene 10 microg/mL in Acetonitrile, FT-0614185, ST24030136, ST45022245, W6563, Benzo(a)pyrene 100 microg/mL in Acetonitrile, Benzo(a)pyrene 100 microg/mL in Cyclohexane, 4809-EP2270014A1, 4809-EP2270895A2, 4809-EP2272517A1, 4809-EP2277880A1, 4809-EP2277898A2, 4809-EP2278637A1, 4809-EP2284157A1, 4809-EP2292088A1, 4809-EP2292610A1, 4809-EP2292630A1, 4809-EP2295424A1, 4809-EP2295428A2, 4809-EP2298735A1, 4809-EP2298744A2, 4809-EP2298780A1, 4809-EP2302015A1, 4809-EP2305250A1, 4809-EP2305689A1, 4809-EP2305825A1, 4809-EP2308852A1, 4809-EP2311820A1, 4809-EP2316827A1, 4809-EP2316836A1, 4809-EP2316937A1, 4809-EP2371805A1, 4809-EP2374895A1, C07535, J10073, S-4361, A828066, A828067, Benzo[a]pyrene, vial of 1 g, analytical standard, C-29981, I14-2877, BRD-K09668667-001-02-0, Benzo[a]pyrene, certified reference material, TraceCERT(R), UNII-0TNN3Q0D4D component FMMWHPNWAFZXNH-UHFFFAOYSA-N, Benzo[a]pyrene, analytical standard, for environmental analysis, BENZO(A)PYRENE (SEE ALSO: BENZO(E)PYRENE (CAS 192-97-2)), Benzo[a]pyrene solution, 100 mug/mL in cyclohexane, analytical standard, Benzo[a]pyrene solution, certified reference material, 100 mug/mL in methylene chloride, 819804-28-9, Benzo[a]pyrene solution, certified reference material, TraceCERT(R), 1000 mug/mL in acetone, Benzo[a]pyrene solution, certified reference material, TraceCERT(R), 200 mug/mL in methylene chloride


ID: 609

chemical graph of compound 609



InChIKey: FMOKUKPRJSMPOI-QRPNPIFTSA-N
SMILES: CC(=O)C[C@@H]1CCCCN1.Cl

biological descriptors:

CFTR relevance: weak CFTR corrector

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

reference list:

"JW Hanrahan" "R Robert" "Y Luo" "KA Teske" "GW Carlile" "D Zhang" "DY Thomas"


CID is 72942005
synonyms found at PubChem are:
UNII-Q107JES56Y, Q107JES56Y, Pelletierine hydrochloride, (+)-, 2-Propanone, 1-(2S)-2-piperidinyl-, hydrochloride (1:1), 1250851-48-9, UNII-516910XH33 component FMOKUKPRJSMPOI-QRPNPIFTSA-N


ID: 610

chemical graph of compound 610



InChIKey: FMOKUKPRJSMPOI-UHFFFAOYSA-N
SMILES: CC(=O)CC1CCCCN1.Cl

biological descriptors:

CFTR relevance: weak CFTR corrector

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

reference list:

"JW Hanrahan" "R Robert" "Y Luo" "KA Teske" "GW Carlile" "D Zhang" "DY Thomas"


CID is 16667749
synonyms found at PubChem are:
PELLETIERINE HYDROCHLORIDE, 5984-61-2, Isopelletierine hydrochloride, Pelletierine hydrochloride [MI], (+/-)-Pelletierine hydrochloride, Pelletierine hydrochloride, (+/-)-, SPECTRUM300553, SCHEMBL4270933, 2-Propanone, 1-(2-piperidinyl)-, hydrochloride (1:1), CHEMBL3039396, CTK1E6396, CCG-38558, NCGC00095603-01, 2-Propanone, 1-(2-piperidinyl)-, hydrochloride, SR-05000002412, SR-05000002412-1


ID: 611

chemical graph of compound 611



InChIKey: FMQURVHYTBGYSQ-UHFFFAOYSA-H
SMILES: C1=CC(=CC(=C1)NC(=O)NC2=CC=CC(=C2)C(=O)NC3=C4C(=CC(=CC4=C(C=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])C(=O)NC5=C6C(=CC(=CC6=C(C=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[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:

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


CID is 4465
synonyms found at PubChem are:
NF-023, GTPL4266, MolPort-003-983-646, 1,3,5-trisodium 8-{[3-({[3-({4,6,8-tris[(sodiooxy)sulfonyl]naphthalen-1-yl}carbamoyl)phenyl]carbamoyl}amino)benzene]amido}naphthalene-1,3,5-trisulfonate, NF 023, 104869-31-0, NF 023 hydrate, CHEMBL216504, hexasodium 8-[[3-[[3-[(4,6,8-trisulfonatonaphthalen-1-yl)carbamoyl]phenyl]carbamoylamino]benzoyl]amino]naphthalene-1,3,5-trisulfonate, NCGC00016181-01, Lopac-N-8652, D0B7MW, AC1O1BH0, AC1L1I87, HMS3262B21, MFCD11046019, AKOS024456482, CCG-208808, LP00810, NCGC00016181-02, NCGC00094143-01, NCGC00261495-01, RT-014691, EU-0100810, N 8652, J-001279, 8,8'-(carbonyl-bis(imino-3,1-phenylenecarbonylimino))bis(naphthalene-1,3,5-trisulfonic acid)-hexasodium salt, 8,8'-[carbonylbis(imino-3,1-phenylene carbonylimino)]bis(1,3,5-naphthalene-trisulfonic acid) hexasodium salt, 8,8'-[Carbonylbis(imino-3,1-phenylene carbonylimino)]bis(1,3,5-naphthalene-trisulfonic acid) hexasodium salt hydrate, 8,8'-[carbonylbis(imino-3,1-phenylenecarbonylimino)]bis-1,3,5-naphthalene-trisulphonic acid, hexasodium salt


ID: 612

chemical graph of compound 612



InChIKey: FMZXNVLFJHCSAF-DNVCBOLYSA-N
SMILES: C1C(=C(N2[C@H](S1)[C@@H](C2=O)NC(=O)CC3=CC=CS3)C(=O)[O-])C[N+]4=CC=C(C=C4)C(=O)N

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 21743
synonyms found at PubChem are:
CEFALONIUM, Cephalonium, 5575-21-3, Cefalonum, Cefalonium hydrate, Cefalonium [INN-Latin], Cefalonio [INN-Spanish], Lilly 41071, UNII-K2P920217W, EINECS 226-948-7, BRN 4169337, C20H18N4O5S2, K2P920217W, 7-(alpha-Thienylacetamido)-3-(4-carbamoylpyridinomethyl)-3-cephem-4-carboxylic acid, DSSTox_CID_25388, DSSTox_RID_80845, DSSTox_GSID_45388, (6R,7R)-3-(4-(4-Carbamoyl-1-pyridiniomethyl)-8-oxo-7-(2-(2-thienyl)acetamido)-5-thia-1-azabicyclo(4.2.0)oct-2-en-2-carboxylat, 3-(4-Carbamoylpyridylmethyl)-8-oxo-7-(alpha-(thien-2-yl)acetamido)-5-thia-1-azabicyclo(4.2.0)oct-2-en-2carbonsaeure, Cefalonio, (6R,7R)-3-[(4-carbamoylpyridin-1-ium-1-yl)methyl]-8-oxo-7-[(2-thiophen-2-ylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate, Cefalonium [INN], Pyridinium, 4-carbamoyl-1-((2-carboxy-8-oxo-7-(2-(2-thienyl)acetamido)-5-thia-1-aza-bicyclo(4.2.0)oct-2-en-3-yl)methyl)- hydroxide, inner salt, Cefalonium [INN:BAN], NCGC00016657-01, Cefalonium (BAN), CAS-5575-21-3, Cepravin dry cow (TN), AC1L2IZP, SCHEMBL125252, CHEMBL2105567, DTXSID5045388, CHEBI:95345, CTK8F8515, MolPort-006-117-037, HMS1571G13, HMS2098G13, Pharmakon1600-01505997, Tox21_110548, NSC759292, AKOS026749802, Tox21_110548_1, API0006602, CCG-213999, NSC-759292, NCGC00179310-01, NCGC00179310-03, Q767, LS-132299, AB00513991, D07634, AB00513991_02


ID: 613

chemical graph of compound 613



InChIKey: FMZYZILCSUARND-ZENOOKHLSA-N
SMILES: C[C@]12CC[C@H](C[C@@H]1CCC3=C2C=C(C=C3)OC)O

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 6728946
synonyms found at PubChem are:
12-METHOXY-4,4-BISNOR-5alpha-8,11,13-PODOCARPATRIEN-3-OL, SPBio_001190, Spectrum2_001255, AC1O9AU6, CHEMBL3039053, CCG-39129, (2R,4aS,10aS)-6-methoxy-4a-methyl-2,3,4,9,10,10a-hexahydro-1H-phenanthren-2-ol


ID: 614

chemical graph of compound 614



InChIKey: FNDGLVOYAQNQPE-UHFFFAOYSA-N
SMILES: CN(C(CN1CCCC1)C2=CC(=CC=C2)OCC(=O)O)C(=O)CC3=CC(=C(C=C3)Cl)Cl.Cl

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 129407
synonyms found at PubChem are:
ICI 204,448 hydrochloride, 121264-04-8, ICI-204,448 hydrochloride, Ici 204448, 4,4'-(2-ACETYL-1,3-GLYCEROL)BISANHYDRO MELLITATE, MLS002153186, (RS)-[3-[1-[[(3,4-Dichlorophenyl)acetyl]methylamino]-2-(1-pyrrolidinyl)ethyl]phenoxy]acetic acid hydrochloride, R,S-[3-[1-[[(3,4-Dichlorophenyl)acetyl]methylamino]-2-(1-pyrrolidinyl)ethyl] phenoxy]-acetic acid hydrochloride, SR-01000075504, SMR001230677, AC1L2VJX, SCHEMBL3167955, CHEMBL1256750, CTK8F0814, FNDGLVOYAQNQPE-UHFFFAOYSA-N, MolPort-003-941-768, Tox21_500704, ICI 204,448 hydrochloride, solid, MFCD00153814, AKOS024458659, API0007622, CCG-222008, LP00704, N(1)-(2-(N-Methyl-3,4-dichlorophenylacetamido)-2-(3-carboxyphenyl)ethyl)pyrrolidine, NCGC00094056-01, NCGC00261389-01, RT-013314, EU-0100704, I-122, J-004474, SR-01000075504-1, SR-01000075504-3, 2-[3-[1-[[2-(3,4-dichlorophenyl)acetyl]-methylamino]-2-pyrrolidin-1-ylethyl]phenoxy]acetic acid hydrochloride, 3-{1-[2-(3,4-dichlorophenyl)-N-methylacetamido]-2-(pyrrolidin-1-yl)ethyl}phenoxyacetic acid hydrochloride, Acetic acid, (3-(1-(((3,4-dichlorophenyl)acetyl)methylamino)-2-(1-pyrrolidinyl)ethyl)phenoxy)-, monohydrochloride, (+-)-


ID: 615

chemical graph of compound 615



InChIKey: FNPXMHRZILFCKX-KAJVQRHHSA-N
SMILES: CCC(=O)OCC(=O)[C@]1(CC[C@@H]2[C@@]1(C[C@@H]([C@H]3[C@H]2CCC4=CC(=O)C=C[C@]34C)O)C)OC(=O)OCC

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 6714002
synonyms found at PubChem are:
PREDNICARBATE, Dermatop, 73771-04-7, Peitel, Hoe 777, Hoe-777, Dermatop E emollient, Prednitop, UNII-V901LV1K7D, Dermatop (TN), Prednicarbate (USP/INN), S-770777, MLS002154121, V901LV1K7D, [2-[(8S,9S,10R,11S,13S,14S,17R)-17-ethoxycarbonyloxy-11-hydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] propanoate, Prednicarbatum [INN-Latin], Prednicarbato [INN-Spanish], S-77 0777, Prednicarbato, Prednicarbatum, EINECS 277-590-3, S 770777, Prednicarbat, Regenit, 11beta,17,21-Trihydroxypregna-1,4-diene-3,20-dione 17-(ethyl carbonate) 21-propionate, NCGC00016926-01, Pregna-1,4-diene-3,20-dione, 17-((ethoxycarbonyl)oxy)-11-hydroxy-21-(1-oxopropoxy)-, (11beta)-, Prednicarbate [USAN:USP:INN:BAN], CAS-73771-04-7, Prestwick0_001044, Prestwick1_001044, Prestwick2_001044, Prestwick3_001044, D09IEE, SCHEMBL3941, DSSTox_CID_25502, DSSTox_RID_80919, DSSTox_GSID_45502, BSPBio_000968, SPBio_002904, AC1O8Q04, BPBio1_001066, GTPL7605, CHEMBL1200386, DTXSID9045502, CHEBI:135791, HMS1571A10, HMS2098A10, HMS2230O11, HMS3715A10, ZINC3938652, Tox21_110687, AKOS025402043, AC-3521, AN-6763, API0009173, CCG-221044, DB01130, NCGC00179357-01, BC226387, SC-81331, SMR001233428, AB2000755, AB00514017, D05601, 771P047, Prednisolone 17-(Ethyl Carbonate) 21-Propionate, SR-01000841201, Q-101379, SR-01000841201-2, BRD-K46137903-001-03-3, S 77 0777, S 77-0777, (11|A)-17-[(Ethoxycarbonyl)oxy]-11-hydroxy-21-(1-oxopropoxy)pregna-1,4-diene-3,20-dione, [2-[(8S,9S,10R,11S,13S,14S,17R)-17-ethoxycarbonyloxy-11-hydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxo-ethyl] propanoate, Pregna-1,4-diene-3,20-dione,17-[(ethoxycarbonyl)oxy]-11-hydroxy-21-(1-oxopropoxy)-, (11b)-


ID: 616

chemical graph of compound 616



InChIKey: FNQQBFNIYODEMB-UHFFFAOYSA-N
SMILES: CC1=C(C=C2C(=C1)CCCS2(=O)=O)S(=O)(=O)N

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 4165
synonyms found at PubChem are:
meticrane, 1084-65-7, Arresten, Fontiliz, 6-Methylthiochroman-7-sulfonamide 1,1-dioxide, Meticran, Meticranum [INN-Latin], Meticrano [INN-Spanish], UNII-I7EKN1924Q, Meticrane [INN:DCF:JAN], C10H13NO4S2, EINECS 214-112-4, E-103-E, SD 17102, I7EKN1924Q, 6-Methyl-7-sulfamido-thiochroman-1,1-dioxide, Thiochroman-7-sulfonamide, 6-methyl-, 1,1-dioxide, NCGC00016561-01, CAS-1084-65-7, 2H-1-Benzothiopyran-7-sulfonamide, 3,4-dihydro-6-methyl-, 1,1-dioxide, 6-Methyl-3,4-dihydro-2H-1-benzothiopyran-7-sulfonamide 1,1-dioxide, DSSTox_CID_25346, DSSTox_RID_80814, DSSTox_GSID_45346, Meticranum, Meticrano, 6-methyl-1,1-dioxo-3,4-dihydro-2H-thiochromene-7-sulfonamide, 6-Methylthiochroman-7-sulphonamide 1,1-dioxide;6-Methylthiochroman-7-sulfonamide 1,1-dioxide, SR-01000838874, Arresten (TN), Prestwick_881, AC1Q6TPB, Prestwick0_000011, Prestwick1_000011, Prestwick2_000011, Prestwick3_000011, 6-methyl-7-sulfamoylthiochroman 1,1-dioxide, Meticrane (JP17/INN), AC1L1HK4, SCHEMBL49070, BSPBio_000041, MLS002154170, Meticrane, analytical standard, SPBio_001962, BPBio1_000047, ZINC1718, CHEMBL1318341, DTXSID9045346, CHEBI:31839, CTK4A6055, FNQQBFNIYODEMB-UHFFFAOYSA-N, MolPort-002-070-500, HMS1568C03, HMS2095C03, HMS2235D06, HMS3371D22, HMS3712C03, Pharmakon1600-01506077, HY-B0908, Tox21 110495, Tox21_110495, 2541AH, NSC759309, AKOS016014038, Tox21_110495_1, API0019488, CCG-214046, NSC-759309, NCGC00016561-02, NCGC00016561-05, AJ-08074, SD-17102, SMR001233468, ZB000397, SBI-0207038.P001, AX8140024, KB-249210, LS-152602, TR-002132, FT-0725174, 6-Methylthiochroman-7-sulfonamide1,1-dioxide, D01605, C-54999, J-002149, SR-01000838874-2, SR-01000838874-3, BRD-K58265391-001-03-6, BRD-K58265391-001-06-9, 6-Methyl-3,4-dihydro-2H-thiochromene-7-sulfonamide 1,1-dioxide, 2H-1-Benzothiopyran-7-sulfonamide,3,4-dihydro-6-methyl-, 1,1-dioxide, 3,4-Dihydro-6-methyl-2H-1-benzothiopyran-7-sulfonamide 1,1-dioxide, 3,4-Dihydro-6-methyl-2H-1-benzothiopyran-7-sulfonamide- 1,1-dioxide, 6-Methyl-1-thia-1,2,3,4-tetrahydronaphthalene-7-sulfonamide 1,1-dioxide, 2H-1-Benzothiopyran-7-sulfonamide, 3,4-dihydro-6-methyl-, 1,1-dioxide (9CI)


ID: 617

chemical graph of compound 617



InChIKey: FNWNGQGTFICQJU-UHFFFAOYSA-N
SMILES: CC1=C(C(=C(C=C1)C(C)C)O)C(=O)O

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 11052
synonyms found at PubChem are:
2-Hydroxy-3-isopropyl-6-methylbenzoic acid, 548-51-6, o-Thymotic acid, o-Thymotinic acid, Orthothymotic acid, o-Thymolcarboxylic acid, 2-Thymolcarboxylic acid, 2-Thymotic acid, ORTHOTHYMOTINIC ACID, 3-Isopropyl-6-methylsalicylic acid, 6-Methyl-3-isopropylsalicylic acid, 3-Hydroxy-2-p-cymenecarboxylic acid, 3-Isopropyl-6 methyl salicylic acid, UNII-GF566F3K7L, 2-Methyl-5-isopropylsalicyclic acid, EINECS 208-949-4, NSC 68360, 3-Hydroxy-p-cymene-2-carboxylic acid, BRN 2578282, Benzoic acid, 2-hydroxy-6-methyl-3-(1-methylethyl)-, GF566F3K7L, p-CYMENE-2-CARBOXYLIC ACID, 3-HYDROXY-, 2-Hydroxy-6-methyl-3-(1-methylethyl)benzoic acid, 2-hydroxy-6-methyl-3-propan-2-ylbenzoic acid, Benzoic acid,2-hydroxy-6-methyl-3-(1-methylethyl)-, o-Thymotinsaure, Spectrum_001420, ACMC-1AVNZ, AC1L1WIK, Spectrum2_000438, Spectrum3_001779, Spectrum4_000088, Spectrum5_001130, AC1Q1OF7, BSPBio_003277, KBioGR_000356, KBioSS_001900, 3-10-00-00629 (Beilstein Handbook Reference), MLS002207117, SCHEMBL503619, SPBio_000456, CHEMBL1905986, CHEBI:93677, CTK5A2665, KBio2_001900, KBio2_004468, KBio2_007036, KBio3_002778, DTXSID80203279, FNWNGQGTFICQJU-UHFFFAOYSA-N, MolPort-001-792-258, ZINC389607, ALBB-014373, NSC68360, NSC76970, 5425AE, CCG-40250, NSC-68360, NSC-76970, AKOS005174254, VZ24721, 1012-86-8 (mono-hydrochloride salt), LS-58918, SMR001306720, DB-052656, KB-173041, TC-170544, FT-0632365, R1396, 2-Hydroxy-3-Isopropyl-6-Methyl-Benzoic Acid, 2-hydroxy-6-methyl-3-(propan-2-yl)benzoic acid, 6-methyl-2-oxidanyl-3-propan-2-yl-benzoic acid, 2-Hydroxy-3-isopropyl-6-methylbenzoic acid, 98%, A830383, Benzoicacid,2-hydroxy-6-methyl-3-(1-methylethyl)-, BRD-K95788524-001-02-4, I01-16067, Benzoic acid, 2-hydroxy-6-methyl-3-(1-methylethyl)- (9CI), InChI=1/C11H14O3/c1-6(2)8-5-4-7(3)9(10(8)12)11(13)14/h4-6,12H,1-3H3,(H,13,14


ID: 618

chemical graph of compound 618



InChIKey: FNYLWPVRPXGIIP-UHFFFAOYSA-N
SMILES: C1=CC=C(C=C1)C2=NC3=C(N=C2N)N=C(N=C3N)N

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 5546
synonyms found at PubChem are:
triamterene, 396-01-0, 6-phenylpteridine-2,4,7-triamine, 2,4,7-Triamino-6-phenylpteridine, Dyrenium, Triamteren, Dytac, Pterofen, Pterophene, Triamteril, Triteren, Ademin, Diurene, Noridil, Taturil, Teridin, Urocaudal, Ademine, Jatropur, Noridyl, Triampur, Diren, Ditak, Dyren, Teriam, Tri-Span, Triamteril complex, Trispan, Diucelpin, 6-Phenyl-2,4,7-pteridinetriamine, Triamterenum, Triamthiazid, Dinazide, Diutensat, Diuteren, Dyberzide, Dytenzide, Esiteren, Hidiurese, Hypertorr, Jenateren, Kalspare, Masuharmin, Renezide, Triamizide, Tricilone, Triurene, Amteren, Diarol, Hydrene, Isobar, Nephral, Reviten, Trizid, Uretren, Anjal, Dazid, Turfa, Apo-triazide, Thiazid Wolff, 2,4,7-Pteridinetriamine, 6-phenyl-, Ademin(e), Triamterena, Triazide, Fluss 40, SALI-PUREN, 6-Phenyl-2,4,7-triaminopteridine, SKF 8542, SK&F 8542, Triamterenum [INN-Latin], Triamterena [INN-Spanish], Triamterine, pter ophene, Pteridine, 2,4,7-triamino-6-phenyl-, 2,4,7-Triamino-6-fenilpteridina, UNII-WS821Z52LQ, Dyrenium (TN), BRN 0266723, CCRIS 5872, TRIAMTERENE USP, Pteridine deriv. 11, HSDB 3405, 2,4,7-Triamino-6-fenilpteridina [Italian], NCI C56042, C12H11N7, Triamterene [USAN:INN:BAN:JAN], EINECS 206-904-3, NSC 77625, NSC 639359, SK-8542, AI3-60017, WS821Z52LQ, NCI-C56042, NSC77625, NSC-77625, SK&F-8542, NCGC00016016-10, CAS-396-01-0, 6-PHENYL-2,4,7-TRIAMINO PTERIDINE, DSSTox_CID_1373, T 4143, DSSTox_RID_76117, DSSTox_GSID_21373, SR-01000002968, Triamtereno, Prestwick_480, Ademine(Triamterene), Dyazide (Salt/Mix), Triamterene [USAN:USP:INN:BAN:JAN], Spectrum_000508, Triamterene, >=99%, Prestwick0_000034, Prestwick1_000034, Prestwick2_000034, Prestwick3_000034, Spectrum2_000938, Spectrum3_001372, Spectrum4_000366, Spectrum5_001034, Lopac-T-4143, ACMC-1CT1F, CHEMBL585, D00NKB, Jorba Brand of Triamterene, AC1L1KL5, AC1Q52QZ, NCIOpen2_004741, Lopac0_001196, Oprea1_825704, SCHEMBL40707, BSPBio_000127, BSPBio_002924, KBioGR_000831, KBioSS_000988, 5-26-17-00447 (Beilstein Handbook Reference), KSC492C7T, MLS000069431, ARONIS23836, BIDD:GT0534, DivK1c_000433, SPECTRUM1500589, SPBio_000876, SPBio_002048, BDBM6644, BPBio1_000141, CHEBI:9671, Goldshield Brand of Triamterene, GTPL4329, Wellspring Brand of Triamterene, Jsp006872, Triamterene (JP15/USP/INN), Triamterene (JP17/USP/INN), 2,7-Triamino-6-phenylpteridine, 6-Phenyl-2,7-triaminopteridine, DTXSID6021373, CTK3J2179, HMS501F15, KBio1_000433, KBio2_000988, KBio2_003556, KBio2_006124, KBio3_002144, FNYLWPVRPXGIIP-UHFFFAOYSA-N, MolPort-001-641-070, NINDS_000433, HMS1568G09, HMS2092O17, HMS2095G09, HMS2232B04, HMS3259C08, HMS3263P13, HMS3371D10, HMS3652E10, HMS3712G09, Pharmakon1600-01500589, ZINC120286, 2,7-Pteridinetriamine, 6-phenyl-, Pteridine,4,7-triamino-6-phenyl-, BCP28855, EBD44439, HY-B0575, KS-00000X8I, KS-000046GO, 2,4,7-triamino-6-phenyl-pteridine, Tox21_110283, Tox21_202021, Tox21_302833, Tox21_501196, ANW-74763, BBL023360, CCG-40090, MFCD00006708, NSC639359, NSC757367, s4080, SBB017574, STK300348, AKOS003790819, Tox21_110283_1, CS-2682, DB00384, LP01196, LS-1250, MCULE-5832721534, NC00544, NSC-757367, RTR-015817, IDI1_000433, SmithKline Beecham Brand of Triamterene, SMP1_000147, NCGC00016016-01, NCGC00016016-02, NCGC00016016-03, NCGC00016016-04, NCGC00016016-05, NCGC00016016-06, NCGC00016016-07, NCGC00016016-08, NCGC00016016-09, NCGC00016016-11, NCGC00016016-12, NCGC00016016-13, NCGC00016016-14, NCGC00016016-15, NCGC00016016-16, NCGC00016016-18, NCGC00023458-03, NCGC00023458-04, NCGC00023458-05, NCGC00023458-06, NCGC00023458-07, NCGC00256495-01, NCGC00259570-01, NCGC00261881-01, AC-14066, AJ-11688, AN-23435, AS-12471, CJ-00900, CPD000059118, KB-67376, SAM002554937, SC-77320, SMR000059118, ST093702, ZB004096, SBI-0051163.P003, AB0011988, TR-015817, AB00052116, B2275, BB 0256885, EU-0101196, FT-0609936, ST24029840, Triamterene 1.0 mg/ml in Dimethyl Sulfoxide, Dyrenium|||2,4,7-Triamino-6-phenylpteridine, D00386, WLN: T66 BN DN GN JNJ CZ EZ HR& IZ, Z-0803, AB00052116_13, AB00052116_14, 396T010, A824641, I06-1678, SR-01000002968-2, SR-01000002968-4, SR-01000002968-6, BRD-K92049597-001-05-9, BRD-K92049597-001-10-9, Z275128596, Triamterene, European Pharmacopoeia (EP) Reference Standard, Triamterene, United States Pharmacopeia (USP) Reference Standard, Triamterene, Pharmaceutical Secondary Standard; Certified Reference Material


ID: 619

chemical graph of compound 619



InChIKey: FOCVUCIESVLUNU-UHFFFAOYSA-N
SMILES: C1CN1P(=S)(N2CC2)N3CC3

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 5453
synonyms found at PubChem are:
thiotepa, THIO-TEPA, 52-24-4, Triethylenethiophosphoramide, Thiophosphamide, Tiofosfamid, Tiofosyl, Thiofozil, Tespamin, Thioplex, Tiofozil, Girostan, Oncotepa, Tespamine, Thiotef, Stepa, Tio-tef, Thio-Tep, Oncotiotepa, Tifosyl, Oncothio-tepa, TESPA, TSPA, Thio-tepa S, Ledertepa, Thiotriethylenephosphoramide, TIO TEF, N,N',N''-Triethylenethiophosphoramide, Tris(1-aziridinyl)phosphine sulfide, tepadina, 1,1',1''-phosphorothioyltriaziridine, Thiophosphamidum, Triethylene thiophosphoramide, Triaziridinylphosphine sulfide, Tri(aziridin-1-yl)phosphine sulfide, Triethylenethiophosphorotriamide, Tris(ethylenimino)thiophosphate, CBC 806495, Phosphorothioic acid triethylenetriamide, Tris(aziridinyl)phosphine sulfide, Phosphine sulfide, tris(1-aziridinyl)-, Tri(ethyleneimino)thiophosphoramide, Aziridine, 1,1',1''-phosphinothioylidynetris-, NCI-C01649, NSC 6396, NSC-6396, N,N',N''-Triethylenethiophosphamide, SK 6882, Thiotepum [INN-Latin], Tiotepa [INN-Spanish], Tri-1-aziridinylphosphine sulfide, Tris(1-aziridinyl)phosphine sulphide, UNII-905Z5W3GKH, Phosphoric tri(ethyleneamide), C6H12N3PS, CCRIS 586, N,N',N''-Triethylenethiophosphortriamide, AI3-24916, HSDB 3258, NSC6396, 1,1',1''-Phosphinothioylidynetrisaziridine, N,N',N''-Triethylenephosphorothioic triamide, N,N',N''-Tri-1,2-ethanediylthiophosphoramide, EINECS 200-135-7, Thiophosphoramide, N,N',N''-tri-1,2-ethanediyl-, BRN 0145978, N,N',N''-Tri-1,2-ethanediylphosphorothioic triamide, WR-45312, MLS001333083, MLS003389372, 905Z5W3GKH, CHEBI:9570, Phosphorothioic triamide, N,N',N''-tri-1,2-ethanediyl-, AI 3-24916, FOCVUCIESVLUNU-UHFFFAOYSA-N, Phosphorothioic triamide, N,N',N''-triethylene-, NCGC00095042-04, NCGC00095042-06, DSSTox_CID_1339, tris(aziridin-1-yl)-thioxo-$l^{5}-phosphane, Tris(aziridinyl)-phosphine sulfide (thio-tepa), DSSTox_RID_76093, DSSTox_GSID_21339, AZIRIDINE,1,1',1''-PHOSPHINOTHIOYLIDYNETRIS-, Thiotepum, Tiotepa, CAS-52-24-4, SMR000058542, tris(aziridin-1-yl)-sulfanylidene-, SR-05000001855, Thiotepa [USP:INN:BAN:JAN], Thiotepa [USAN:INN:BAN:JAN], N,N',N"-Triethylenethiophosphamide, Tepadina (TN), Thioplex (TN), N,N',N"-Triethylenethiophosphoramide, Spectrum_001689, Thiophosphoramide, N,N',N"-triethylene-, WR 45312, Thiophosphoramide, N,N',N''-triethylene-, AC1L1KDQ, Spectrum2_001557, Spectrum3_001594, Spectrum4_000208, Spectrum5_001641, Aziridine, 1,1,1"-phosphinothioylidynetris-, CHEMBL671, D00YZA, Thioplex (TN) (Immunex), SCHEMBL4760, Phosphorothioic triamide, N,N',N"-triethylene-, Thiotepa (JAN/USP/INN), Triethylenethiop hosphoramide, Thio-TEPA, 98%, solid, BSPBio_003188, KBioGR_000815, KBioSS_002169, triethylenethiophosphortriamide, 4-20-00-00052 (Beilstein Handbook Reference), KSC917M9N, MLS001333084, MLS002207150, MLS006009972, ARONIS24177, BIDD:GT0127, DivK1c_000817, SPECTRUM1503324, SPBio_001434, GTPL7622, DTXSID0021339, CTK8B7696, HMS502I19, KBio1_000817, KBio2_002169, KBio2_004737, KBio2_007305, KBio3_002688, N,N''-Triethylenethiophosphamide, THIOPHOSPHRAMIDE,THIO-TEPA, AOB5373, 1,1,1-phosphorothioyltriaziridine, MolPort-001-783-551, NINDS_000817, HMS1922A14, HMS2093E05, HMS2232P17, HMS3372D10, N,N''-Triethylenethiophosphoramide, Pharmakon1600-01503324, BCP04110, KS-000010LT, ZINC1530867, Tox21_111399, Tox21_400065, ANW-58232, BDBM50418086, CCG-39776, LS-170, MFCD00145452, NSC758455, RW2156, AKOS005267118, CS-3119, DB04572, GC10080, MCULE-5478761622, NSC-758455, RL03925, RTR-018556, 1,1''-Phosphinothioylidynetrisaziridine, IDI1_000817, Thiophosphoramide,N',N'' -triethylene-, NCGC00095042-01, NCGC00095042-02, NCGC00095042-03, NCGC00095042-05, NCGC00095042-07, NCGC00095042-08, NCGC00095042-09, PHOSPHOROTHIOIC TRI(ETHYLENEAMIDE), AN-41625, AS-16885, HY-17574, KB-81272, N,N''-Triethylenephosphorothioic triamide, NCI60_013117, SC-27282, SBI-0051814.P002, tris(1-aziridinyl)-sulfanylidenephosphorane, tris(aziridin-1-yl)-lambda-phosphanethione, AB0006704, AB2000286, Aziridine,1',1''-phosphinothioylidynetris-, N,N''-Tri-1,2-ethanediylthiophosphoramide, Phosphorothioic triamide,N',N''-triethylene, Thiophosphoramide, N,N',N'' -triethylene-, TR-018556, tris(aziridin-1-yl)-lambda5-phosphanethione, Aziridine,1,1',1'-phosphinothioylidynetris-, FT-0082517, FT-0600281, tris(aziridin-1-yl)-$l;{5}-phosphanethione, tris(aziridin-1-yl)-sulfanylidenephosphorane, WLN: T3NTJ APS&- AT3NTJ&- AT3NTJ, Y0223, 1-[Di(1-aziridinyl)phosphorothioyl]aziridine #, C07641, D00583, Phosphorothioic triamide, N,N',N''-triethylene, Thiophosphoramide,N',N''-tri-1,2-ethanediyl-, Z-0841, 24126-EP2272827A1, 24126-EP2272832A1, 24126-EP2275420A1, 24126-EP2280012A2, 24126-EP2292615A1, 24126-EP2295055A2, 24126-EP2295416A2, 24126-EP2295426A1, 24126-EP2295427A1, 24126-EP2298748A2, 24126-EP2298764A1, 24126-EP2298765A1, 24126-EP2298768A1, 24126-EP2298778A1, 24126-EP2301928A1, 24126-EP2305642A2, 24126-EP2308833A2, 24126-EP2311453A1, 24126-EP2314590A1, AB00052346-06, AB00052346_07, N,N',N''-Tri-1,2-et hanediylthiophosphoramide, 145T452, A828998, N,N''-Tri-1,2-ethanediylphosphorothioic triamide, 1-(DI(1-AZIRIDINYL)PHOSPHOROTHIOYL)AZIRIDINE, I09-1625, Q-201826, SR-05000001855-1, SR-05000001855-5, tris(aziridin-1-yl)-sulfanylidene-$l^{5}-phosphane, BRD-K09631521-001-05-7, Phosphorothioic triamide,N',N''-tri-1,2-ethanediyl-, TRIS(AZIRIDIN-1-YL)-LAMBDA(5)-PHOSPHANETHIONE, Tiofosyl;Tiofosfamid;Triethylenethiophosphoramide;Thioplex, Z2574360269, Thiotepa, United States Pharmacopeia (USP) Reference Standard, 1631739-26-8, 639-23-6, 85177-92-0


ID: 620

chemical graph of compound 620



InChIKey: FOGDPGQSHLLYIK-XYQGXRRISA-N
SMILES: C[C@@H]1CC(=O)[C@]2([C@@H](O1)O[C@@H]3[C@H]([C@@H]([C@@H]([C@@H]([C@H]3O2)NC)O)NC)O)O.Cl.Cl

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 64740
synonyms found at PubChem are:
Spectinomycin dihydrochloride, 21736-83-4, actinospectacin, Spectinomycin hydrochloride, Spectinomycin HCl, Spectinomycin (dihydrochloride), Spectinomycin dihydrochloride pentahydrate, CHEBI:9216, Spectinomycin hydrochloride anhydrous, EN300-74585, DSSTox_CID_25429, DSSTox_RID_80873, DSSTox_GSID_45429, 22189-32-8, UNII-296JEI210Z, (2R,4aR,5aR,6S,7S,8R,9S,9aR,10aS)-4a,7,9-trihydroxy-2-methyl-6,8-bis(methylamino)decahydro-4H-benzo[b]pyrano[2,3-e][1,4]dioxin-4-one dihydrochloride, Spectinomycin hydrochloride hydrate, 296JEI210Z, (+)-Spectinomycin Dihydrochloride, SR-05000001868, Spectinomycin 2HCl, Prestwick_106, NCGC00016754-01, CAS-21736-83-4, SCHEMBL184452, SPECTRUM1500538, AC1L21U2, CHEMBL3184600, DTXSID9045429, FOGDPGQSHLLYIK-XYQGXRRISA-N, MolPort-003-666-283, HMS1570B09, HMS1920P22, HY-B0438, Tox21_110592, CCG-39253, s2510, AKOS016010051, Tox21_110592_1, API0004215, CS-2544, NE47662, NCGC00017354-07, AK115166, CC-34517, AB2000613, AX8151790, S0584, ST24049298, (2R,4aR,5aR,6S,7S,8R,9S,9aR,10aS)-decahydro-4a,7,9-trihydroxy-2-methyl-6,8-bis(methylamino)-4H-pyrano[2,3-b][1,4]benzodioxin-4-one Hydrochloride, C11619, C-21807, SR-05000001868-3, SR-05000001868-5, W-107526, Spectinomycin hydrochloride, Antibiotic for Culture Media Use Only, (1R,3S,5R,8R,10R,11S,12S,13R,14S)-8,12,14-trihydroxy-5-methyl-11,13-bis(methylamino)-2,4,9-trioxatricyclo[8.4.0.0?,?]tetradecan-7-one dihydrochloride, (2R,4aR,5aR,6S,7S,8R,9S,9aR,10aS)-4a,7,9-trihydroxy-2-methyl-6,8-bis(methylamino)decahydro-4H-pyrano[2,3-b][1,4]benzodioxin-4-one dihydrochloride, (2R,4aR,5aR,6S,7S,8R,9S,9aR,10aS)-4a,7,9-trihydroxy-N,N',2-trimethyl-4-oxodecahydro-2H-pyrano[2,3-b][1,4]benzodioxine-6,8-diaminium dichloride, Spectogard, Stanilo, Spectam Scour Halt, EINECS 244-554-3, Trobicin, 1695-77-8 (Parent), 4H-Pyrano(2,3-b)(1,4)benzodioxin-4-one, decahydro-4a,7,9-trihydroxy-2-methyl-6,8-bis(methylamino)-, dihydrochloride, (2R,4aR,5aR,6S,7S,8R,9S,9aR,10aS)-, 4H-Pyrano(2,3-b)(1,4)benzodioxin-4-one, decahydro-4a,7,9-trihydroxy-2-methyl-6,8-bis(methylamino)-, dihydrochloride, (2R-(2-alpha,4a-beta,5a-beta,6-beta,7-beta,8-beta,9-alpha,9a-alpha,10a-beta))-, Spectinomycin Hydrochloride (anhydrous), Spectinomycin Dihydrochloride, Anhydrous, NSC 248616, AC1MHWL1, LS-127328, Spectinomycin hydrochloride


ID: 621

chemical graph of compound 621



InChIKey: FOIVPCKZDPCJJY-JQIJEIRASA-N
SMILES: C/C(=C\C1=CC=C(C=C1)C(=O)O)/C2=CC3=C(C=C2)C(CCC3(C)C)(C)C

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 5289501
synonyms found at PubChem are:
TTNPB, Arotinoid acid, 71441-28-6, Arotinoic acid, Ro 13-7410, CCRIS 3297, AGN 191183, UNII-673M8C29UR, 4-[(E)-2-(5,6,7,8-Tetrahydro-5,5,8,8-tetramethyl-2-naphthalenyl)-1-propenyl]benzoic acid, Tocris-0761, Lopac-T-3757, AGN-191183, BRN 2008247, CHEMBL275311, CHEBI:75261, 673M8C29UR, 4-(2-(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthalenyl)-1-propenyl)benzoic acid, (E)-4-(2-(5,6,7,8-Tetrahydro-5,5,8,8-tetramethyl-2-naphthalenyl)-1-propen-1-yl)benzoic acid, p-((E)-2-(5,6,7,8-Tetrahydro-5,5,8,8-tetramethyl-2-naphthyl)propenyl)benzoic acid, 4-(2-(5,6,7,8-Tetrahydro-5,5,8,8-tetramethyl-2-naphthenyl)-1E-propen-1-yl)benzoic acid, 4-[(E)-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)prop-1-enyl]benzoic acid, (E)-4-(2-(5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)prop-1-en-1-yl)benzoic acid, 4-[(1E)-2-(5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRONAPHTHALEN-2-YL)PROP-1-ENYL]BENZOIC ACID, Benzoic acid, 4-(2-(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthalenyl)-1-propenyl)-, (E)-, SR-01000076154, arotinoid Ro-137410, 1xap, 4-[2-(5,6,7,8-TETRAHYDRO-5,5,8,8-TETRAMETHYL-2-NAPHTHENYL)-1E-PROPEN-1-YL]BENZOIC ACID, Ttnpb(arotinoid acid), AC1NRDEA, Spectrum5_001943, TTNPB (Arotinoid Acid), D0G6JM, DSSTox_CID_20743, DSSTox_GSID_40743, Lopac0_001176, BSPBio_001532, MLS002153338, SCHEMBL177444, T3757_SIGMA, BML2-E10, GTPL2646, DTXSID6040743, 4-[2-(5,5,8,8-Tetramethyl-5,6,7,8-tetrahydro-naphthalen-2-yl)-propenyl]-benzoic acid, FOIVPCKZDPCJJY-JQIJEIRASA-N, MolPort-003-959-717, HMS1361M14, HMS1791M14, HMS1989M14, HMS2232G03, HMS3263L13, HMS3402M14, Benzoic acid,4-[(1E)-2-(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthalenyl)-1-propen-1-yl]-, ZINC4475360, Tox21_304044, Tox21_501176, BDBM50032219, MFCD00673917, s4627, AKOS024458636, CCG-205250, CS-3253, DB02877, LP01176, Ro-137410, (e)-4-(2-(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthalenyl)-1-propenyl)benzoic acid, (e)-4-(2-(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-napthalenyl)-1-propenyl) benzoic acid, IDI1_034002, NCGC00016015-01, NCGC00016015-02, NCGC00016015-03, NCGC00016015-04, NCGC00016015-05, NCGC00016015-06, NCGC00016015-07, NCGC00016015-08, NCGC00016015-09, NCGC00016015-10, NCGC00024775-01, NCGC00024775-02, NCGC00024775-03, NCGC00024775-04, NCGC00024775-05, NCGC00024775-06, NCGC00024775-07, NCGC00024775-08, NCGC00261861-01, NCGC00357251-01, BC251620, HY-15682, LS-38311, SMR001230750, CAS-71441-28-6, EU-0101176, Ro 13-7410;Arotinoid acid;AGN191183, X6862, C15634, T 3757, 102723-EP2272841A1, 102723-EP2301936A1, 102724-EP2272841A1, 102724-EP2301936A1, SR-01000076154-1, SR-01000076154-3, SR-01000076154-5, BRD-K49685476-001-02-7, BRD-K49685476-001-05-0, (e)-4-(2-(5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)prop-1-enyl)benzoic acid, 4-(2-(5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)prop-1-enyl)benzoic acid, p-[(E)-2-(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthyl)propenyl]-benzoic acid, (E)-4-[2-(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthylenyl)-1 -propenyl] benzoic acid, 4-[(1E)-2-(5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)prop-1-en-1-yl]benzoic acid, 4-[(E)-2-(5,5,8,8-Tetramethyl-5,6,7,8-tetrahydro-naphthalen-2-yl)-propenyl]-benzoic acid


ID: 622

chemical graph of compound 622



InChIKey: FOJWIEHQODXJCL-UHFFFAOYSA-N
SMILES: C(C1=C(SCC(=O)OC)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:

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


CID is 46196543


ID: 623

chemical graph of compound 623



InChIKey: FOWAIJYHRWFTHR-UHFFFAOYSA-N
SMILES: C1=CC(=CC(=C1)Cl)N=C(N)N=C(N)N.Cl

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 16444
synonyms found at PubChem are:
1-(3-Chlorophenyl)biguanide hydrochloride, 2113-05-5, m-chlorophenylbiguanide hydrochloride, 1-(m-Chlorophenyl)-biguanide hydrochloride, m-CPBG hydrochloride, 1-(3-CHLOROPHENYL)BIGUANIDE HCL, 1-(m-Chlorophenyl)biguanide hydrochloride, 1-carbamimidamido-N-(3-chlorophenyl)methanimidamide hydrochloride, Imidodicarbonimidic diamide, N-(3-chlorophenyl)-, monohydrochloride, N-m-Chlorophenylbiguanide hydrochloride, SR-01000075547, BIGUANIDE, 1-(m-CHLOROPHENYL)-, MONOHYDROCHLORIDE, N-(3-Chlorophenyl)imidodicarbonimidic diamide hydrochloride, N-(3-Chlorophenyl)-imidodicarbonimidic diamide monohydrochloride, ACMC-20apbq, AC1MBRPQ, EU-0100343, MLS001056739, SCHEMBL1320574, CHEMBL1256027, CTK1A2803, KS-00000LTE, DTXSID80175361, MolPort-001-756-912, ZX-AT005881, Tox21_500343, BN0321, MFCD00053019, NSC210906, OR0928, SBB100366, AKOS023093273, CCG-221647, LP00343, MCULE-2237141498, NSC-210906, PS-7507, VZ20899, KS-00003R36, NCGC00093781-01, NCGC00261028-01, KB-17058, SMR000326726, TC-172493, B6306, C-144, FT-0634040, ST50825927, K-0005, 1-(3-Chlorophenyl)biguanide hydrochloride, solid, C-15185, J-013867, SR-01000075547-1, SR-01000075547-3, {[(3-Chloroanilino)(imino)methyl]amino}methanimidamide hydrochloride, 2-(3-chlorophenyl)-1-(diaminomethylidene)guanidine hydrochloride, amino{[(3-chlorophenyl)amino]iminomethyl}carboxamidine, chloride, Imidodicarbonimidicdiamide, N-(3-chlorophenyl)-, hydrochloride (1:1), NSC 210906, AI3-60023, 48144-44-1 (Parent), Imidodicarbonimidic diamide, N-(3-chlorophenyl)-, monohydrochloride (9CI), C8H10ClN5.HCl, LS-43875


ID: 624

chemical graph of compound 624



InChIKey: FPHMSKWSSWNMQV-UHFFFAOYSA-M
SMILES: CC1=CC(=CN2C1=NC3=[N+](C2)C=C(C=C3C)Br)Br.[I-]

biological descriptors:

CFTR relevance: inactive

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

reference list:

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


CID is 10696617


ID: 625

chemical graph of compound 625



InChIKey: FPLMIPQZHHQWHN-UHFFFAOYSA-N
SMILES: COC1=C(C=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:

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


CID is 5281699
synonyms found at PubChem are:
Tamarixetin, 603-61-2, 4'-Methoxyquercetin, 4'-O-Methylquercetin, Quercetin 4'-methyl ether, UNII-73WRA8Z8M8, 3,3',5,7-Tetrahydroxy-4'-methoxyflavone, 4'-O-Methyl Quercetin, Quercetin-4'-methylether, 73WRA8Z8M8, CHEMBL226034, CHEBI:67492, 3,5,7-Trihydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-benzopyrone, 3,5,7-trihydroxy-2-(3-hydroxy-4-methoxyphenyl)-4H-chromen-4-one, 4'-Methoxy-3,3',5,7-tetrahydroxyflavone, Tamaraxetin, 3-O-rhamnopyranosyl-1-2-glucopyranoside, 3-O-alpha-L-rhamnopyranosyl-1-2-beta-D-glucopyranoside, AC1NQYX7, D06PZE, C10188, SCHEMBL892776, DTXSID00209056, FPLMIPQZHHQWHN-UHFFFAOYSA-N, MolPort-001-741-910, ZINC6484604, BDBM50325674, LMPK12110606, AKOS024287252, MCULE-8124433804, 4H-1-Benzopyran-4-one, 3,5,7-trihydroxy-2-(3-hydroxy-4-methoxyphenyl)- (9CI), 4'-methoxy-3,5,7,3'-tetrahydroflavone, CC-34633, FT-0603487, W2755, C-19473, 3,5,7-trihydroxy-2-(3-hydroxy-4-methoxyphenyl)chromen-4-one, 3,5,7-Trihydroxy-2-(3-hydroxy-4-methoxy-phenyl)-chromen-4-one, 3,5,7-Trihydroxy-2-(3-hydroxy-4-methoxyphenyl)-4H-1-benzopyran-4-one, 4H-1-Benzopyran-4-one,3,5,7-trihydroxy-2-(3-hydroxy-4-methoxyphenyl)-


ID: 626

chemical graph of compound 626



InChIKey: FPOQLQZHRCEVOT-UHFFFAOYSA-N
SMILES: C1=CC=C(C=C1)CC(=O)NO

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 220184
synonyms found at PubChem are:
N-HYDROXY-2-PHENYLACETAMIDE, N-Hydroxy-2-phenyl-acetamide, PHENYLACETOHYDROXAMIC ACID, 5330-97-2, CHEMBL152665, FPOQLQZHRCEVOT-UHFFFAOYSA-N, 2-phenylethanehydroxamic acid, NSC2544, benzylhydroxamic acid, n-hydroxyphenylacetamide, AC1Q5QCW, Spectrum2_001716, Spectrum3_001684, N-hydroxy-phenyl-acetamide, AC1L58DD, BSPBio_003208, SPECTRUM210031, SCHEMBL213873, SPBio_001732, CHEBI:93303, CTK1H4422, KBio3_002428, DTXSID80277490, MolPort-002-479-420, HMS1923A21, NSC-2544, BDBM50015094, CCG-39445, SBB086771, ZINC16887669, AKOS000184738, MCULE-5154879216, NCGC00095226-01, NCGC00095226-02, NCGC00095226-03, NCGC00095226-04, KB-58301, FT-0693745, ST51029581, 330H972, AD-266/40386900, BRD-K74112339-001-02-7, BRD-K74112339-001-03-5


ID: 627

chemical graph of compound 627



InChIKey: FQEQMASDZFXSJI-BPCQOVAHSA-N
SMILES: C1CCN2CC3CC([C@@H]2C1)CN4C3=CC=CC4=O

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 228640
synonyms found at PubChem are:
Thermopsine, Rhombinin, NSC21725, AC1L5GDH, AC1Q6APS, Spectrum2_001627, Spectrum4_001842, Spectrum5_000344, KBioGR_002244, THERMOPSINE PERCHLORATE, SPBio_001693, SDCCGMLS-0066774.P001


ID: 628

chemical graph of compound 628



InChIKey: FQPFAHBPWDRTLU-UHFFFAOYSA-N
SMILES: CN1C2=C(C(=O)N(C1=O)C)NC=N2.CN1C2=C(C(=O)N(C1=O)C)NC=N2.C(CN)N

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 9433
synonyms found at PubChem are:
aminophylline, 317-34-0, Aminophyllin, Theophyllamine, Cardophyllin, Phyllocontin, Somophyllin, Truphylline, Theophylline ethylenediamine, Cardiofilina, Ethophylline, Metaphylline, Methophylline, Peterphyllin, Syntophyllin, Theophyldine, Theophyllaminum, Variaphylline, Aminocardol, Ammophyllin, Cardiomin, Cardophylin, Cariomin, Diaphylline, Diophllin, Diuxanthine, Eurphyllin, Euufillin, Genophyllin, Grifomin, Inophylline, Linampheta, Lixaminol, Metaphyllin, Minaphil, Miofilin, Neophyiline, Norofilina, Phylcardin, Phyllindon, Stenovasan, Theodrox, Theolamine, Theolone, Thephyldine, Vasofilina, Aminodur, Carena, Lasodex, Somophyllin O, Aminophylline Dye Free, Euphylline, Euphyllin, Diaphilline, Euphyllinum, Diophyllin, DOBO, Euufilin, Theomin, Rectalad aminophylline, Rectalad-aminophylline, Theophyllaminium, Theophyllin aethylendiamin, Aminodur dura-tabs, Theophyline ethylenediamine, Theophyllin ethylenediamine, Eufilina [Polish], Eufilina, Aminophylline ethylenediamine, Aminofillina [DCIT], Etilen-xantisan tabl., Aminofilina [Spanish], Dura-Tab S.M. Aminophylline, Aminophylline Anhydrous, Somopphyllin, Dura-tab sm aminophylline, Aminofilina [INN-Spanish], Aminophyllinum [INN-Latin], Aminofilina, Aminofillina, Diaphyllin, Mudrane GG Tablets, Phyllotemp, UNII-27Y3KJK423, HSDB 221, Theophyllinum et ethylendiaminum, Theophylline compound with ethylenediamine, Mudrane GG-2 Tablets, Theophyllin aethylendiamin [German], NSC 7919, EINECS 206-264-5, TH/100, Aminophylline dihydrate, 1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-, compd. with 1,2-ethanediamine (2:1), BY 108, AMINOPHYLLINE IN SODIUM CHLORIDE 0.45%, Theophylline, compd with ethylenediamine (2:1), 27Y3KJK423, Ethylenediamine, compd. with theophylline (1:2), Theophylline compound with ethylenediamine (2:1), Theophylline, compd. with ethylenediamine (2:1), Somophyllin-O, 1,3-dimethyl-7H-purine-2,6-dione; ethane-1,2-diamine, AMINOPHYLLINE IN SODIUM CHLORIDE 0.45% IN PLASTIC CONTAINER, 1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-, compd with 1,2-ethanediamine (2:1), 3,7-Dihydro-1,3-dimethyl-1H-purine-2,6-dione compd. with 1,2-ethanediamine (2:1), Aminophyllinum, Euphyllin Retard, Theophylline-Ethylenediamine Anhydrous, C7H8N4O2, Mundiphyllin Retard, Pulmophyllin (new), Pulmophylline (new), 95646-60-9, 1,3-dimethyl-7H-purine-2,6-dione;ethane-1,2-diamine, Aminocadol, A 1755, Aminophylline [INN:BAN:JAN], Prestwick_93, Somophyllin (TN), Phyllocontin-350, Aminophylline [USP:INN:BAN:JAN], C16H24N10O4, Etilen-xantisan tabl, Ammonium Carbonate NF, 3,7-Dihydro-1,3-dimethyl-1H-purine-2,6-dione, cmpd. with 1,2-ethanediamine (2:1), Lopac-A-1755, Aminophylline (USP/INN), Aminophylline (Truphylline), SCHEMBL5037, Aminophylline Anhydrous Powder, AC1L1T14, CHEBI:2659, Aminophylline, >=98%, powder, CHEMBL1370561, bis(constant-T); ethylenediamine, ethylenediamine; bis(theophylline), FQPFAHBPWDRTLU-UHFFFAOYSA-N, MolPort-004-959-540, MolPort-006-069-308, Theophylline ethylenediamine (TN), (Theophylline)2 . Ethylenediamine, HMS1570D21, HMS2097D21, HMS3260C09, HMS3655A19, HMS3714D21, BCP23387, HY-B0140, Tox21_500014, MFCD00013221, AKOS015951253, AKOS015960458, Aminophylline, anhydrous, 98% 25g, BCP9000293, CCG-220820, CCG-221318, CS-1936, DB01223, KS-5340, LP00014, Aminophylline(Phyllocontin, Truphylline), NCGC00016113-01, NCGC00016113-02, NCGC00016113-03, NCGC00093539-01, NCGC00260699-01, AC-11138, AN-44247, CAS-317-34-0, Theophylline hemi(ethylenediamine) complex, BCP0726000247, AB1009250, LS-149548, A2805, EU-0100014, FT-0622295, ST50298827, D00227, SR-01000872628, SR-01000872628-1, W-106881, 1,3-dimethyl-1H-purine-2,6(3H,7H)-dione compound with ethane-1,2-diamine (2:1), 1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione compound with ethane-1,2-diamine (2:1), 1,3-dimethyl-3,9-dihydro-1H-purine-2,6-dione compound with ethane-1,2-diamine (2:1), 1H-Purine-2,6-dione, 3,9-dihydro-1,3-dimethyl-, compd. with 1,2-ethanediamine (2:1), 1,3-dimethyl-1,3-dihydropurine-2,6-dione, 1,3-dimethyl-1,3-dihydropurine-2,6-d ione, ethane-1,2-diamine, 12767-26-9, 1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-, compd. with 1,2-ethanediamine (2:1), mixt. with 3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione, 442519-87-1, 8013-40-9, 80186-94-3


ID: 629

chemical graph of compound 629



InChIKey: FQRUARKLFVTIIK-UHFFFAOYSA-N
SMILES: COC1=CC2=C(C=C1)C(=O)C=C(O2)C3=CC=C(C=C3)F

biological descriptors:

CFTR relevance: inactive

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

reference list:

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


CID is 10378415
synonyms found at PubChem are:
CHEMBL344504, 2-(4-fluorophenyl)-7-methoxy-4H-chromen-4-one, D0G6MA, 4'-Fluoro-7-methoxyflavone, SCHEMBL9142214, BDBM50310198, ZINC27557271, 2-(4-Fluoro-phenyl)-7-methoxy-chromen-4-one


ID: 630

chemical graph of compound 630



InChIKey: FQTXPVLCCDQRHY-UHFFFAOYSA-N
SMILES: CC(C1=C(C(=CC=C1)Cl)Cl)N.Cl

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 11957540
synonyms found at PubChem are:
39959-66-5, 1-(2,3-Dichlorophenyl)ethanamine hydrochloride, LY 78335, (+/-)-2,3-Dichloro-alpha-methylbenzylamine hydrochloride, EU-0100476, SCHEMBL1321451, CHEMBL1255749, CTK8F1484, KS-00000TZV, DTXSID80474684, DCMB hydrochloride; LY-78335, MolPort-003-940-937, Tox21_500476, 1-(2,3-dichlorophenyl)ethanamine hcl, AKOS024457957, CCG-221780, LP00476, ACM39959665, NCGC00093885-01, NCGC00093885-02, NCGC00261161-01, DS-19653, D-103, 2,3-Dichloro-?-methylbenzylamine hydrochloride, SR-01000075609, SR-01000075609-1, (?)-2,3-Dichloro-alpha-methylbenzylamine hydrochloride, (y)-2,3-Dichloro-alpha-methylbenzylamine hydrochloride, ( inverted question mark)-2,3-Dichloro-alpha-methylbenzylamine hydrochloride


ID: 631

chemical graph of compound 631



InChIKey: FQWLMRXWKZGLFI-BQYFGGCBSA-N
SMILES: C1=CC(=CC=C1/C=C/C2=CC(=CC3=C2[C@@H]([C@H](O3)C4=CC=C(C=C4)O)C5=CC(=CC(=C5)O)O)O)O

biological descriptors:

CFTR relevance: CFTR inhibitor

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

reference list:

"T Ma" "H Yang" "Y Zhang" "Y Sui" "B Yu" "X Gao"


CID is 5315233
synonyms found at PubChem are:
(+)-epsilon-Viniferin, Trans-E-Viniferin, UNII-0AF07924BM, CHEBI:76137, 0AF07924BM, trans-epsilon-Viniferin, Viniferin, 129170-22-5, 5-[(2S,3S)-6-hydroxy-2-(4-hydroxyphenyl)-4-[(E)-2-(4-hydroxyphenyl)ethenyl]-2,3-dihydro-1-benzofuran-3-yl]benzene-1,3-diol, 5-{(2S,3S)-6-hydroxy-2-(4-hydroxyphenyl)-4-[(E)-2-(4-hydroxyphenyl)ethenyl]-2,3-dihydro-1-benzofuran-3-yl}benzene-1,3-diol, AC1NSSU1, (+)-trans-epsilon-viniferin, CHEMBL498439, SCHEMBL13004136, 253435-07-3, ZINC5722187, 1,3-Benzenediol, 5-((2S,3S)-2,3-dihydro-6-hydroxy-2-(4-hydroxyphenyl)-4-((1E)-2-(4-hydroxyphenyl)ethenyl)-3-benzofuranyl)-


ID: 632

chemical graph of compound 632



InChIKey: FQZYTYWMLGAPFJ-OQKDUQJOSA-N
SMILES: CC/C(=C(\C1=CC=CC=C1)/C2=CC=C(C=C2)OCCN(C)C)/C3=CC=CC=C3.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:

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


CID is 2733525
synonyms found at PubChem are:
Tamoxifen citrate, 54965-24-1, Istubal, Tamoxifen (Citrate), Zitazonium, UNII-7FRV7310N6, I.C.I. 46474 citrate, Tamoxifen citrate salt, ICI 46474, Farmifeno, Ginarsan, Jenoxifen, Ledertam, Nourytan, Noxitem, Oncotam, Tafoxen, Tamofen, Tamoplex, Tamoxasta, Tamoxifen Citrate (Nolvadex), Terimon, Zynoplex, Emblon, Nolgen, Noltam, Zemide, Genox, Tamax, Taxus, Tamox-Puren, 7FRV7310N6, Z-Tamoxifen citrate, NSC180973, NCGC00024928-06, CAS-54965-24-1, DSSTox_CID_1301, N,N-Dimethyl-2-(p-(1,2-diphenyl-1-butenyl)phenoxy)ethylamine citrate, DSSTox_RID_76068, Ethylamine, 2-(p-(1,2-diphenyl-1-butenyl)phenoxy)-N,N-dimethyl-, citrate (Z)-, DSSTox_GSID_21301, CCRIS 6718, Caditam, EINECS 259-415-2, ICI 46,474, 7244-97-5, Ethanamine, 2-(4-(1,2-diphenyl-1-butenyl)phenoxy)-N,N-dimethyl-, (Z)-, 2-hydroxy-1,2,3-propanetricarboxylate, SMR000677949, SR-01000075523, citro; tamoxifen, trans-1-(p-beta-Dimethylaminoethoxyphenyl)-1,2-diphenylbut-1-ene citrate, (Z)-2-(p-(1,2-Diphenyl-1-butenyl)phenoxy)-N,N-dimethylethylamine citrate (1:1), 2-[4-[(Z)-1,2-diphenylbut-1-enyl]phenoxy]-N,N-dimethylethanamine;2-hydroxypropane-1,2,3-tricarboxylic acid, Prestwick_458, Tamoxifen citrate [USAN:USP:JAN], Tamoxifen (Nolvadex), Tamoxifen Citrate,(S), Tamoxifen, citrate salt, AC1MBZ3O, Lopac-T-9262, CHEMBL786, SCHEMBL6365, MLS001055370, MLS002154210, ARONIS23853, SPECTRUM1500557, Nolvadex (TN) (AstraZeneca), DTXSID8021301, Tamoxifen citrate (JP17/USP), HMS500M20, Tamoxifen citrate salt, >=99%, FQZYTYWMLGAPFJ-OQKDUQJOSA-N, HMS1568M14, HMS1921C13, HMS2092K17, HMS2095M14, HMS2232E08, HMS3263B08, HMS3712M14, Pharmakon1600-01500557, (2-{4-[1,2-diphenylbut-1-en-1-yl]phenoxy}ethyl)dimethylamine; 2-hydroxypropane-1,2,3-tricarboxylic acid, (Z)-(2-(4-(1,2-Diphenylbut-1-enyl)phenoxy)ethyl)dimethylammonium dihydrogen 2-hydroxypropane-1,2,3-tricarboxylate, 10540-29-1 (Parent), 2-{4-[(1Z)-1,2-diphenylbut-1-en-1-yl]phenoxy}-N,N-dimethylethanamine 2-hydroxypropane-1,2,3-tricarboxylate (salt), Ethanamine, 2-(4-(1,2-diphenyl-1-butenyl)phenoxy)-N,N-dimethyl, (Z)-, 2-hydroxy-1,2,3-propanetricarboxylate (1:1), hydroxypropane-1,2,3-tricarboxylate, Tox21_110938, Tox21_202070, Tox21_300274, Tox21_501203, CCG-39629, MFCD00058321, NSC757345, s1238, s1972, SBB080554, AKOS005111126, Tox21_110938_1, CS-1852, KS-5046, LP01203, NSC-180973, NSC-757345, NCGC00016206-01, NCGC00016206-02, NCGC00016206-03, NCGC00016206-04, NCGC00016206-05, NCGC00016206-06, NCGC00024928-02, NCGC00024928-23, NCGC00094450-01, NCGC00094450-02, NCGC00094450-03, NCGC00094450-04, NCGC00254000-01, NCGC00259619-01, NCGC00261888-01, CPD000677949, HY-13757, KB-80806, LS-68202, M936, SAM002564256, SC-13399, BCP0726000223, AB0006810, AB2000015, EU-0101203, (Z)-2-(4-(1,2-diphenylbut-1-enyl)phenoxy), D00966, J10303, K-9859, T 9262, 965T241, Q-201776, SR-01000075523-1, SR-01000075523-3, SR-01000075523-5, SR-01000075523-6, SR-01000075523-10, (Z)-1-(4-Dimethylaminoethoxyphenyl)-1,2-diphenyl-1-butene Citrate, Tamoxifen citrate, European Pharmacopoeia (EP) Reference Standard, (Z)-2-[4-(1,2-Diphenyl-1-butenyl)phenoxy]-N,N-dimethylethanamine citrate, Tamoxifen citrate, United States Pharmacopeia (USP) Reference Standard, (Z)-2-[ p-(1,2-Diphenyl-1-butenyl)phenoxy]- N, N-dimethylethylamine citrate (1:1), (Z)-2-[4-(1,2-Diphenyl-1-butenyl)phenoxy]-N,N-dimethyl-ethanamine cirtrate (1:1), Tamoxifen citrate for performance test, European Pharmacopoeia (EP) Reference Standard, (Z)-2-(4-(1,2-diphenylbut-1-en-1-yl)phenoxy)-N,N-dimethylethan-1-amine 2-hydroxypropane-1,2,3-tricarboxylate, (Z)-2-(4-(1,2-diphenylbut-1-enyl)phenoxy)-N,N-dimethylethanamine 2-hydroxypropane-1,2,3-tricarboxylate, {2-[4-((1Z)-1,2-diphenylbut-1-enyl)phenoxy]ethyl}dimethylamine, 2-hydroxypropa ne-1,2,3-tricarboxylic acid, 2-[4-[(Z)-1,2-diphenylbut-1-enyl]phenoxy]-N,N-dimethylethanamine; 2-hydroxypropane-1,2,3-tricarboxylic acid, Ethanamine, 2-(4-((1Z)-1,2-diphenyl-1-butenyl)phenoxy)-N,N-dimethyl-, 2-hydroxy-1,2,3-propanetricarboxylate (1:1), Ethanamine,2-diphenyl-1-butenyl)phenoxy]-N,N-dimethyl-, (Z)-, 2-hydroxy-1,2,3-propanetricarboxylate (1:1), Tamoxan, Tamoxene, Tamoxin, Tamox, 2-{4-[(1Z)-1,2-diphenylbut-1-en-1-yl]phenoxy}-N,N-dimethylethanamine 2-hydroxypropane-1,2,3-tricarboxylate


ID: 633

chemical graph of compound 633



InChIKey: FRCCEHPWNOQAEU-UHFFFAOYSA-N
SMILES: C1=CC(C2C1C3(C(=C(C2(C3(Cl)Cl)Cl)Cl)Cl)Cl)Cl

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 3589
synonyms found at PubChem are:
heptachlor, Heptachlorane, Heptamul, 3-Chlorochlordene, Rhodiachlor, Aahepta, Agroceres, Heptagran, Hepta, 76-44-8, Velsicol heptachlor, GPKh, Technical heptachlor, Eptacloro, Heptachloor, Heptachlore, Heptox, Velsicol 104, Arbinex 30TN, Heptagranox, Basaklor, Heptamak, Heptasol, Soleptax, Rcra waste number P059, NCI-C00180, Eptacloro [Italian], Heptachloor [Dutch], Heptachlore [French], Caswell No. 474, Latka 104, ENT 15,152, Heptachlor [BSI:ISO], Heptachlorotetrahydro-4,7-methanoindene, Latka 104 [Czech], H-34, Heptachlore [ISO-French], NSC 8930, Gold Crest H-60, Termide, Heptachlor (technical grade), CCRIS 324, 4,7-Methano-1H-indene, 1,4,5,6,7,8,8-heptachloro-3a,4,7,7a-tetrahydro-, E 3314, HSDB 554, Drinox H-34, H-60, OMS 193, 3,4,5,6,7,8,8a-Heptachlorodicyclopentadiene, EINECS 200-962-3, Heptachlor and metabolites, RCRA waste no. P059, EPA Pesticide Chemical Code 044801, Dicyclopentadiene, 3,4,5,6,7,8,8a-heptachloro-, 1,4,5,6,7,8,8-Heptachloro-3a,4,7,7a-tetrahydro-4,7-methanoindene, 1,4,5,6,7,8,8-Heptachloro-3a,4,7,7a-tetrahydro-4,7-methano-1H-indene, AI3-15152, CHEBI:34785, 1,4,5,6,7,10,10-Heptachloro-4,7,8,9-tetrahydro-4,7-methyleneindene, 1,4,5,6,7,8,8-heptachloro-3a,4,7,7a-tetrahydro-1H-4,7-methanoindene, 1,4,5,6,7,8,8a-Heptachloro-3a,4,7,7a-tetrahydro-4,7-methanoindane, 4,7-Methanoindene, 1,4,5,6,7,8,8-heptachloro-3a,4,7,7a-tetrahydro-, 1(3a),4,5,6,7,8,8-Heptachloro-3a(1),4,7,7a-tetrahydro-4,7-methanoindene, alpha-Dicyclopentadiene, 3,4,5,6,7,8,8A-heptachloro-, 1,4,5,6,7,8,8-Heptachlorotetrahydro-4,7-methanoindene, DSSTox_CID_679, 1,4,5,6,7,8,8-Eptacloro-3a,4,7,7a-tetraidro-4,7-endo-metano-indene, 1,4,5,6,7,10,10-Heptachloro-4,7,8,9-tetrahydro-4,7-endomethyleneindene, 1,4,5,6,7,8,8-Heptachloor-3a,4,7,7a-tetrahydro-4,7-endo-methano-indeen, 1,4,5,6,7,8,8-Heptachlor-3a,4,7,7,7a-tetrahydro-4,7-endo-methano-inden, 1,4,5,6,7,8,8-Heptachloro-3a,4,7,7a-tetrahydro-4,7-endomethanoindene, 1,4,5,6,7,8,8-Heptachloro-3a,4,7,7a-tetrahydro-4,7-methanol-1H-indene, 1,4,5,6,7,8,8-Eptacloro-3a,4,7,7a-tetraidro-4,7-endo-metano-indene [Italian], 1,4,5,6,7,8,8-Heptachloor-3a,4,7,7a-tetrahydro-4,7-endo-methano-indeen [Dutch], 1,4,5,6,7,8,8-Heptachlor-3a,4,7,7,7a-tetrahydro-4,7-endo-methano-inden [German], DSSTox_RID_75727, DSSTox_GSID_20679, heptaklor, 1,5,7,8,9,10,10-heptachlorotricyclo[5.2.1.0(2,6)]deca-3,8-diene, CAS-76-44-8, Tetrahydro, hepta klor, Spectrum_001951, SpecPlus_000590, AC1Q3LFN, Spectrum2_001891, Spectrum3_000865, Spectrum4_000705, Spectrum5_002052, AC1L1G9N, AC1Q3HE4, SCHEMBL65124, BSPBio_002509, KBioGR_001229, KBioSS_002505, SPECTRUM330078, MLS002454407, DivK1c_006686, SPBio_001822, CHEMBL194400, DTXSID3020679, KBio1_001630, KBio2_002497, KBio2_005065, KBio2_007633, KBio3_002009, NSC8930, FRCCEHPWNOQAEU-UHFFFAOYSA-N, NSC-8930, Tox21_201911, Tox21_300534, BDBM50410521, CCG-39341, LS-1694, NCGC00091514-01, NCGC00094549-01, NCGC00094549-02, NCGC00094549-03, NCGC00094549-04, NCGC00094549-05, NCGC00254523-01, NCGC00259460-01, SMR001372010, 3,5,6,7,8,8-Heptachlorodicyclopentadiene, C14185, Dicyclopentadiene,4,5,6,7,8,8a-heptachloro-, WLN: L C555 A DU IUTJ AG AG BG FG HG IG JG, 4, 1,4,5,6,7,8,8-heptachloro-3a,4,7,7a-tetrahydro-, 1,5,6,7,8,8-Heptachloro-3a,4,7,7a-tetrahydro-4,7-methanoindene, 3a,5,6,7,8,8-Heptachloro-3a,4,7,7a-tetrahydro-4,7-methanoindene, 1(3a),5,6,7,8,8-Heptachloro-3a(1),4,7,7a-tetrahydro-4,7-methanoindene, 1,4,5,6,7,10,10-hept achloro-4,7,8,9-tetrahydro-4,7-methyleneindene, 1,4,5,6,7,8,8-h eptachloro-3a,4,7,7a-tetrahydro-4,7-endomethanoindene, 1,4,5,6,7,8,8-Heptachloro-3a,4,7,7,7a-tetrahydro-4,7-methylene indene, 1,4,5,6,7,8,8-heptachloro-3a,4,7,7,7a-tetrahydro-4,7-methyleneindene, 1,4,5,6,7,8,8-Heptachloro-3a,4,7,7a-tetrahydro-4,7-endo-methanoindene, 1,4,5,6,7,8,8a-heptachloro-3a,4,7,7a-tetrahydro-4,7-methanoindene, 1,5,6,7,10,10-Heptachloro-4,7,8,9-tetrahydro-4,7-endo-methyleneindene, 1,5,6,7,10,10-Heptachloro-4,7,8,9-tetrahydro-4,7-methyleneindene, 1,5,6,7,8,8-Eptacloro-3a,4,7,7a-tetraidro-4,7-endo-metano-indene, 1,5,6,7,8,8-Heptachloor-3a,4,7,7a-tetrahydro-4,7-endo-methano-indeen, 1,5,6,7,8,8-Heptachlor-3a,4,7,7,7a-tetrahydro-4,7-endo-methano-inden, 1,5,6,7,8,8-Heptachloro-3a,4,7,7,7a-tetrahydro-4,7-methylene indene, 1,5,6,7,8,8-Heptachloro-3a,4,7,7a- tetrahydro-4,7-methanoindene, 1,5,6,7,8,8-Heptachloro-3a,4,7,7a-tetrahydro-4,7-endo-methanoindene, 1H-1,4,5, 6,7,8,8-Heptachloro-3a,4,7,7a-tetrahydro-4,7-methanoindene, 1H-1,4,5,6,7,8,8-Heptachloro-3a,4,7,7a-tetrahydro-4,7-methanoindene, (4S,7S)-1,4,5,6,7,8,8-heptachloro-3a,4,7,7a-tetrahydro-1H-4,7-methanoindene, 1,4,5,6,7,10,10-Heptachloro-4,7,8,9-tetrahydro-4,7-endo-methyleneindene, Indene, 1,4,5,6,7,8,8-heptachloro-3alpha,4,7,7alpha-tetrahydro-4,7-methano-, 23720-59-4, 6,7,8,9,10,10-hexachloro-1,5,5a,6,9,9a-hexahydro-3-methyl-4,7-Methano-1H-ind ene, 1,4,5,6,7,8,8-heptachloro-3a,4,7,7a-tetrahydro-6,9-methano-2,4,3-benzodioxathiepin, 6,7,8,9,10,10-hexachloro-1,5,5a,6,9,9a-hexahydro-3-methyl-4,7-Methano-1H-indene, 1,4,5,6,7,8,8-heptachloro-3a,4,7,7a-tetrahydro-6,9-methano-2,4,3-benzodioxathiepin


ID: 634

chemical graph of compound 634



InChIKey: FSEUPUDHEBLWJY-HWKANZROSA-N
SMILES: C/C(=N\O)/C(=O)C

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 6409633
synonyms found at PubChem are:
2,3-butanedione monoxime, Diacetyl monoxime, Diacetylmonoxime, Biacetyl monoxime, Biacetyl monooxime, Diacetyl monooxime, Diacetylmonooxime, 2,3-Butanedione 2-oxime, 57-71-6, 2-Oximino-3-butanone, 3-Oximino-2-butanone, 2,3-Butanedione-2-monoxime, DAM (oxime), 2,3-Butanedione, monooxime, 2,3-Butanedione 3-monoxime, 3-oxo-2-butanone oxime, 2,3-Butanedione monooxime, Isonitrosoethyl methyl ketone, (3E)-3-hydroxyiminobutan-2-one, 2,3-Butanedione oxime, UNII-19SQ93LM6H, 3-(hydroxyimino)butan-2-one, C4H7NO2, NSC 116103, CCRIS 6215, CHEBI:4480, EINECS 200-348-5, BRN 0605582, AI3-23962, 19SQ93LM6H, BDM, DAM, (2E)-butane-2,3-dione oxime, CHEMBL1255578, 2, monooxime, NSC-660, 2, monoxime, NSC-116103, WLN: QNUY1&V1, 2,3-Butanedione, 2-oxime, 2,3-Butanedione 2-Monoxime, 17019-25-9, KBDO, SR-01000075306, FSEUPUDHEBLWJY-HWKANZROSA-N, 2,3-BUTANEDIONE-2-OXIME, 2,3-BDMO, potassium 2,3-butanedione monoximate, AC1O4OEO, 2, 3-Butanedione Monoxime, Lopac0_000090, 4-01-00-03646 (Beilstein Handbook Reference), SCHEMBL257234, SCHEMBL282899, NSC660, DTXSID7024669, FSEUPUDHEBLWJY-HWKANZROSA-, (3E)-3-hydroxyimino-2-butanone, 2,3-Butanedione monoxime, 97%, cMAP_000064, MolPort-001-779-942, HMS3260A22, 110828-81-4, 3-[(Z)-Hydroxyimino]-2-butanone, Tox21_500090, 2,3-Butanedione monoxime, >=98%, 2,3-Butanedione, monooxime, (E)-, BDBM50024959, HSCI1_000099, MFCD00002116, NSC116103, ZINC12358749, 2,3-Butanedione, monooxime, (2E)-, AKOS005207181, 2,3-Butanedione, 2-oxime, (2E)-, CCG-204185, LS-1392, NCGC00024887-02, NCGC00024887-03, NCGC00024887-04, NCGC00024887-05, NCGC00260775-01, L027, SC-46911, 2,3-Butanedione monoxime, p.a., 99.0%, EU-0100090, FT-0082821, A feminineOOo poundO>>e inverted question mark, B 0753, C07509, A831569, J-610059, S14-1109, SR-01000075306-1, SR-01000075306-3, W-105446, paragraph signthornOOo poundO>>e inverted question mark, InChI=1/C4H7NO2/c1-3(5-7)4(2)6/h7H,1-2H3/b5-3+, 2,3-Butanedione monoxime, for spectrophotometric det. of urea, >=99.0%


ID: 635

chemical graph of compound 635



InChIKey: FSKVGWXINKZUKS-UHFFFAOYSA-M
SMILES: C[N+](C)(C)CC=O.[Cl-]

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 2735510
synonyms found at PubChem are:
Betaine aldehyde chloride, 7758-31-8, N,N,N-Trimethyl-2-oxoethanaminium chloride, trimethyl(2-oxoethyl)azanium chloride, (2-Oxoethyl)trimethylammonium chloride, BTL chloride, EU-0100182, AC1MC3H4, MLS002153203, SCHEMBL116970, CHEMBL1256576, DTXSID10370761, MolPort-001-761-299, REGID_for_CID_2735510, HMS2230C14, HMS3260F05, HMS3373H22, Tox21_500182, AKOS027320642, (Formylmethyl)trimethylammonium chloride, CCG-221486, LP00182, KS-0000194S, (formylmethyl)-trimethylammonium chloride, NCGC00093661-01, NCGC00260867-01, SMR000326966, 2-Oxo-N,N,N-trimethylethanaminium chloride, FT-0622916, B 3650, SR-01000075715, Ethanaminium,N,N,N-trimethyl-2-oxo-,chloride(1:1), SR-01000075715-1


ID: 636

chemical graph of compound 636



InChIKey: FSNITHOUQGJHTR-UHFFFAOYSA-N
SMILES: COC1=CC=C(C=C1)C(C=C)C2=CC(=O)C(=CC2=O)OC

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 364106
synonyms found at PubChem are:
4,4'-Dimethoxydalbergione, NSC629751, 2-Methoxy-5-(1-(4-methoxyphenyl)-2-propenyl)benzo-1,4-quinone, Spectrum_000021, SpecPlus_000153, AC1Q6BVY, Spectrum2_000597, Spectrum3_000682, Spectrum5_001863, AC1L7O5Y, BSPBio_002403, KBioSS_000381, SPECTRUM201448, DivK1c_006249, SPBio_000474, CHEMBL1436980, CTK7A2184, KBio1_001193, KBio2_000381, KBio2_002949, KBio2_005517, KBio3_001623, CCG-38518, NSC-629751, NCGC00095719-01, NCGC00095719-02, SR-05000002539, SR-05000002539-1, 2-methoxy-5-[1-(4-methoxyphenyl)allyl]-1,4-benzoquinone, 2-methoxy-5-[1-(4-methoxyphenyl)prop-2-enyl]cyclohexa-2,5-diene-1,4-dione


ID: 637

chemical graph of compound 637



InChIKey: FSQKKOOTNAMONP-UHFFFAOYSA-N
SMILES: CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)OCC(=O)O

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 1981
synonyms found at PubChem are:
acemetacin, 53164-05-9, Rantudil, Emflex, Acemetacinum, Acemix, Acemetacina, Acemetacine, Aximeixin, Rheumibis, Bay f 4975, indomethacin carboxymethyl ester, Solart, Acemetacine [INN-French], Acemetacinum [INN-Latin], Acemetacina [INN-Spanish], TVX 3322, UNII-5V141XK28X, K 708, K-708, TVX 1322, indometacin glycolic ester, EINECS 258-403-4, indomethacin glycolic ester, BRN 0501672, C21H18ClNO6, indometacin carboxymethyl ester, 1H-Indole-3-acetic acid, 1-(4-chlorobenzoyl)-5-methoxy-2-methyl-, carboxymethyl ester, CHEMBL189171, CHEBI:31162, FSQKKOOTNAMONP-UHFFFAOYSA-N, 5V141XK28X, 1-(4-Chlorobenzoyl)-5-methoxy-2-methyl-1H-indole-3-acetic acid carboxymethyl ester, NCGC00016868-09, CAS-53164-05-9, ((1-(4-Chlorobenzoyl)-5-methoxy-2-methylindol-3-yl)acetoxy)acetic acid, DSSTox_CID_2540, (1-(p-Chlorbenzoyl)-5-methoxy-2-methylindol-3-acetoxy)essigsaeure [German], 2-(2-(1-(p-Chlorobenzoyl)-5-methoxy-2-methylindol-3-yl)acetoxy)acetic acid, DSSTox_RID_76618, DSSTox_GSID_22540, Rantodil, [1-(4-Chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetoxyacetic Acid, [1-(4-Chloro-benzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]-acetic acid carboxymethyl ester, 1-(p-Chlorobenzoyl)-5-methoxy-2-methylindole-3-acetic acid carboxymethyl ester, 1-(p-Chlorobenzoyl)-5-methoxy-2-methylindole-3-acetic acid ester with glycolic acid, 1-[p-Chlorobenzoyl]-5-methoxy-2-methylindole-3-acetic acid carboxymethyl ester, 2-(2-(1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl)acetoxy)acetic acid, 2-[2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetyl]oxyacetic acid, SMR000058409, SR-01000000070, acemet, acemethacin, acemethazine, Acemetacin [BAN:INN:JAN], Acemetacin [INN:BAN:JAN], {[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetoxy}acetic acid, Rantudil (TN), Prestwick_669, Acemetacin (Emflex), Spectrum_000428, AC1L1CNQ, Prestwick0_000296, Prestwick1_000296, Prestwick2_000296, Prestwick3_000296, Spectrum2_001162, Spectrum3_001868, Spectrum4_000803, Spectrum5_001385, Acemetacin (JP17/INN), {2-[1-(4-chlorbenzoyl)-5-methoxy-2-methyl-1h-indol-3-yl]acetoxy}essigs, AC1Q3N7Y, Bay-f-4975, SCHEMBL23843, BSPBio_000232, BSPBio_003316, KBioGR_001285, KBioSS_000908, 5-22-05-00241 (Beilstein Handbook Reference), MLS000028440, MLS006010622, DivK1c_000490, SPECTRUM1500666, SPBio_001143, SPBio_002451, Acemetacin, analytical standard, BPBio1_000256, DTXSID7022540, CTK8B3535, HMS501I12, KBio1_000490, KBio2_000908, KBio2_003476, KBio2_006044, KBio3_002818, KS-00000FKT, MolPort-002-045-405, NINDS_000490, HMS1568L14, HMS1921A08, HMS2090E21, HMS2095L14, HMS2230G08, HMS3372K20, HMS3656E22, HMS3712L14, Pharmakon1600-01500666, ZINC601272, BCP13127, HY-B0482, TVX-1322, Tox21_113473, (1-(p-Chlorbenzoyl)-5-methoxy-2-methylindol-3-acetoxy)essigsaeure, ANW-42684, BDBM50336272, CCG-39550, MFCD00151473, NSC757413, s2602, AKOS015895194, Tox21_113473_1, AB03974, API0001356, CS-2597, DB13783, MCULE-3371205328, NSC-757413, TV-1322, IDI1_000490, NCGC00016868-01, NCGC00016868-02, NCGC00016868-03, NCGC00016868-04, NCGC00016868-05, NCGC00016868-06, NCGC00016868-07, NCGC00016868-08, NCGC00016868-11, NCGC00016868-12, NCGC00022084-03, NCGC00022084-04, NCGC00022084-05, NCGC00022084-06, NCGC00022084-07, AN-25630, CC-23639, LS-82122, SC-66348, SBI-0051585.P002, AB2000691, A2452, AB00052149, FT-0630659, ST50993919, D01582, AB00052149-15, AB00052149_16, AB00052149_17, 164A059, C-21993, I06-0330, SR-01000000070-2, SR-01000000070-3, BRD-K67563174-001-05-1, BRD-K67563174-001-09-3, 1-[P-CHLOROBENZOYL]-5-METHOXY-2-METHYLINDOLE-3-ACE, Acemetacin, European Pharmacopoeia (EP) Reference Standard, [1-(p-Chlorobenzoyl)-5-methoxy-2-methyl-3-indoleacetoxy]-acetic acid, ({2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetyl}oxy)acetic acid, [({1-[(4-chlorophenyl)carbonyl]-5-methoxy-2-methyl-1H-indol-3-yl}acetyl)oxy]acetic acid, {2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetoxy}acetic acid, 1-(4-Chlorobenzoyl)-5-methoxy-2-methylindole-3-acetic Acid Carboxymethyl Ester, 1-[p-Chlorobenzoyl]-5-methoxy- 2-methylindole-3-acetic acid carboxymethyl ester, 1H-Indole-3-aceticacid, 1-(4-chlorobenzoyl)-5-methoxy-2-methyl-, carboxymethyl ester, 2-(2-(1-((4-chlorophenyl)carbonyl)-5-methoxy-2-methylindol-3-yl)acetyloxy)acetic acid, 2-(2-{1-[(4-chlorophenyl)carbonyl]-5-methoxy-2-methylindol-3-yl}acetyloxy)acet ic acid, 2-[2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-indol-3-yl]acetyl]oxyacetic acid, [({1-[(4-chlorophenyl)carbonyl]-2-methyl-5-(methyloxy)-1H-indol-3-yl}acetyl)oxy]acetic acid


ID: 638

chemical graph of compound 638



InChIKey: FSVJFNAIGNNGKK-UHFFFAOYSA-N
SMILES: C1CCC(CC1)C(=O)N2CC3C4=CC=CC=C4CCN3C(=O)C2

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 4891
synonyms found at PubChem are:
praziquantel, 55268-74-1, Droncit, Biltricide, Pyquiton, Cesol, Azinox, Embay 8440, Cutter Tape Tabs, Prasiquantel, Praziquantelum, Traziquantel, Biliricide, Cysticide, Distocide, Drontsit, Prazinon, Praziquantelum [INN-Latin], Cutter, Biltricide (TN), 2-(cyclohexylcarbonyl)-1,2,3,6,7,11b-hexahydro-4H-pyrazino[2,1-a]isoquinolin-4-one, CCRIS 4114, MLS000038419, Praziquantel [USAN:INN:BAN:JAN], EINECS 259-559-6, Praziquantel (Biltricide), NPFAPI-02, BRN 0761557, SMR000037139, Bay-8440, Praziquantel (JAN/USP/INN), EMBAY-8440, FSVJFNAIGNNGKK-UHFFFAOYSA-N, 2-(cyclohexanecarbonyl)-3,6,7,11b-tetrahydro-1H-pyrazino[2,1-a]isoquinolin-4-one, 2-(Cyclohexylcarbonyl)-1,2,3,6,7,11b-hexahydro-4H-pyrazino(2,1-a)isoquinolin-4-one, 2-cyclohexanecarbonyl-1H,2H,3H,4H,6H,7H,11bH-piperazino[2,1-a]isoquinolin-4-one, 4H-Pyrazino(2,1-a)isoquinolin-4-one, 2-(cyclohexylcarbonyl)-1,2,3,6,7,11b-hexahydro-, DSSTox_CID_1182, P 4668, 2-(cyclohexanecarbonyl)-1,2,3,6,7,11b-hexahydro-4H-pyrazino[2,1-a]isoquinolin-4-one, 2-(cyclohexanecarbonyl)-2,3,6,7-tetrahydro-1H-pyrazino[2,1-a]isoquinolin-4(11bH)-one, 2-Cyclohexylcarbonyl-1,2,3,6,7,11b-hexahydro-4H-pyrazino(2,1-a) isoquinolin-4-one, 4H-Pyrazino[2,1-a]isoquinolin-4-one, 2-(cyclohexylcarbonyl)-1,2,3,6,7,11b-hexahydro-, DSSTox_RID_75995, DSSTox_GSID_21182, 135526-78-2, Cisticid, (11bS)-2-(cyclohexylcarbonyl)-1,2,3,6,7,11b-hexahydro-4H-pyrazino[2,1-a]isoquinolin-4-one, 2-(Cyclohexylcarbonyl)-1,2,3,6,7-11b-hexahydro-4H-pyrazino(2,1a)isoquinolin-4-one, 2-(Cyclohexylcarbonyl)-1,2,3,6,7-11b-hexahydro-4H-pyrazinoe(2,1a)isoquinolin-4-one, 2-Cyclohexanecarbonyl-1,2,3,6,7,11b-hexahydro-pyrazino[2,1-a]isoquinolin-4-one, SR-01000003100, Praziquantel, (R)-Isomer, Praziquantel, (S)-Isomer, saniquantrel, Praziquantel, (+-)-Isomer, Praziquantel,(S), NCGC00016877-01, Prestwick_402, CAS-55268-74-1, (+-)-Praziquantel, ACMC-20emeg, (+/-)-Praziquantel, Praziquantel [USAN:USP:INN:BAN:JAN], Spectrum_001119, Opera_ID_378, Prestwick0_000260, Prestwick1_000260, Prestwick2_000260, Prestwick3_000260, Spectrum2_001288, Spectrum3_000550, Spectrum4_000482, Spectrum5_001064, CHEMBL976, D0L9ZR, AC1L1J6N, Bayer Brand of Praziquantel, cid_4891, Merck Brand of Praziquantel, Lopac0_000909, Oprea1_163497, SCHEMBL44153, BSPBio_000080, BSPBio_002199, KBioGR_000963, KBioSS_001599, 5-24-03-00361 (Beilstein Handbook Reference), MLS000028528, MLS001201812, MLS001304085, MLS002548849, MLS006011880, DivK1c_000130, SPECTRUM1500494, SPBio_001295, SPBio_002299, BPBio1_000088, DTXSID9021182, SCHEMBL16019896, 8440, EMBAY, BDBM74574, CHEBI:91583, HMS500G12, KBio1_000130, KBio2_001599, KBio2_004167, KBio2_006735, KBio3_001699, Biltricide, Droncit, Praziquantel, MolPort-001-926-470, NINDS_000130, Praziquantel(Biltricide, Droncit), HMS1568D22, HMS1920J06, HMS2090J19, HMS2092A09, HMS2095D22, HMS3259K07, HMS3262F20, HMS3655O19, HMS3712D22, Pharmakon1600-01500494, BCP28525, HY-B0244, KS-000002NE, Tox21_110660, Tox21_201950, Tox21_302927, Tox21_500909, CCG-39773, CP0098, MFCD00058531, NSC757285, Praziquantel, anthelminic, neurogenic, s1691, STK030186, AKOS000541869, AKOS016398525, Tox21_110660_1, AC-8426, AN-8035, CS-2223, DB01058, LP00909, LS-7155, MCULE-1638759858, NC00468, NE56665, NSC-757285, RP17849, (+-)-2-(Cyclohexylcarbonyl)-1,2,3,6,7,11b-hexahydro-4H-pyrazino(2,1a)isoquinolin-4-one, IDI1_000130, NCGC00015818-04, NCGC00015818-05, NCGC00015818-06, NCGC00015818-07, NCGC00015818-08, NCGC00015818-11, NCGC00015818-12, NCGC00015818-14, NCGC00015818-15, NCGC00089733-02, NCGC00089733-03, NCGC00089733-04, NCGC00089733-05, NCGC00256422-01, NCGC00259499-01, NCGC00261594-01, AS-12459, BAS 00347357, CPD000037139, KB-59949, LS-23174, SAM002264632, SC-46696, TA-01001, SBI-0050884.P004, AB0011974, AB1009469, AB00052075, EU-0100909, FT-0630676, P2125, ST24049030, ST50904686, 1H-pyrazino[2,1-a]isoquinolin-4(11bH)-one, 2-(cyclohexanecarbonyl)-2,3,6,7-tetrahydro-, C07367, D00471, J10194, AB00052075-13, AB00052075-15, AB00052075_16, AB00052075_17, Praziquantel, VETRANAL(TM), analytical standard, 268P741, I06-0088, Praziquantel, Antibiotic for Culture Media Use Only, Q-201612, SR-01000003100-3, SR-01000003100-5, SR-01000003100-7, BRD-A21858158-001-05-2, BRD-A21858158-001-16-9, F0037-0136, Z1563145961, Praziquantel, European Pharmacopoeia (EP) Reference Standard, Praziquantel, United States Pharmacopeia (USP) Reference Standard, 10-(cyclohexylcarbonyl)-5,6,7,11a-tetrahydropiperazino[2,1-a]isoquinolin-8-one, 2-(Cyclohexylcarbonyl)-1,2,3,6,7,11b-hexahydro- 4H-pyrazino[2,1-a]-isoquinolin-4-one, 2-(Cyclohexylcarbonyl)-1,2,3,6,7,11b-hexahydro-4H-pyrazino-[2,1- a]isoquinolin-4-one, 2-(Cyclohexylcarbonyl)-1,2,3,6,7,11b-hexahydro-4H-pyrazino[2,1-a]-isoquinolin-4-one, 2-(Cyclohexylcarbonyl)-1,2,3,6,7-11b-hexahydro-4H-pyrazino[2,1-aisoquinolin-4-one, 2-[cyclohexyl(oxo)methyl]-3,6,7,11b-tetrahydro-1H-pyrazino[2,1-a]isoquinolin-4-one, 2-Cyclohexylcarbonyl-1,2,3,6,7,11b-hexahydro-4H-pyrazino(2,1-a)isoquinolin-4-one, Praziquantel for system suitability, European Pharmacopoeia (EP) Reference Standard, Praziquantel, Pharmaceutical Secondary Standard; Certified Reference Material, InChI=1/C19H24N2O2/c22-18-13-20(19(23)15-7-2-1-3-8-15)12-17-16-9-5-4-6-14(16)10-11-21(17)18/h4-6,9,15,17H,1-3,7-8,10-13H


ID: 639

chemical graph of compound 639



InChIKey: FSXRLASFHBWESK-HOTGVXAUSA-N
SMILES: C1=CC=C(C=C1)C[C@@H](C(=O)N[C@@H](CC2=CC=C(C=C2)O)C(=O)O)N

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 515709
synonyms found at PubChem are:
phenylalanyltyrosine, 17355-18-9, H-Phe-Tyr-OH, CHEBI:73637, L-phenylalanyl-L-tyrosine, L-Tyrosine,L-phenylalanyl-, L-Tyrosine, L-phenylalanyl-, (S)-2-((S)-2-Amino-3-phenylpropanamido)-3-(4-hydroxyphenyl)propanoic acid, Phe-Tyr, L-Phe-L-Tyr, L-Phe-L-Tyr-OH, AC1LAL1E, L-Phenylalanin L-Tyrosin, Spectrum2_001496, Spectrum3_001813, BSPBio_003425, CHEMBL54572, SPBio_001511, SCHEMBL3037096, CTK4D4680, KBio3_002928, DTXSID30333656, FSXRLASFHBWESK-HOTGVXAUSA-N, FY, ZINC2384778, 7225AH, BDBM50049728, CCG-39203, L-Tyrosine, L-phenylalanyl-, monomer, AKOS022181529, NCGC00178074-01, AJ-35117, J-010920, BRD-K22337096-001-01-8, (2S)-2-[[(2S)-2-amino-3-phenyl-propanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid, (2S)-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid, Melanin synthesized from Phe-Tyr substrate catalyzed by tyrosinase for 40 hrs, F-Y


ID: 640

chemical graph of compound 640



InChIKey: FTBGFGQPUMCUSC-UHFFFAOYSA-N
SMILES: CC(=CCC1=C(C=C2C(=C1O)C(=O)C(=CO2)C3=CC4=C(C=C3)OCO4)O)C

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 5810067
synonyms found at PubChem are:
derrubone, 5,7-Dihydroxy-3',4'-methylenedioxy-6-prenylisoflavone, KBio2_007443, AC1NXMCX, Spectrum_001813, Spectrum2_000048, Spectrum3_000230, Spectrum4_000946, Spectrum5_001728, BSPBio_001879, KBioGR_001532, KBioSS_002309, SPECTRUM201650, SPBio_000175, CHEMBL412010, KBio2_002307, KBio2_004875, KBio3_001379, CHEBI:107656, CCG-40042, LMPK12050239, SDCCGMLS-0066443.P001, NCGC00095513-01, NCGC00095513-02, NCGC00178932-01, 22044-58-2, SR-05000002621, SR-05000002621-1, BRD-K59272984-001-02-6, 3-(1,3-benzodioxol-5-yl)-5,7-dihydroxy-6-(3-methylbut-2-enyl)chromen-4-one


ID: 641

chemical graph of compound 641



InChIKey: FTLDJPRFCGDUFH-UHFFFAOYSA-N
SMILES: CC(C)(CC1=CC=CC=C1)N(C)C(=O)CN(CCO)CC(=O)N(C)C(C)(C)CC2=CC=CC=C2

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 4621
synonyms found at PubChem are:
Oxethazaine, Oxetacaine, 126-27-2, Mucaine, Oxaethacainum, Oxethacaine, Oxaine, Betalgil, Muthesa, Stomacain, Topicain, Oxethacaina [Italian], Tepilta, Oxetacainum [INN-Latin], Oxetacaina [INN-Spanish], UNII-IP8QT76V17, CCRIS 4692, EINECS 204-780-5, FH 099, WY 806, BRN 2404063, CHEMBL127592, IP8QT76V17, CHEBI:31947, Wy-806, Oxetacaine (INN), Oxetacaine [INN], 2,2'-((2-Hydroxyethyl)imino)bis(N-(1,1-dimethyl-2-phenylethyl)-N-methylacetamide), NCGC00016382-01, CAS-126-27-2, 2-Di(N-methyl-N-phenyl-tert-butyl-carbamoylmethyl)aminoethanol, DSSTox_CID_5818, N,N-Bis(N-methyl-N-phenyl-tert-butylacetamido)-beta-hydroxyethylamine, 2,2'-((2-Hydroxyethyl)imino)bis(N-(alpha,alpha-dimethylphenethyl)-N-methylacetamide), Acetamide, 2,2'-((2-hydroxyethyl)imino)bis(N-(1,1-dimethyl-2-phenylethyl)-N-methyl-, DSSTox_RID_77936, DSSTox_GSID_25818, Milzine, Acetamide, 2,2'-((2-hydroxyethyl)imino)bis(N-(alpha,alpha-dimethylphenethyl)-N-methyl-, Acetamide, 2,2'-[(2-hydroxyethyl)imino]bis[N-(1,1-dimethyl-2-phenylethyl)-N-methyl-, 2-[2-hydroxyethyl-[2-[methyl-(2-methyl-1-phenylpropan-2-yl)amino]-2-oxoethyl]amino]-N-methyl-N-(2-methyl-1-phenylpropan-2-yl)acetamide, N-(1,1-dimethyl-2-phenyl-ethyl)-2-[[2-[(1,1-dimethyl-2-phenyl-ethyl)-methyl-amino]-2-oxo-ethyl]-(2-hydroxyethyl)amino]-N-methyl-acetamide, SR-05000001851, Oxethazaine [USAN:JAN], storocaine, Storocain, Prestwick_767, degrees centEuEuOo, Spectrum_001657, AC1L1IKS, Prestwick0_000058, Prestwick1_000058, Prestwick2_000058, Prestwick3_000058, Spectrum2_001987, Spectrum3_001751, Spectrum4_000202, Spectrum5_001269, cid_4621, Oxethazaine (JP17/USAN), SCHEMBL24489, BSPBio_000215, BSPBio_003482, KBioGR_000803, KBioSS_002137, 4-12-00-02822 (Beilstein Handbook Reference), MLS002154188, DivK1c_000715, SPECTRUM1503279, SPBio_002136, SPBio_002173, BPBio1_000237, Oxethazaine, analytical standard, DTXSID0025818, HMS502D17, KBio1_000715, KBio2_002137, KBio2_004705, KBio2_007273, KBio3_002702, KS-00000GVG, FTLDJPRFCGDUFH-UHFFFAOYSA-N, MolPort-003-666-480, NINDS_000715, 13930-31-9 (hydrochloride), HMS1568K17, HMS1922A04, HMS2093C15, HMS2095K17, HMS2236A03, HMS3370M13, HMS3712K17, Pharmakon1600-01503279, BCP07626, HY-B0955, ZINC3874585, Tox21_110407, 2622AH, BDBM50017672, CCG-39525, LS-703, NSC758444, AKOS024284189, Tox21_110407_1, API0003711, CS-4432, DB12532, MCULE-5155939580, NSC-758444, IDI1_000715, NCGC00016382-02, NCGC00016382-03, NCGC00016382-04, NCGC00016382-07, NCGC00095039-01, NCGC00095039-02, NCGC00095039-03, AN-43561, CC-33412, SMR001233479, ST073363, SBI-0051816.P002, AB00052348, FT-0603332, C12552, D01152, AB00052348_08, AB00052348_09, 126O272, C-22674, J-005353, SR-05000001851-1, SR-05000001851-3, BRD-K56940463-001-05-4, BRD-K56940463-001-08-8, 2-Hydroxyethyliminobis[N-(alpha,alpha-dimethylphenethyl)-N-methyl-acetamide], 2,2'-((2-hydroxyethyl)imino)bis(N-alpha,alpha-dimethylphenethyl)-N-methylacetamide, 2,2'-(2-hydroxyethylazanediyl)bis(N-methyl-N-(2-methyl-1-phenylpropan-2-yl)acetamide), 2-Hydroxyethyliminobis[N-(alpha,alpha-dimethylphenethyl)-N-methyl- acetamide], 2-oCOO>>uNC degrees +/->>uE<<(N-[|A,|A- paragraph signthorn(1/4)x>>u+/-(1/2)OO>>u]-N-(1/4)x>>uOOo pound degrees .), N-(1,1-Dimethyl-2-phenyl-ethyl)-2-[{[(1,1-dimethyl-2-phenyl-ethyl)-methyl-carbamoyl]-methyl}-(2-hydroxy-ethyl)-amino]-N-methyl-acetamide, N-(1,1-dimethyl-2-phenylethyl)-2-({[N-(1,1-dimethyl-2-phenylethyl)-N-methylcar bamoyl]methyl}(2-hydroxyethyl)amino)-N-methylacetamide


ID: 642

chemical graph of compound 642



InChIKey: FTNWXGFYRHWUKG-UHFFFAOYSA-N
SMILES: CN(C)CCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)C(F)(F)F.Cl

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 66069
synonyms found at PubChem are:
Triflupromazine hydrochloride, 1098-60-8, Flumazin, Fluorofen, Neoprin, Nivoman, Vesprin hydrochloride, Triflupromazine (hydrochloride), Triflupromazine monohydrochloride, Triflupromazine HCl, Trifluopromazine hydrochloride, Fluopromazine monohydrochloride, UNII-9E75N4A5HM, MC 4703, EINECS 214-149-6, Trifluopromazine hydrochloride (VAN), NSC 14959, NSC 17473, MLS000069672, 9E75N4A5HM, NCGC00094410-02, SMR000058517, 10-(3-(Dimethylamino)propyl)-2-(trifluoromethyl)phenothiazine monohydrochloride, 10-(3-Dimethylaminopropyl)-2-(trifluoromethyl)phenothiazine hydrochloride, 10H-Phenothiazine-10-propanamine, N,N-dimethyl-2-(trifluoromethyl)-, monohydrochloride, DSSTox_CID_25804, DSSTox_RID_81142, DSSTox_GSID_45804, CHEBI:9712, Phenothiazine, 10-(3-(dimethylamino)propyl)-2-(trifluoromethyl)-, monohydrochloride, C18H19F3N2S, NSC14959, NSC17473, WLN: T C666 BN ISJ B3N1&1 EXFFF, SR-01000000224, CAS-1098-60-8, C18H19F3N2S.ClH, SR-01000000224-4, 10-[3-(Dimethylamino)propyl]-2-(trifluoromethyl)phenothiazine hydrochloride, dimethyl{3-[2-(trifluoromethyl)phenothiazin-10-yl]propyl}amine, chloride, 10H-Phenothiazine-10-propanamine,N-dimethyl-2-(trifluoromethyl)-, monohydrochloride, Triflupromazine hydrochloride [JAN], Prestwick_893, Triflupromazine hydrochloride [USP:JAN], N,N-dimethyl-3-(2-(trifluoromethyl)-10H-phenothiazin-10-yl)propan-1-amine hydrochloride, N,N-dimethyl-3-[2-(trifluoromethyl)phenothiazin-10-yl]propan-1-amine;hydrochloride, Opera_ID_486, AC1L24JZ, Triflupromazine(hydrochloride), MLS001148408, MLS002222277, SCHEMBL317144, SPECTRUM1503118, REGID_for_CID_66069, CHEMBL1201102, DTXSID8045804, CTK8G3605, MolPort-003-666-452, HMS1568K07, HMS1922G15, Pharmakon1600-01503118, HY-B0909, Tox21_111276, Tox21_501146, 2767AH, NSC-14959, NSC-17473, NSC758387, SBB058191, AKOS024288004, Tox21_111276_1, API0004503, CCG-213116, LP01146, MCULE-4776607695, NSC-758387, KS-00001F94, NCGC00016012-12, NCGC00094410-01, NCGC00094410-03, NCGC00094410-04, NCGC00094410-05, NCGC00261831-01, Triflupromazine hydrochloride (JAN/USP), LS-105501, EU-0101146, FT-0736671, ST51015135, D00800, T 2896, J-002339, SR-01000000224-2, SR-01000000224-8, Z1642388275, Triflupromazine Hydrochloride 1.0 mg/ml in Methanol (as free base), Triflupromazine hydrochloride, VETRANAL(TM), analytical standard, 10-[3-(Dimethylamino)-1-propyl]-2-(trifluoromethyl)phenothiazine Hydrochloride, dimethyl({3-[2-(trifluoromethyl)-10H-phenothiazin-10-yl]propyl})amine hydrochloride, Phenothiazine, 10-(3-dimethylaminopropyl)-2-(trifluoromethyl)-, hydrochloride, Triflupromazine hydrochloride, United States Pharmacopeia (USP) Reference Standard, N,N-dimethyl-3-[2-(trifluoromethyl)-10H-phenothiazin-10-yl]propan-1-amine hydrochloride, AC1LCW96, AKOS026749861, N,N-dimethyl-3-[2-(trifluoromethyl)phenothiazin-10-yl]propan-1-amine; hydron; chloride


ID: 643

chemical graph of compound 643



InChIKey: FTSCEGKYKXESFF-LXTVHRRPSA-N
SMILES: CCCCCCCCCN1C[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:

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


CID is 501640
synonyms found at PubChem are:
N-Nonyldeoxynojirimycin, N-(N-NONYL)DEOXYNOJIRIMYCIN, NN-DNJ, 81117-35-3, N-Nonyl-deoxynojirimycin, (2R,3R,4R,5S)-2-(hydroxymethyl)-1-nonylpiperidine-3,4,5-triol, CHEBI:76399, N-nonyl-1-deoxynojirimycin, N-Nonyl-DNJ, AC1L9V9L, N-Nonyl 1-Deoxynojirimycin, N-(n-Nonyl)-deoxynojirimycin, (2R,3R,4R,5S)-2-(Hydroxymethyl)-1-nonyl-3,4,5-piperidinetriol, BICL4182, CHEMBL408500, SCHEMBL2268575, BDBM18358, CTK8G1326, DTXSID60333407, MolPort-023-276-901, ZINC14253608, NN-DNJ, >=98% (HPLC), AKOS024457751, DB08283, NCGC00182087-01, N-(n-Nonyl)-1-deoxynojirimycin min. 99%, B7472, W-203849, (2R,3R,4R,5S)-2-(hydroxymethyl)-1-nonyl-piperidine-3,4,5-triol, (5S,2R,3R,4R)-2-(Hydroxymethyl)-1-nonylpiperidine-3,4,5-triol, 3,4,5-Piperidinetriol, 2-(hydroxymethyl)-1-nonyl-, (2R,3R,4R,5S)-


ID: 644

chemical graph of compound 644



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

biological descriptors:

CFTR relevance: ΔF508 CFTR activation

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

reference list:

"M Mazur" "J Prasain" "JP Clancy" "PA Sloane" "LC Pyle" "S Barnes" "SM Rowe" "JC Fulton" "K Backer"


CID is 667495
synonyms found at PubChem are:
(2R)-naringenin, (R)-naringenin, (2R)-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one, naringenin, (S)-Naringenin, 480-41-1, (+)-(2R)-5,7-dihydroxy-2-(4-hydroxyphenyl)chroman-4-one, 2,3-dihydro-5,7-dihydroxy-2-(4-hydroxyphenyl)-4-benzopyrone, (-)-Naringenin, 17654-19-2, R-naringenin, (+)-naringenin, AC1LDI7C, ZINC1785, SCHEMBL17166263, CHEBI:50201, MolPort-002-507-277, (2R)-5,7,4'-trihydroxyflavone, HMS3468H18, (2R)-4',5,7-trihydroxyflavanone, ALBB-015405, BBL010488, MFCD03265520, STK801623, AKOS004119880, MCULE-5852778653, (2R)-4',5,7-trihydroxyflavan-4-one, AJ-08090, SC-85987, ZB000410, BB 0261506, N1370, R6691, ST24036200, (2R)-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one, 4H-1-benzopyran-4-one, 2,3-dihydro-5,7-dihydroxy-2-(4-hydroxyphenyl)-, (2R)-


ID: 645

chemical graph of compound 645



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

biological descriptors:

CFTR relevance: ΔF508 CFTR activation

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

reference list:

"M Mazur" "J Prasain" "JP Clancy" "PA Sloane" "LC Pyle" "S Barnes" "SM Rowe" "JC Fulton" "K Backer"


CID is 439246
synonyms found at PubChem are:
naringenin, 480-41-1, (S)-5,7-Dihydroxy-2-(4-hydroxyphenyl)chroman-4-one, (2S)-Naringenin, naringetol, pelargidanon, salipurpol, Asahina, (S)-Naringenin, Salipurol, UNII-HN5425SBF2, CCRIS 5839, C15H12O5, YSO1, (-)-(2S)-Naringenin, CHEMBL9352, (S)-2,3-Dihydro-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one, AI3-23355, HN5425SBF2, CHEBI:17846, (-)-Naringenin, Flavanone, 4',5,7-trihydroxy- (8CI), NSC 11855, (2S)-5,7-dihydroxy-2-(4-hydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-4-one, 4H-1-Benzopyran-4-one, 2,3-dihydro-5,7-dihydroxy-2-(4-hydroxyphenyl)-, (2S)-, NAR, EINECS 207-550-2, pelargidanon 1602, (2S)-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one, SR-01000721771, (2S)-5,7-dihydroxy-2-(4-hydroxyphenyl)chroman-4-one, (S)-2,3-Dihydro-5,7-dihydroxy-2-(4-hydroxyphenyl)-4-benzopyrone, NSC-11855, 2,3-Dihydro-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one, 2uxu, 4deu, Spectrum_000247, 4eh3, Spectrum2_000325, Spectrum3_000567, Spectrum4_000124, Spectrum5_001423, D02ABO, 4',5,7-triOH-Flavone, AC1L96YW, SCHEMBL20570, BSPBio_001954, KBioGR_000508, KBioSS_000727, MLS000574861, BIDD:ER0116, DivK1c_000118, SPECTRUM1500746, SPBio_000329, 4',5, 7-Trihydroxyflavanone, 5,7-Dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one, AC1Q78P1, DTXSID1022392, BDBM23419, CTK8C4789, HMS500F20, KBio1_000118, KBio2_000727, KBio2_003295, KBio2_005863, KBio3_001454, FTVWIRXFELQLPI-ZDUSSCGKSA-N, MolPort-001-796-145, NINDS_000118, (2S)-5,7,4'-trihydroxyflavone, AIDS001417, HMS2202M06, ZINC156701, (2S)-4',5,7-trihydroxyflavanone, HY-N0100, KS-000010IV, TNP00287, 2580AH, ANW-73132, CCG-38601, LMPK12140001, Phytochemistry 8: 127 (1969), s2394, AKOS016843490, CS-6421, DB03467, RTR-017609, SDCCGMLS-0066570.P001, (2S)-4',5,7-trihydroxyflavan-4-one, IDI1_000118, NCGC00016457-01, NCGC00016457-02, NCGC00016457-03, NCGC00017346-01, NCGC00163598-01, AJ-13871, CAS-480-41-1, SMR000156272, ZB006427, FT-0617134, FT-0617135, C00509, Q-100666, SR-01000721771-3, SR-01000721771-4, BRD-K08832567-001-02-4, BRD-K08832567-001-06-5, (-)-(2S)-5,7-dihydroxy-2-(4-hydroxyphenyl)chroman-4-one, (2S)-5,7-dihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one, (S)-2,3-dihydo-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one, 13308-00-4, 15912-71-7


ID: 646

chemical graph of compound 646



InChIKey: FUMINTAAUJUVMP-UHFFFAOYSA-N
SMILES: C1CN(CCC1N)C2=NC(=CC=C2)Cl.Cl

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 131746
synonyms found at PubChem are:
SR 57227A, 77145-61-0, SR 57227 HYDROCHLORIDE, SR 57227A hydrochloride, UNII-OW45B79UZD, 4-amino-1-(6-chloro-2-pyridyl)-piperidine hydrochloride, SR-57227A, CM57227, OW45B79UZD, SR 57,227A, 1-(6-chloro-2-pyridinyl)-4-piperidinamine hydrochloride, 4-amino-1-(6-chloro-2-pyridyl)piperidine hydrochloride, 1-(6-Chloro-2-pyridinyl)-4-piperidinamine monohydrochloride, 4-Amino-1-(6-chloro-2-pyridyl)piperidine monohydrochloride, 4-Piperidinamine, 1-(6-chloro-2-pyridinyl)-, monohydrochloride, DSSTox_CID_25201, DSSTox_RID_80745, DSSTox_GSID_45201, 1-(6-chloropyridin-2-yl)piperidin-4-amine hydrochloride, SMR000449299, CAS-77145-61-0, SR-01000075564, NCGC00015931-04, 1-(6-chloropyridin-2-yl)piperidin-4-amine hydrochloride(1:1), AC1Q3BCO, C10H14ClN3.HCl, SR 57227A, solid, AC1L2ZQ2, MLS000758285, MLS001424006, SCHEMBL3282207, sr57227, CHEMBL1256322, DTXSID5045201, MolPort-003-959-507, Tox21_110263, BN0505, MFCD01756430, AKOS024456463, Tox21_110263_1, API0008440, CCG-100768, LP01066, NC00018, NCGC00015931-07, NCGC00094345-01, CPD000449299, SAM001246999, KB-147557, LS-113853, B6632, EU-0101066, X6887, SR-01000075564-2, SR-01000075564-3, [1-(6-chloropyridin-2-yl)piperidin-4-yl]amine hydrochloride, AC1Q1T0S


ID: 647

chemical graph of compound 647



InChIKey: FUQAYSQLAOJBBC-UHFFFAOYSA-N
SMILES: CC1(CC2C1CCC3(CCCC2(C3)O)C)C

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 61125
synonyms found at PubChem are:
beta-Caryophyllene alcohol, Caryophyllenol, Caryolan-1-ol, 472-97-9, Tricyclo[6.3.1.02,5]dodecan-1-ol, 4,4,8-trimethyl-, (1R,2S,5R,8S)-, beta-caryolan-1-ol, Spectrum_000678, SpecPlus_000224, AC1L1UKR, Spectrum2_001727, Spectrum3_001279, Spectrum4_001455, Spectrum5_000069, 4,4,8-Trimethyltricyclo(6.3.1.02,5)dodecan-1-ol, BSPBio_002878, KBioGR_001969, KBioSS_001158, SPECTRUM300105, DivK1c_006320, SPBio_001774, SCHEMBL3508459, CHEMBL1374805, KBio1_001264, KBio2_001158, KBio2_003726, KBio2_006294, KBio3_002378, FUQAYSQLAOJBBC-UHFFFAOYSA-N, CCG-38795, SDCCGMLS-0066495.P001, NCGC00095583-01, NCGC00095583-02, AN-23476, SR-05000002464, SR-05000002464-1, 4,4,8-Trimethyl-Tricyclo(6.3.1.02,5)dodecan-1-ol, 4,4,8-trimethyltricyclo[6.3.1.0;{2,5}]dodecan-1-ol, 4,4,8-Trimethyltricyclo[6.3.1.02,5]dodecan-1-ol, 9CI


ID: 648

chemical graph of compound 648



InChIKey: FUQOTYRCMBZFOL-UHFFFAOYSA-N
SMILES: C1=CC2=C(C=C1Cl)C=C(N2)C(=O)O

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 82693
synonyms found at PubChem are:
5-Chloroindole-2-carboxylic acid, 10517-21-2, 5-Chloro-1H-indole-2-carboxylic acid, 5-Chloroindole-2-carboxylate, 1H-Indole-2-carboxylic acid, 5-chloro-, EINECS 234-050-1, BRN 0153229, FUQOTYRCMBZFOL-UHFFFAOYSA-N, Spectrum_000183, 5-Chloroindoline-2-carboxylicacid, PubChem1670, ACMC-1BZTJ, SpecPlus_000670, Spectrum2_000513, Spectrum3_000783, Spectrum4_001044, Spectrum5_001833, Biomol-NT_000198, 2-Carboxy-5-chloro-indole, AC1Q73TG, NCIOpen2_000893, 5-chloroindolecarboxylic acid, Oprea1_643267, BSPBio_002486, KBioGR_001308, KBioSS_000663, KSC181I8F, MLS002207052, CHEMBL23906, DivK1c_006766, SCHEMBL720582, SPECTRUM1502057, SPBio_000465, AC1L33X8, BPBio1_001228, 5-Chloroindole-2-carboxylicacid, Jsp000495, CTK0I1482, KBio1_001710, KBio2_000663, KBio2_003231, KBio2_005799, KBio3_001706, KS-00000NGC, 5-chloro-2-indolecarboxylic acid, 5-chloroindole-2-carboxylic-acid, DTXSID60146993, CHEBI:107646, MolPort-000-148-158, 5-chloro indole-2-carboxylic acid, 5-chloro-indole-2-carboxylic acid, ZINC164954, ACT03581, ALBB-006019, BCP15099, NSC75651, 5chloro-1H-indole-2-carboxylic acid, ANW-15178, BBL001474, CCG-39574, CL3504, HTS000962, MFCD00005613, NSC-75651, SBB003591, STK287956, 5-chloro-indole-2-carbo--xylic acid, 5-Chloro-1H-indol-2-carboxylic acid, AKOS000137114, AC-8793, AN-7657, CG-0517, CS-W007385, MCULE-5711501424, RL00239, RP04019, RTC-060641, TRA0013214, VI30019, 5-chloro-1 H-indole-2-carboxylic acid, 5-Chloroindole-2-carboxylic acid, 98%, NCGC00095877-01, NCGC00095877-02, NCGC00095877-03, AJ-16329, BP-11766, BR-28711, I798, KB-73467, LS-82555, SC-00214, SMR001306706, AB0013897, AB1005637, DB-012761, KB-245386, ST2418704, TC-060641, TL8000199, 4CH-015451, A1974, AM20061127, BB 0248943, C1868, FT-0620319, ST50406277, EN300-28911, M-2316, 517C212, BRD-K57244822-001-03-1, 3ZB


ID: 649

chemical graph of compound 649



InChIKey: FUSNMLFNXJSCDI-UHFFFAOYSA-N
SMILES: CC1=CC(=CC=C1)N(C)C(=S)OC2=CC3=CC=CC=C3C=C2

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 5510
synonyms found at PubChem are:
tolnaftate, 2398-96-1, Tolnaphthate, Tinactin, Tonoftal, Sporiline, Tinaderm, Tolsanil, Aftate, Chinofungin, Dermoxin, Focusan, Tinavet, Pitrex, Naphthiomate T, Phytoderm, Tolnaftato, Tolnaftatum, Timoped, Tritin, HI-Alazin, Fungistop, Sorgoa, Dungistop, Tniaderm, Separin, Tolnaftato [DCIT], Naphthiomate-T, Hi-alarzin, O-2-Naphthyl m,N-dimethylthiocarbanilate, Tolnaftatum [INN-Latin], Sch 10144, 2-Naphthyl N-methyl-N-(3-tolyl)thionocarbamate, Tolnaftato [INN-Spanish], Genaspore cream, Tinactin powder, Tinavet (Veterinary), Tinactin cream, Pitrex cream, Ting Products, Tinactin solution, Zeasorb-AF powder, Tinactin (TN), Prestwick_472, Separin (TN), NP-27 Solution, Tinactin plus powder, Dr. Scholl's athlete's foot spray, Ting antifungal cream, NP-27 Powder, m,N-Dimethylthiocarbanilic acid O-2-naphthyl ester, Ting antifungal powder, NP-27 Cream, Tinactin aerosol liquid, Tinactin aerosol powder, NP-27 Spray Powder, Tinactin jock itch cream, Aftate for jock itch gel, Methyl (3-methylphenyl)carbamothioic acid O-2-naphthalenyl ester, Tinactin plus aerosol powder, Ting antifungal spray liquid, Ting antifungal spray powder, Carbamothioic acid, methyl(3-methylphenyl)-, O-2-naphthalenyl ester, Tolnaftate(USAN), UNII-06KB629TKV, Carbanilic acid, m,N-dimethylthio-, O-2-naphthyl ester, Carbanilic acid, N,m-dimethylthio-, O-2-naphthyl ester, Aftate for athlete's foot gel, NSC 233648, TOLNAFRATE, Tinactin jock itch spray powder, MLS000028526, Tinactin jock itch aerosol powder, Tolnaftate [USAN:BAN:INN:JAN], Tolnaftate [USAN:INN:BAN:JAN], Aftate for jock itch sprinkle powder, EINECS 219-266-6, Tolnaftate (JP14/USP), Tolnaftate (JP15/USP), BRN 2752620, O-2-Naphthyl N,N-dimethylthiocarbanilate, SMR000058288, C19H17NOS, Aftate for jock itch aerosol spray powder, Tinactin antifungal deodorant powder aerosol, 06KB629TKV, CHEBI:9620, O-naphthalen-2-yl N-methyl-N-(3-methylphenyl)carbamothioate, FUSNMLFNXJSCDI-UHFFFAOYSA-N, N-methyl-N-(3-methylphenyl)-1-naphthalen-2-yloxy-methanethioamide, Carbamothioic acid, N-methyl-N-(3-methylphenyl)-, O-2-naphthalenyl ester, O-2-naphthyl methyl(3-methylphenyl)carbamothioate, NCGC00016610-01, Aftate for athlete's foot sprinkle powder, Methyl-[3-methylphenyl]-carbamothioic acid O-2-naphthyl ester, CAS-2398-96-1, Aftate for athlete's foot aerosol spray liquid, Aftate for athlete's foot aerosol spray powder, DSSTox_CID_22477, DSSTox_RID_80034, DSSTox_GSID_42477, O-2-Naphthyl methyl(3-methylphenyl)thiocarbamate, 94256-64-1, o-(2-Naphthyl) methyl(3-methylphenyl)thiocarbamate, O-(2-naphthyl) N-methyl-N-(m-tolyl)carbamothioate, W-107363, O-naphthalen-2-yl methyl(3-methylphenyl)carbamothioate, Breezee, Genaspor, Methyl-(3-methylphenyl)carbamothioic acid O-2-naphthyl ester, Micoisdin, O-Naphthalen-2-yl N-Methyl-N-(3-Methylphenyl)Thiocarbamate, Tinatox, Ting, ZeaSorb, N-Methyl-(3-methylphenyl)-carbamothioic acid, O-2-naphthalenyl ester, N-methyl-N-(3-methylphenyl)-1-(naphthalen-2-yloxy)methanethioamide, Ony Clear, Ony-Clear, Tolnaftat Purder N, Purder N, Tolnaftat, SR-01000003084, Tolnaflate, NP27, Tolnaftate-10KG, Absorbine (TN), NP 27, Carbamothiolic Acid, Genaspor (TN), Aftate (TN), Odor Eaters (TN), Scholl (TN), Lamasil AF (TN), Tolnaftate [USAN:USP:INN:BAN:JAN], Ting (TN), Spectrum_000963, N-dimethylthiocarbanilate, Tolnaftate Douglas Brand, Opera_ID_1698, Prestwick0_000070, Prestwick1_000070, Prestwick2_000070, Prestwick3_000070, Spectrum2_000950, Spectrum4_000360, Spectrum5_001000, Tolnaftate Schering Brand, Essex Brand of Tolnaftate, Isdin Brand of Tolnaftate, D02NTO, Zenith Brand of Tolnaftate, AC1L1KI4, Bioglan Brand of Tolnaftate, cid_5510, Douglas Brand of Tolnaftate, Insight Brand of Tolnaftate, SCHEMBL3520, Stiefel Brand of Tolnaftate, Chinosol Brand of Tolnaftate, Schering Brand of Tolnaftate, Thompson Brand of Tolnaftate, BSPBio_000259, KBioGR_000799, KBioSS_001443, MLS001146910, ARONIS24597, CHEMBL83668, DivK1c_000334, SPECTRUM1500583, SPBio_000920, SPBio_002180, Pedinol Brand 1 of Tolnaftate, Pedinol Brand 2 of Tolnaftate, BPBio1_000285, Tolnaftate (JP15/USP/INN), Tolnaftate (JP17/USP/INN), Wernigerode Brand of Tolnaftate, DTXSID3042477, BDBM39349, CTK5H6131, HMS501A16, KBio1_000334, KBio2_001443, KBio2_004011, KBio2_006579, KS-00000ZUQ, ZINC57522, MolPort-002-893-958, NINDS_000334, HMS1568M21, HMS1921E21, HMS2092O05, HMS2095M21, HMS2231O21, HMS3373P10, HMS3655D15, HMS3712M21, NP 27 (TN), Pharmakon1600-01500583, Carter Wallace Brand of Tolnaftate, BCP12071, HY-B0370, KS-000046KG, Tox21_110521, Tox21_301363, MFCD00056611, NSC233648, NSC757355, s2058, SCH-10144, STL069548, AKOS005111014, Schering-Plough Brand 1 of Tolnaftate, Schering-Plough Brand 2 of Tolnaftate, Tox21_110521_1, AC-5548, API0004445, CCG-212827, CS-2427, DB00525, KS-5115, MCULE-6942707513, NSC-233648, NSC-757355, IDI1_000334, NCGC00016610-02, NCGC00016610-03, NCGC00016610-04, NCGC00016610-05, NCGC00016610-07, NCGC00016610-08, NCGC00023506-03, NCGC00255761-01, AN-10909, CC-35091, LS-51199, Q770, SC-16758, ZB002142, Carbamothioic acid, O-2-naphthalenyl ester, SBI-0051538.P002, AB2000462, TR-011103, AB00052111, FT-0603605, D00381, K-6488, O-naphthalen-2-yl methyl(m-tolyl)carbamothioate, AB00052111_17, AB00052111_18, N-Dimethylthiocarbanilic acid O-2-naphthyl ester, 398T961, C-19112, O-(naphthalen-2-yl) methyl(m-tolyl)carbamothioate, Carbanilic acid,m-dimethylthio-, O-2-naphthyl ester, Carbanilic acid,N-dimethylthio-, O-2-naphthyl ester, SR-01000003084-2, SR-01000003084-4, BRD-K44273375-001-04-5, BRD-K44273375-001-14-4, BRD-K44273375-001-23-5, O-(2-Naphthyl) methyl(3-methylphenyl)thiocarbamate #, Methyl(3-methylphenyl)carbamothioic Acid O-2-Naphthyl Ester, N-methyl-N-(m-tolyl)thiocarbamic acid O-(2-naphthyl) ester, Tolnaftate, European Pharmacopoeia (EP) Reference Standard, Tolnaftate, United States Pharmacopeia (USP) Reference Standard, N-methyl-N-(3-methylphenyl)carbamothioic acid O-(2-naphthalenyl) ester, Tolnaftate, Pharmaceutical Secondary Standard; Certified Reference Material, Tolnaftate for system suitability, European Pharmacopoeia (EP) Reference Standard


ID: 650

chemical graph of compound 650



InChIKey: FUZBPOHHSBDTJQ-CFOQQKEYSA-L
SMILES: C[C@H](CC1=CC2=C(C=C1)OC(O2)(C(=O)[O-])C(=O)[O-])NC[C@@H](C3=CC(=CC=C3)Cl)O.[Na+].[Na+]

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 5312115
synonyms found at PubChem are:
CL 316,243, UNII-CF9MRO9QWW, CL-316243, 138908-40-4, CF9MRO9QWW, CL-316,243, CL316243, BTA-243, CL 316243, CL316,243, FUZBPOHHSBDTJQ-CFOQQKEYSA-L, Disodium (R,R)-5-(2-((2-(3-chlorophenyl)-2-hydroxyethyl)-amino)propyl)-1,3-benzodioxole-2,3-dicarboxylate, CHEMBL32590, Disodium 5-[(2R)-2-[[(2R)-2-(3-Chlorophenyl)-2-hydroxyethyl]amino]propyl]-1,3-benzodioxole-2,2-dicarboxylate, 151126-84-0, disodium 5-[(2R)-2-{[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]amino}propyl]-1,3-benzodioxole-2,2-dicarboxylate, 1,3-Benzodioxole-2,2-dicanboxylic acid, 5-(2-((2-(3-chlorophenyl)-2-hydroxyethyl)amino)propyl)-, disodium salt, (R-(R*,R*))-, CL-316243 sodium, AC1NSM16, SCHEMBL2016430, DTXSID6041004, MolPort-003-940-777, HMS3260L12, Tox21_500295, 138908-40-4 (sodium salt), AKOS024456637, API0008511, LP00295, NCGC00093745-01, NCGC00260980-01, AS-16747, CC-20995, EU-0100295, FT-0697629, C 5976, 102718-EP2272841A1, 102718-EP2301936A1, 5-[(2R)-2-([(2R)-2-(3-CHLOROPHENYL)-2-HYDROXYETHYL]AMINO)PROPYL]-1,3-BENZODIOXOLE-2,2-DICARBOXYLATE DISODIUM, 5-[(2R)-2-[[(2R)-2-(3-Chlorophenyl)-2-hydroxyethyl]amino]propyl]-1,3-benzodioxole-2,2-dicarboxylic acid disodium salt, sodium 5-((R)-2-((R)-2-(3-chlorophenyl)-2-hydroxyethylamino)propyl)benzo[d][1,3]dioxole-2,2-dicarboxylate, AOB33751, NCGC00092282-01


ID: 651

chemical graph of compound 651



InChIKey: FUZMQNZACIFDBL-KYJUHHDHSA-N
SMILES: CN1CCC2=CC(=C3C=C2[C@@H]1CC4=CC=C(C=C4)OC5=C(C=CC(=C5)C[C@H]6C7=C(CCN6C)C(=C(C(=C7O3)OC)OC)OC)OC)OC

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 72343
synonyms found at PubChem are:
Hernandezine, (+)-Hernandezine, 6681-13-6, CHEBI:5677, (1|A)-5,6,6',7,12-pentamethoxy-2,2'-dimethylberbaman, AC1L2HVY, pentamethoxy(dimethyl)[?], NSC626650, AC1Q58FE, CHEMBL504936, SCHEMBL16254179, DTXSID40216926, BDBM50201796, ZINC19685806, AKOS015969728, CCG-208358, C09461, SR-05000002295, SR-05000002295-2, Berbaman, 5,6,6',7,12-pentamethoxy-2,2'-dimethyl-, (1beta)-, 16H-1,24:6,9-Dietheno-11,15-metheno-2H-pyrido[2',3':17,18][1,11]dioxacycloeicosino[2,3,4-ij]isoquinoline, 3,4,4a,5,16a,17,18,19-octahydro-12,20,21,22,26-pentamethoxy-4,17-dimethyl-, (4aS,16aS)-


ID: 652

chemical graph of compound 652



InChIKey: FVLVBPDQNARYJU-UHFFFAOYSA-N
SMILES: CC1CCC(CC1)NC(=O)N(CCCl)N=O

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 5198
synonyms found at PubChem are:
semustine, Methyl-CCNU, 13909-09-6, MeCCNU, METHYL CCNU, trans-Methyl-CCNU, 1-(2-Chloroethyl)-3-(4-methylcyclohexyl)-1-nitrosourea, Lomustine, methyl-, Semustina, Semustinum, NSC 95441, ICIG 1110, Semustine [USAN:INN], Semustinum [INN-Latin], UNII-EGU4CMI14D, Semustina [INN-Spanish], NCI-C04955, Urea, N-(2-chloroethyl)-N'-(4-methylcyclohexyl)-N-nitroso-, Lomustine, methyl, UNII-2281H4FBL9, CCRIS 6336, N-(2-Chloroethyl)-N'-(4-methylcyclohexyl)-N-nitrosourea, NSC95441, EGU4CMI14D, NSC 135091, CHEBI:6863, Urea, 1-(2-chloroethyl)-3-(4-methylcyclohexyl)-1-nitroso-, 1-(2-Chloroethyl)-3-(trans-4-methylcyclohexane)-1-nitrosourea, 2281H4FBL9, Urea, 1-(2-chloroethyl)-3-(4-methylcyclohexyl)-1-nitroso-, trans-, UNII-6YY7T1T567, 33185-87-4, Methyl-CCNU [Chloroethyl nitrosoureas], NCGC00095051-01, cis-1-(2-Chloroethyl)-3-(4-methylcyclohexyl)-1-nitrosourea, N-(2-Chloroethyl)-N'-(trans-4-methylcyclohexyl)-N-nitrosourea, Urea, N-(2-chloroethyl)-N'-(4-methylcyclohexyl)-N-nitroso-, cis-, Urea, N-(2-chloroethyl)-N'-(4-methylcyclohexyl)-N-nitroso-, trans-, 33073-59-5, 1-(2-Choroethyl)-3-(4-methylcyclohexyl)-1-nitrosourea, 1-(2-chloroethyl)-3-(4-methylcyclohexyl)-1-nitroso-urea, Urea,N-(2-chloroethyl)-N'-(4-methylcyclohexyl)-N-nitroso-, trans-Semustine, cis-Semustine, Urea, 3-(beta-chloroethyl)-1-(4-methylcyclohexyl)-3-nitroso-, Urea, 1-(2-chloroethyl)-3-(4-methylcyclohexyl)-1-nitroso-, (Z)-, 1-(2-Chloroethyl)-1-([(4-methylcyclohexyl)amino]carbonyl)-2-oxohydrazine, cis-Methyl CCNU, 1-(2-Chloroethyl)-3-(4-methylcyclohexyl)-1-nitrosourea [Chloroethyl nitrosoureas], SMR000058889, trans-Methyl CCNU, 6YY7T1T567, MeCCNU (trans), Me-CCNU, 1-[2-Chloroethyl]-3-[4-methylcyclohexyl]-1-nitrosourea, methyl lomustine, 1-(2-Chloroethyl)-1-(((4-methylcyclohexyl)amino)carbonyl)-2-oxohydrazine, HSDB 7760, NSC-95441, Prestwick_1013, Spectrum_001335, AI3-52897, Semustine (USAN/INN), AC1L1JTC, AC1Q5MLQ, Spectrum2_000911, Spectrum3_000966, Spectrum4_001084, Spectrum5_001087, SCHEMBL4500, DSSTox_CID_11603, DSSTox_RID_78887, DSSTox_GSID_31603, BSPBio_002571, KBioGR_001468, KBioSS_001815, MLS000069831, MLS001074931, CHEMBL12948, DivK1c_000020, SPECTRUM1503422, SPBio_000782, SCHEMBL4959160, CHEMBL1967746, CHEMBL2051944, DTXSID8031603, CTK4C1614, HMS500A22, KBio1_000020, KBio2_001815, KBio2_004383, KBio2_006951, KBio3_001791, FVLVBPDQNARYJU-UHFFFAOYSA-N, NINDS_000020, HMS1922C16, HMS2093E21, Pharmakon1600-01503422, 1-trans-(2-Chloroethyl)-3-(4-methylcyclohexyl)-1-nitrosourea, KS-000018RB, ZINC3874951, Tox21_111404, CCG-39897, LS-814, NSC135091, NSC758471, Urea, 1-(2-chloroethyl)-3-(4-methylcyclohexyl)-1-nitroso-, cis-, Urea, N-(2-chloroethyl)-N'-(4-methylcyclohexyl)-N-nitroso-, cis- (9CI), API0004155, NSC-135091, NSC-758471, IDI1_000020, QTL1_000073, NCGC00095051-02, NCGC00095051-03, NCGC00095051-04, NCI60_042122, SBI-0051825.P002, CAS-13909-09-6, LS-159442, C07640, D05822, AB01563283_01, 909S096, SR-01000763446, J-007221, SR-01000763446-2, 1-(2-Chloroethyl)-3-(4-methylcyclohexyl)-1-nitrosoure, 1-(2-Chloroethyl)-3-(4-methyl-cyclohexyl)-1-nitrosourea, UNII-6YY7T1T567 component FVLVBPDQNARYJU-DTORHVGOSA-N, UNII-6YY7T1T567 component FVLVBPDQNARYJU-KYZUINATSA-N, 1-(2-Chloroethyl)-3-(4alpha-methylcyclohexan-1alpha-yl)-1-nitrosourea, 1-(2-Chloroethyl)-3-(4beta-methylcyclohexan-1alpha-yl)-1-nitrosourea, Urea, 1-(2-chloroethyl)-3-(4-methylcyclohexyl)-1-nitroso-, cis- (8CI), Urea, 1-(2-chloroethyl)-3-(4-methylcyclohexyl)-1-nitroso-, trans- (8CI), 56748-54-0


ID: 653

chemical graph of compound 653



InChIKey: FVWJYYTZTCVBKE-ROUWMTJPSA-N
SMILES: CC(=C)[C@@H]1CC[C@]2([C@H]1[C@H]3CC[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)O)C)CO

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 72326
synonyms found at PubChem are:
Betulin, 473-98-3, Betulinol, Betuline, Trochol, Betulol, Lup-20(29)-ene-3b,28-diol, Lup-20(29)-ene-3beta,28-diol, UNII-6W70HN7X7O, C30H50O2, NSC 4644, EINECS 207-475-5, Lup-20(30)-ene-3beta,28-diol, AI3-62999, 6W70HN7X7O, CHEBI:3086, Lup-20(29)-ene-3,28-diol, (3beta)-, (1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-3a-(Hydroxymethyl)-5a,5b,8,8,11a-pentamethyl-1-(prop-1-en-2-yl)icosahydro-1H-cyclopenta[a]chrysen-9-ol, Betulinic alcohol, lup-20(29)-ene-3 beta,28-diol, (1R,2R,5S,8R,9R,10R,13R,14R,17S,19R)-5-(hydroxymethyl)-1,2,14,18,18-pentamethyl-8-(prop-1-en-2-yl)pentacyclo[11.8.0.0^{2,10}.0^{5,9}.0^{14,19}]henicosan-17-ol, (1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-3a-(hydroxymethyl)-1-isopropenyl-5a,5b,8,8,11a-pentamethyl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-ol, SR-05000002167, NSC4644, NSC-4644, NSC692218, (3beta)-lup-20(29)-ene-3,28-diol, Betulin, 23, Betulin, >=98%, Prestwick3_000990, D05KJY, AC1L2HV4, Betulin, analytical standard, BSPBio_001059, ARONIS24303, CHEMBL23236, SCHEMBL131739, BPBio1_001165, MEGxp0_001726, ACon1_000091, BDBM23207, FVWJYYTZTCVBKE-ROUWMTJPSA-N, MolPort-001-742-486, HMS2098E21, HY-N0083, ZINC3978650, MFCD00016802, SBB080743, Lup-20(29)-ene-3 ,28-diol, AKOS005267212, Lup-20(29)-ene-3beta, 28-diol, ACN-035289, AN-8466, API0001703, CCG-208619, CS-6156, GS-3254, LMPR0106140005, NSC-692218, RL03767, NCGC00168803-01, NCGC00168803-02, NCGC00168803-04, AJ-47572, AK-72923, BR-72923, CC-24647, LS-88195, SC-47257, AX8001985, ST2413202, AB00513988, B0803, N1290, V0184, (3.beta.)-Lup-20(29)-ene-3,28-diol, C08618, S-1793, 473B983, C-22391, Q-100501, SR-05000002167-2, SR-05000002167-3, BRD-K64874225-001-01-3, NCGC00168803-04_C30H50O2_Lup-20(29)-ene-3,28-diol, (3beta)-, (1R,2R,5S,8R,9R,10R,13R,14R,17S,19R)-5-(hydroxymethyl)-1,2,14,18,18-pentamethyl-8-(prop-1-en-2-yl)pentacyclo[11.8.0.0(2),(1)?.0?,?.0(1)?,(1)?]henicosan-17-ol, (1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-3 a-(hydroxymethyl)-5a,5b,8,8,11a-pentamethyl-1-(prop-1-en-2-yl)icosahydro-1H-cyclopenta[a]chrysen-9-ol, (1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-3a-(Hydroxymethyl)-5a,5b,8,8,11a-pentamethyl-1-(prop-1-e, (1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-3a-(hydroxymethyl)-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-ol, (5S,17S,1R,2R,8R,9R,10R,13R,14R,19R)-5-(hydroxymethyl)-1,2,14,18,18-pentamethy l-8-(1-methylvinyl)pentacyclo[11.8.0.0<2,10>.0<5,9>.0<14,19>]henicosan-17-ol


ID: 654

chemical graph of compound 654



InChIKey: FVXYCYOANPHZHB-ZSWFMMJVSA-N
SMILES: C[C@@]12CCC3[C@@]4([C@H](C(C5(C(C4=O)C[C@]3(C1=CC(=O)O[C@H]2C6=COC=C6)O5)Cl)(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:

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


CID is 6708564
synonyms found at PubChem are:
SPBio_000072, Spectrum_000642, SpecPlus_000131, Spectrum2_000256, Spectrum3_000039, Spectrum4_001321, Spectrum5_000161, BSPBio_001737, KBioGR_001781, KBioSS_001122, DivK1c_006227, KBio1_001171, KBio2_001122, KBio2_003690, KBio2_006258, KBio3_000877, CCG-39940, NCGC00179045-01, 3-CHLORO-8beta-HYDROXYCARAPIN, 3,8-HEMIACETAL, BRD-A66979321-001-02-1


ID: 655

chemical graph of compound 655



InChIKey: FVYXIJYOAGAUQK-UHFFFAOYSA-N
SMILES: C=CCC1=CC(=C(C=C1)O)C2=CC(=C(C=C2)O)CC=C

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 72303
synonyms found at PubChem are:
Honokiol, 35354-74-6, 5,3'-Diallyl-2,4'-dihydroxybiphenyl, NSC 293100, Honokiol,(S), 3,5'-Diallyl-4,2'-dihydroxybiphenyl, UNII-11513CCO0N, 3',5-Diallylbiphenyl-2,4'-diol, CPD000387107, CHEMBL16901, CHEBI:5759, 3',5-diallyl-[1,1'-biphenyl]-2,4'-diol, 4-allyl-2-(3-allyl-4-hydroxy-phenyl)phenol, 11513CCO0N, 3',5-diallyl-2,4'-biphenyldiol, 5,3&prime;-Diallyl-2,4&prime;-dihydroxydiphenyl, Q-100425, [1,1'-Biphenyl]-2,4'-diol, 3',5-di-2-propenyl-, SMR000387107, 3',5-di(prop-2-en-1-yl)biphenyl-2,4'-diol, houpa, Honokiol, HO, 5,3&prime, AC1L2HTG, D04DQJ, AC1Q7A9U, Honokiol, analytical standard, cid_72303, MLS000759481, MLS001048916, MLS001423980, MLS006011755, SCHEMBL133034, REGID_for_CID_72303, ZINC1536, CTK5J3931, KS-00000NQF, DTXSID30188845, 3',1'-biphenyl)-2,4'-diol, FVYXIJYOAGAUQK-UHFFFAOYSA-N, MolPort-002-507-432, HMS2051C12, HMS2271J07, HMS3393C12, HMS3656G03, BCP28282, HY-N0003, 3',5'-Diallyl-2,4'-biphenyldiol, 5,3'-Diallyl-biphenyl-2,4'-diol, AC-486, ANW-56605, BBL027819, BDBM50157304, BN0719, MFCD00016674, NSC293100, s2310, STK801954, 3'',5-diallylbiphenyl-2,4''-diol, Honokiol, >=98% (HPLC), powder, AKOS005622639, 3',5-Diallyl-2,4'-dihydroxybiphenyl, ACN-035410, API0002927, AT-5464, CCG-100864, CS-1696, MCULE-5001549020, NC00114, NSC-293100, RTR-014635, VZ32385, 5,3''-Diallyl-biphenyl-2,4''-diol, SMP2_000040, NCGC00163567-01, NCGC00163567-02, NCGC00163567-03, 4CN-0876, AJ-08043, AK-25837, AN-15767, AS-15333, BC205226, O900, SAM001246690, SC-17371, AB0016711, AX8008971, LS-174528, TR-014635, 5,3''''-Diallyl-biphenyl-2,4''''-diol, FT-0601638, N1672, ST24044036, C10630, J10347, W-2613, 354H746, SR-01000758208, I06-0428, SR-01000758208-5, {1,1'-Biphenyl]-2,4'-diol, 3,5-di-2-propenyl-, 3'',5-di-2-propenyl-1,1''-biphenyl-2,4''-diol, BRD-K98493452-001-01-6, 2-(4-hydroxy-3-prop-2-enylphenyl)-4-prop-2-enylphenol, 3',5-Di-2-propen-1-yl[1,1'-biphenyl]-2,4'-diol, Honokiol, European Pharmacopoeia (EP) Reference Standard, [1,1'-Biphenyl]-2,4'-diol, 3',5-di-2-propen-1-yl-, InChI=1/C18H18O2/c1-3-5-13-7-9-18(20)16(11-13)14-8-10-17(19)15(12-14)6-4-2/h3-4,7-12,19-20H,1-2,5-6H


ID: 656

chemical graph of compound 656



InChIKey: FWKQNCXZGNBPFD-UHFFFAOYSA-N
SMILES: CC1=C2C=CC(=C2C=C(C=C1)C(C)C)C

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 3515
synonyms found at PubChem are:
guaiazulene, 489-84-9, 1,4-Dimethyl-7-isopropylazulene, 7-Isopropyl-1,4-dimethylazulene, Vetivazulen, Azulon, Azunol, Eucazulen, Guajazulene, Kessazulen, Purazulen, Silazulon, Uroazulen, S-Guaiazulene, Cuteazul, Guiazulene, Gurjunazulen, Azulen-beris, 3,8-Dimethyl-5-(2-propyl)azulene, Azulene, 1,4-dimethyl-7-(1-methylethyl)-, 1,4-Dimethyl-7-(1-methylethyl)azulene, Azulol, 1,4-dimethyl-7-(propan-2-yl)azulene, guaiazulen, Vaumigan, hepatoprotectant, UNII-2OZ1K9JKQC, NSC 4714, AZ-8 beris, Azunol (TN), 7-isopropyl- 1,4-dimethylazulene, 7-isopropyl-1,4-dimethyl-azulene, AZULENE, 1,4-DIMETHYL-7-ISOPROPYL-, EINECS 207-701-2, 2OZ1K9JKQC, Azulene, 7-isopropyl-1,4-dimethyl-, BRN 1365001, CHEBI:5550, 1,4-dimethyl-7-propan-2-ylazulene, C15H18, 1,4-Dimethyl-7-isopropylazulene (JAN), NCGC00095836-02, Azulene, 7-isopropyl-1,4-dimethyl- (8CI), DSSTox_CID_25996, DSSTox_RID_81279, DSSTox_GSID_45996, CAS-489-84-9, Eucazulene, Guajazulen, Kessazulene, Guaiazulene 98%, Guaiazulene, 99%, Azulene,4-dimethyl-, PubChem15731, Spectrum_001198, Spectrum2_001089, Spectrum3_001537, Spectrum4_000762, Spectrum5_001090, AC1L1G3Z, BSPBio_002954, KBioGR_001144, KBioSS_001678, 4-05-00-01751 (Beilstein Handbook Reference), KSC492A3L, MLS002207286, 1,3,5,7,9-Guaiapentaene, DivK1c_001006, SPECTRUM1502249, SPBio_001138, AZ-8, CHEMBL1408759, DTXSID7045996, CTK3J2035, HMS503I13, KBio1_001006, KBio2_001678, KBio2_004246, KBio2_006814, KBio3_002454, Azulene,4-dimethyl-7-isopropyl-, NSC4714, FWKQNCXZGNBPFD-UHFFFAOYSA-N, MolPort-001-766-757, NINDS_001006, 1, 4-Dimethyl-7-isopropylazulene, ZINC968478, 1,4-Dimethyl-7-isopropyl-Azulene, BB_NC-01536, KS-000001GN, NSC-4714, ZX-AT020641, Tox21_111526, ANW-41603, BBL027440, CCG-40099, MFCD00003811, STK801958, 1,4-dimethyl-7-(methylethyl)azulene, 1,4-dimethyl-7-propan-2-yl-azulene, 1,4-Dimethyl-7-(prop-2-yl)azulene, AKOS001082716, Tox21_111526_1, LMPR0103410006, MCULE-9349286347, OR28914, RTR-017759, SDCCGMLS-0066686.P001, WLN: L57J B1 F1 IY1&1, IDI1_001006, Azulene,4-dimethyl-7-(1-methylethyl)-, NCGC00095836-01, NCGC00095836-03, NCGC00095836-05, NCGC00178373-01, 1,4-dimethyl-7-(1-methylethyl)-azulene, AN-45261, AS-13972, CC-29080, CJ-04653, KB-52304, LS-23575, SMR001306801, ST098714, ZB015559, TL8003279, TR-017759, FT-0626818, G0228, V0215, 1,4-Dimethyl-7-(1-methyl)-azulene (azulon), 1,4-Dimethyl-7-(1-methylethyl)azulene, 9CI, C09675, D01037, A827639, C-30056, SR-05000002441, SR-05000002441-1, BRD-K36719159-001-04-9, I14-99343, Z56347227, 12040-47-0, InChI=1/C15H18/c1-10(2)13-7-5-11(3)14-8-6-12(4)15(14)9-13/h5-10H,1-4H


ID: 657

chemical graph of compound 657



InChIKey: FWYSBEAFFPBAQU-LBPRGKRZSA-N
SMILES: CC(C)([C@@H]1CC2=C(O1)C=C3C(=C2)C=CC(=O)O3)O

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 334704
synonyms found at PubChem are:
Marmesin, (+)-Marmesin, 13849-08-6, S-(+)-Marmesin, (7S)-marmesin, (S)-Marmesin, MARMESIN, (+)-, CHEBI:6695, CHEMBL442813, (2S)-2-(1-hydroxy-1-methylethyl)-2,3-dihydro-7H-furo[3,2-g]chromen-7-one, (S)-2-(2-Hydroxypropan-2-yl)-2H-furo[3,2-g]chromen-7(3H)-one, (+)-2,3-dihydro-2-(1-hydroxy-1-methylethyl)-7H-furo[3,2-g][1]benzopyran-7-one, (S)-(+)-2,3-dihydro-2-(1-hydroxy-1-methylethyl)-7H-furo[3,2-g][1]benzopyran-7-one, (S)-2,3-dihydro-2-(1-hydroxy-1-methylethyl)-7H-furo[3,2-g][1]benzopyran-7-one, (S)-2-(2-hydroxypropan-2-yl)-2,3-dihydro-7H-furo[3,2-g]chromen-7-one, S(+)-Marmesin, Spectrum_001516, SpecPlus_000918, AC1L7FYQ, Spectrum2_000737, Spectrum3_001642, Spectrum4_001701, Spectrum5_000402, BSPBio_003363, KBioGR_002022, KBioSS_001996, DivK1c_007014, SPBio_000694, MEGxp0_001933, 2-(1-Hydroxy-1-methylethyl)-2,3-dihydro-7H-furo[3,2-g]chromen-7-one #, SCHEMBL12062107, KBio1_001958, KBio2_001996, KBio2_004564, KBio2_007132, KBio3_002583, ZINC51924, FWYSBEAFFPBAQU-LBPRGKRZSA-N, MolPort-002-321-244, HY-N2176, BDBM50250917, CCG-40145, NSC340840, AKOS021983162, CS-7901, MCULE-3509624985, MCULE-4926964615, NSC-340840, SDCCGMLS-0066759.P001, 7H-Furo[3,2-g][1]benzopyran-7-one, 2,3-dihydro-2-(1-hydroxy-1-methylethyl)-, (S)-, C09276, AB00053150-02, BRD-K36377456-001-02-0, 7H-Furo[3, 2,3-dihydro-2-(1-hydroxy-1-methylethyl)-, (+)-, 7H-Furo[3, 2,3-dihydro-2-(1-hydroxy-1-methylethyl)-, (S)-, (2S)-2-(2-hydroxypropan-2-yl)-2,3-dihydrofuro[3,2-g]chromen-7-one, 7H-Furo[3, 2,3-dihydro-2-(1-hydroxy-1-methylethyl)-, (S)-(+)-, (2S)-2,3-dihydro-2-(1-hydroxy-1-methylethyl)-7H-furo[3,2-g][1]benzopyran-7-one, 7H-Furo[3,2-g][1]benzopyran-7-one, 2,3-dihydro-2-(1-hydroxy-1-methylethyl)-, (+)-, 7H-Furo[3,2-g][1]benzopyran-7-one,2,3-dihydro-2-(1-hydroxy-1-methylethyl)-, (2S)-, NCGC00178117-02!(2S)-2-(2-hydroxypropan-2-yl)-2,3-dihydrofuro[3,2-g]chromen-7-one


ID: 658

chemical graph of compound 658



InChIKey: FXKCQWIUITUJFU-UHFFFAOYSA-N
SMILES: CN1C2CCC1CC(C2)OC(C3=CC=CC=C3)C4=CC=C(C=C4)Cl.Cl

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 203135
synonyms found at PubChem are:
Chlortropbenzyl, FC-1, Tropine 4-chlorobenzhydryl ether hydrochloride, 3-CPMT, SL-6057, WY 2149, SL 6057, 1-alpha-H,5-alpha-H-Tropane, 3-alpha-((p-chloro-alpha-phenylbenzyl)oxy)-, hydrochloride, 3-alpha-((p-Chloro-alpha-phenylbenzyl)oxy)-1-alpha-H,5-alpha-H-tropane hydrochloride, CHEMBL540034, 14008-79-8, 4'-Chloro-3-alpha-(diphenylmethoxy)tropane hydrochloride, SCHEMBL466951, AC1L49W9, CTK8F5025, FXKCQWIUITUJFU-UHFFFAOYSA-N, MolPort-003-940-668, AKOS024458694, NCGC00093782-01, LS-157770, C-207, EU-0100344, SR-01000075361, SR-01000597868, J-007352, SR-01000075361-1, SR-01000597868-1, 3?-[(4-Chlorophenyl)phenylmethoxy] tropane hydrochloride, 3-[(4-chlorophenyl)-phenylmethoxy]-8-methyl-8-azabicyclo[3.2.1]octane hydrochloride


ID: 659

chemical graph of compound 659



InChIKey: FXNFHKRTJBSTCS-UHFFFAOYSA-N
SMILES: C1=CC=C(C=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:

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


CID is 5281605
synonyms found at PubChem are:
baicalein, 491-67-8, 5,6,7-Trihydroxyflavone, 5,6,7-trihydroxy-2-phenyl-4H-chromen-4-one, Noroxylin, Biacalein, BaiKalein, Baicelein, UNII-49QAH60606, NSC661431, NSC 661431, CHEMBL8260, 5,6,7-trihydroxy-2-phenylchromen-4-one, CHEBI:2979, FXNFHKRTJBSTCS-UHFFFAOYSA-N, IN1408, 4H-1-Benzopyran-4-one, 5,6,7-trihydroxy-2-phenyl-, 49QAH60606, 5,7-Trihydroxyflavone, 5,6,7-trihydroxy-2-phenyl-chromen-4-one, 4H-1-Benzopyran-4-one,5,6,7-trihydroxy-2-phenyl-, Sho-saiko-to, 27462-75-5, SMR000112462, SR-01000597499, Baicalein, 8, Baicalein,(S), 3WL, Baicalein, 14, Baicalein, 98%, AC1NQYPP, Spectrum_000427, Tocris-1761, SpecPlus_000758, Spectrum2_000466, Spectrum3_001608, Spectrum4_000537, Spectrum5_001418, D00YEV, Oprea1_765614, BSPBio_003215, KBioGR_001173, KBioSS_000907, MLS002473007, MLS006011756, BIDD:ER0121, DivK1c_006854, SCHEMBL139617, SPECTRUM1504002, 5,6,7-Trihydroxy-2-phenyl-4H-1-benzopyran-4-one, SPBio_000572, GTPL5144, DTXSID2022389, KBio1_001798, KBio2_000907, KBio2_003475, KBio2_006043, KBio3_002435, MolPort-001-741-408, HMS1922O22, HMS2267F15, HMS3268C22, HMS3649O19, HMS3655P18, ALBB-028286, BCP14393, HY-N0196, TNP00121, ZINC3871633, BBL027840, BDBM50009001, CCG-38705, IN2067, LMPK12111095, MFCD00017459, NSC729192, s2268, SBB067246, STL146746, AKOS005747014, AC-7991, AN-8474, CS-6159, MCULE-8669340472, NSC-661431, NSC-729192, SDCCGMLS-0066744.P001, Baicalein, analytical reference material, SMP1_000037, NCGC00017236-01, NCGC00017236-02, NCGC00017236-03, NCGC00017236-04, NCGC00017236-05, NCGC00017236-06, NCGC00017236-07, NCGC00017236-08, NCGC00017236-10, NCGC00025282-01, NCGC00025282-02, NCGC00025282-03, NCGC00025282-04, NCGC00178204-01, KB-47494, LS-39842, SC-04798, SC-20654, ST057152, 5,6,7-Trihydroxy-2-phenyl-chroman-4-one, AB0018364, FT-0622548, N1858, Baicalein, disposable screening library format, C10023, S00113, W-2736, 491B678, 5,7-Trihydroxy-2-phenyl-4H-1-benzopyran-4-one, Q-100550, SR-01000597499-1, SR-01000597499-3, SR-01000597499-4, SR-01000597499-6, W-202870, 5,6,7-Trihydroxy-2-phenyl-(4H)-1-benzopyran-4-one, BRD-K72327355-001-02-2, BRD-K72327355-001-06-3


ID: 660

chemical graph of compound 660



InChIKey: FXUAIOOAOAVCGD-WCTZXXKLSA-N
SMILES: C1C[C@H]([C@@H]2[C@@H]([C@@H](CN2C1)O)O)O

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 51683
synonyms found at PubChem are:
swainsonine, Tridolgosir, 72741-87-8, (-)-Swainsonine, Tridolgosir [INN], UNII-RSY4RK37KQ, RSY4RK37KQ, CHEBI:9367, CHEMBL371197, FXUAIOOAOAVCGD-WCTZXXKLSA-N, (1S,2R,8R,8aR)-Octahydro-1,2,8-indolizinetriol, 1S-8AB-OCTAHYDRO-INDOLIZIDINE-1A,2A,8B-TRIOL, NCGC00163481-02, (1S,2R,8R,8aR)-octahydroindolizine-1,2,8-triol, (1S,2R,8R,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizine-1,2,8-triol, 1,2,8-Indolizinetriol, octahydro-, (1S-(1alpha,2alpha,8beta,8abeta))-, SWA, Swainosine, Locoweed deriv., NSC614553, 1hww, Octahydro-1,2,8-indolizinetriol hydrochloride, AC1L1BJG, (1S,2R,8R,8aR)-1,2,8-Octahydroindolizidinetriol, AC1Q1GU1, DSSTox_CID_26356, DSSTox_RID_81558, CBiol_001919, DSSTox_GSID_46356, BSPBio_001148, KBioGR_000488, KBioSS_000488, SCHEMBL765848, DTXSID5046356, KBio2_000488, KBio2_003056, KBio2_005624, KBio3_000895, KBio3_000896, MolPort-003-850-377, Bio1_000205, Bio1_000694, Bio1_001183, Bio2_000414, Bio2_000894, HMS1362J09, HMS1792J09, HMS1990J09, HMS3403J09, ZINC3875041, Tox21_112058, 2057AH, BDBM50168995, MFCD00017554, (1S,2R,8aR)-Octahydroindolizinetriol, AKOS016344385, CCG-208274, DB02034, NSC-614553, IDI1_002169, SMP1_000286, NCGC00163481-03, NCGC00163481-04, LS-83623, CAS-72741-87-8, B7316, BB 0261154, FT-0630815, C10173, (1S, 2R, 8R, 8AR)-1,2,8-Indolizidinetriol, 8|A,|A-Octahydroindolizidine-1|A,2|A,8|A-triol, SR-05000002325, SR-05000002325-2, (1S,2R,8R,8aR)-Octahydro-indolizine-1,2,8-triol, 1,8-Indolizinetriol, octahydro-, (1S,2R,8R,8aR)-, 1,2,8-Indolizinetriol,octahydro-, (1S,2R,8R,8aR)-, CFCE4066-9132-492F-B4E1-B50B974FE148, 1,2,8-Indolizinetriol, octahydro-, (1S-(1-alpha,2-alpha,8-beta,8a-beta))-, 1,8-Indolizinetriol, octahydro-,[1S-(1.alpha.,2.alpha., 8.beta.,8a.beta.)]-, SWS


ID: 661

chemical graph of compound 661



InChIKey: FXYZDFSNBBOHTA-UHFFFAOYSA-N
SMILES: C1COCCN1C(=N)N=C(N)N.Cl

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 76621
synonyms found at PubChem are:
Moroxydine hydrochloride, 3160-91-6, Moroxydine HCl, Flumidin, Virustat, Influcol, Spenitol, Virusmin, ABOB hydrochloride, Flumadon, N-Carbamimidoylmorpholine-4-carboximidamide hydrochloride, Moroxidine hydrochloride, Flumidin (VAN), Morpholinobiguanide hydrochloride, Moroxydine (hydrochloride), Morpholinobiguanide monohydrochloride, UNII-6Y9698W0XT, 4-(Amidinoamidino)morpholine, hydrochloride, EINECS 221-612-6, NSC 43840, NSC 47838, NSC 52355, NSC 63755, NSC 407204, AI3-51320, N-[amino(imino)methyl]morpholine-4-carboximidamide hydrochloride, 6Y9698W0XT, 4-Morpholinecarboxamidine, N-amidino-, monohydrochloride, N1,N1-Anhydrobis(beta-hydroxyethyl)biguanide hydrochloride, Biguanide, 1,1-anhydrobis(beta-hydroxyethyl)-, hydrochloride, 4-Morpholinecarboximidamide, N-(aminoiminomethyl)-, monohydrochloride, N(sup 1),N(sup 1)-Anhydrobis(beta-hydroxyethyl)biguanide hydrochloride, DSSTox_CID_25376, DSSTox_RID_80837, DSSTox_GSID_45376, 1-(morpholine-4-carboximidoyl)guanidine hydrochloride, 3731-59-7 (Parent), assur, SMR000718626, 4-Morpholinecarboxamidine, monohydrochloride, SR-01000841820, NCGC00016623-01, CAS-3160-91-6, amino(iminomorpholin-4-ylmethyl)carboxamidine, chloride, N-carbamimidoylmorpholine-4-carboximidamide;hydrochloride, N1,N1-Anhydrobis(.beta.-hydroxyethyl)biguanide hydrochloride, Prestwick_547, EINECS 231-039-3, virustat hydrochloride, N-Amidinomorpholine-4-carboxamidine HCl, Moroxydine,hydrochloride, ACMC-1BCAT, AC1Q3CFW, moroxydine monohydrochloride, C6H14ClN5O, AC1L2RB4, C6H13N5O.HCl, N-Amidinomorpholine-4-carboxamidine hydrochloride, SCHEMBL92735, Moroxydine Hydrochloride,(S), MLS001032033, MLS002154194, Moroxydine hydrochloride, 99%, Morpholinbiguanide Hydrochloride, CHEMBL1874337, DTXSID1045376, SCHEMBL14973476, CTK8C5518, HY-B0420A, FXYZDFSNBBOHTA-UHFFFAOYSA-N, MolPort-002-506-667, MolPort-006-836-134, HMS1568A10, Pharmakon1600-01506078, 1-Morpholinobiguanide Hydrochloride, KS-00000GO9, NSC43840, NSC47838, NSC52355, NSC63755, Tox21_110532, NSC-43840, NSC-47838, NSC-52355, NSC-63755, NSC407204, NSC759315, s2486, SBB009855, AKOS005256937, Tox21_110532_1, API0000667, CCG-213951, CS-2526, GL-0672, NSC-407204, NSC-759315, TRA0011334, VA11325, VA11326, KS-00001P37, NCGC00016623-05, 7420-18-0, AC-14457, AK162412, AS-13339, H933, LS-92555, SC-13975, SC-18646, ST060170, AB0013368, AB1009433, AB2000592, AX8140384, TR-015161, FT-0698221, M2443, ST24048531, EN300-216965, M-2138, 160M916, A823597, J-018491, SR-01000841820-2, SR-01000841820-3, I14-18788, N-(morpholine-4-carboximidoyl)guanidine hydrochloride, N''-(morpholine-4-carboximidoyl)guanidine hydrochloride, Z2160887313, N-(Aminoiminomethyl)-4-morpholinecarboximidamide hydrochloride, N-(diaminomethylidene)-4-morpholinecarboximidamide hydrochloride, N-(diaminomethylidene)morpholine-4-carboximidamide hydrochloride, 4-Morpholinecarboximidamide, N-(aminoiminomethyl)-,monohydrochloride, N-[bis(azanyl)methylidene]morpholine-4-carboximidamide hydrochloride, 4-Morpholinecarboximidamide, N-(aminoiminomethyl)-, monohydrochloride (9CI), 1195550-67-4, 8058-46-6, MolPort-000-745-489, MCULE-6852238035, AKOS015917943, I14-8679


ID: 662

chemical graph of compound 662



InChIKey: FYBXRCFPOTXTJF-UHFFFAOYSA-N
SMILES: CC(C)(C)NCC(COC1=CC=CC2=C1CCC(=O)N2)O.Cl

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 40127
synonyms found at PubChem are:
carteolol hydrochloride, 51781-21-6, Carteolol HCl, Arteoptic, Mikelan, Abbott-43326, Cartrol, Endak, Endak hydrochloride, Ocupress, Carbonolol, Endak mite, Abbott 43326, OPC-1085, Teoptic, Carteolol (hydrochloride), OPC 1085, EINECS 257-415-7, dl-Carteolol Hydrochloride, NSC 300906, Ocupress (TN), Cartrol (TN), 5-(2-Hydroxy-3-tert-butylamino)propoxy-3,4-dihydrocarbostyril hydrochloride, 5-(3-tert-Butylamino-2-hydroxy)propoxy-3,4-dihydrocarbostyril hydrochloride, 5-(3-((1,1-Dimethylethyl)amino)-2-hydroxypropoxy)-3,4-dihydro-2(1H)-quinolinone hydrochloride, 5-(3-(tert-Butylamino)-2-hydroxypropoxy)-3,4-dihydrocarbostyril monohydrochloride, 5-(3-tert-Butylamino-2-hydroxy-propoxy)-3,4-dihydro-2(1H)-chinolinon-hydrochlorid [German], DSSTox_CID_25478, DSSTox_RID_80904, DSSTox_GSID_45478, CHEBI:3438, 5-(3-((tert-Butyl)amino)-2-hydroxypropoxy)-3,4-dihydro-2-quinolone monohydrochloride, 2(1H)-Quinolinone, 5-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)-3,4-dihydro-, monohydrochloride, 2(1H)-Quinolinone, 5-[3-[(1,1-dimethylethyl)amino]-2-hydroxypropoxy]-3,4-dihydro-, monohydrochloride, 5-[3-[(1,1-Dimethylethyl)amino]-2-hydroxypropoxy]-3,4-dihydro-2(1H)-quinolinone Hydrochloride, 5-(3-tert-Butylamino-2-hydroxy-propoxy)-3,4-dihydro-2(1H)-chinolinon-hydrochlorid, Arteolol, Carteol, Mikelan LA, 5-[3-(tert-Butylamino)-2-hydroxypropoxy]-3,4-dihydrocarbostyril monohydrochloride, Carteolol hydrochloride [USAN:JAN], Carteolol hydrochloride [USAN:USP:JAN], 5-(3-(tert-Butylamino)-2-hydroxypropoxy)-3,4-dihydroquinolin-2(1H)-one hydrochloride, Carteolol(hydrochloride), NCGC00016865-01, CAS-51781-21-6, SCHEMBL41380, MLS002153816, C16H24N2O3.HCl, Carteolol Hydrochloride ,(S), (+/-)-Carteolol Hydrochloride, CHEMBL1201002, DTXSID4045478, CTK8F8480, MolPort-006-129-555, HMS1569I14, Pharmakon1600-01505519, 51781-06-7 (Parent), AC1L2343, BCP28338, EX-A1257, KS-00001D9M, Tox21_110654, Carteolol hydrochloride (JP17/USP), HY-17495A, NSC300906, NSC760060, s4278, AKOS027379166, Tox21_110654_1, CCG-213475, CS-2955, NSC-300906, NSC-760060, NCGC00179541-03, CC-05270, SMR001233186, LS-142780, B5944, FT-0640026, D00599, WLN: T66 BMVT&J GO1YQ1MX1&1&1 &GH, C-35682, SR-01000841202, SR-01000841202-2, 5-(3-t-butylamino-2-hydroxypropoxy)-3,4-dihydrocarbostyril hydrochloride, 2(1H)-Quinolinone,1-dimethylethyl)amino]-2-hydroxypropoxy]-3,4-dihydro-, monohydrochloride, 5-[3-(tert-butylamino)-2-hydroxypropoxy]-1,2,3,4-tetrahydroquinolin-2-one hydrochloride, 5-[3-(tert-butylamino)-2-hydroxypropoxy]-3,4-dihydro-1H-quinolin-2-one hydrochloride, 2(1H)-Quinolinone, 5-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)-3,4-dihydro-,monohydrochloride, 2(1H)-Quinolinone, 5-[3-[(1,1-dimethylethyl)amino]-2-hydroxypropoxy]-3,4-dihydro, monohydrochloride, 2(1H)-Quinolinone, 5-[3-[(1,1-dimethylethyl)amino]-2hydroxypropoxy]-3,4-dihydro, monohydrochloride, AKOS026750076, 5-[3-(tert-butylamino)-2-hydroxypropoxy]-3,4-dihydroquinolin-2(1H)-one hydrochloride, N-tert-butyl-2-hydroxy-3-[(2-oxo-1,2,3,4-tetrahydroquinolin-5-yl)oxy]propan-1-aminium chloride


ID: 663

chemical graph of compound 663



InChIKey: FYDVPEVHFUBOJG-UHFFFAOYSA-N
SMILES: C1OC2=C(O1)C=C(C=C2)CC(CO)O

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 97807
synonyms found at PubChem are:
SAFROLGLYCOL, 7154-01-0, 1,2-Propanediol, 3-(1,3-benzodioxol-5-yl)-, 3-(Benzo[d][1,3]dioxol-5-yl)propane-1,2-diol, 3-(1,3-benzodioxol-5-yl)-1,2-propanediol, 3-(3,4-Methylenedioxyphenyl)-1,2-propanediol, 3-(2H-1,3-benzodioxol-5-yl)propane-1,2-diol, (+)-3-(3,4-Methylenedioxyphenyl)-1,2-propanediol, NSC43297, NSC 43297, 2',3'-Dihydro-2',3'-dihydroxysafrole, Spectrum_000901, SpecPlus_000090, AI3-20686, AC1L3ZAL, AC1Q6ZXS, AC1Q7BPP, Spectrum2_000683, Spectrum3_000113, Spectrum4_000935, Spectrum5_001785, BSPBio_001726, KBioGR_001490, KBioSS_001381, SPECTRUM100577, DivK1c_006186, 1,2-Propanediol, 3-(3,4-(methylenedioxy)phenyl)-, SPBio_000805, MEGxp0_001786, CHEMBL1527944, SCHEMBL11447270, ACon1_002342, CHEBI:91667, CTK2H7770, KBio1_001130, KBio2_001381, KBio2_003949, KBio2_006517, KBio3_000866, MolPort-001-742-534, CCG-38575, NSC-43297, 1, 3-(1,3-benzodioxol-5-yl)-, AKOS022184763, WLN: T56 BO DO CHJ G1YQ1Q, MCULE-1341874849, SDCCGMLS-0066370.P001, 1, 3-[3,4-(methylenedioxy)phenyl]-, NCGC00095438-01, NCGC00095438-02, NCGC00095438-03, 4CN-2553, ST24041531, 3-(1,3-benzodioxol-5-yl)propane-1,2-diol, SR-05000002431, SR-05000002431-1, BRD-A37867643-001-01-7


ID: 664

chemical graph of compound 664



InChIKey: FYEHYMARPSSOBO-UHFFFAOYSA-N
SMILES: C1=CC(=O)C=CC1=C(C2=CC=C(C=C2)O)C3=CC=C(C=C3)O

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 5100
synonyms found at PubChem are:
Aurin, rosolic acid, Corallin, 603-45-2, p-Rosolic acid, Aurine, Spirit Aurine, Corallin Spirit Soluble, 4,4'-Dihydroxyfuchsone, Aurin No. 555, C.I. 43800, 4-(Bis(4-hydroxyphenyl)methylene)cyclohexa-2,5-dienone, Pararosolic Acid, UNII-85N4AK3JAU, NSC 7805, 4-[bis(4-hydroxyphenyl)methylene]cyclohexa-2,5-dien-1-one, 85N4AK3JAU, 2,5-Cyclohexadien-1-one, 4-[bis(4-hydroxyphenyl)methylene]-, CHEBI:34544, NSC7805, C19H14O3, 4-[bis(4-hydroxyphenyl)methylidene]cyclohexa-2,5-dien-1-one, CI-43800, 4-[Bis(4-hydroxyphenyl)methylene]-2,5-cyclohexadienone, 2,5-Cyclohexadien-1-one, 4-(bis(4-hydroxyphenyl)methylene)-, SMR001224399, ROSOLICACID, Corallin yellow, p-rosolic acin, EINECS 210-041-8, Rosolic acid 25g, Spectrum_000988, AI3-18245, Spectrum2_000762, Spectrum3_000609, Spectrum4_000904, Spectrum5_001864, AC1L1JM0, AC1Q69YI, Corallin yellow (Salt/Mix), p-Rosolic acid, 85.0%, BSPBio_002118, CORALLIN (FREE ACID), KBioGR_001368, KBioSS_001468, MLS001359834, MLS002695900, BIDD:ER0176, DivK1c_000400, SCHEMBL590856, SPECTRUM1500762, SPBio_000804, CHEMBL210868, DTXSID2022387, HMS501D22, KBio1_000400, KBio2_001468, KBio2_004036, KBio2_006604, KBio3_001618, FYEHYMARPSSOBO-UHFFFAOYSA-N, MolPort-003-666-326, NINDS_000400, 4-[Bis(4-hydroxyphenyl)methylene]-2,5-cyclohexadien-1-one, HMS1923K11, HMS3058N04, p-Rosolic acid, JIS special grade, KS-00000X6Y, NSC-7805, ZINC3874879, p-Rosolic acid (C.I. 43800), p-Rosolic acid, Dye content 85 %, BDBM50427512, CCG-39006, MFCD00001624, SBB058277, STL453788, AKOS015903417, MCULE-1450942647, 2, 4-[bis(p-hydroxyphenyl)methylene]-, IDI1_000400, SMP1_000134, 2, 4-[bis(4-hydroxyphenyl)methylene]-, NCGC00095266-01, NCGC00095266-02, NCGC00095266-03, AJ-46406, AN-21594, NCI60_041721, ST080685, Aurin (p-Rosolic acid) (C.I. 43800), TR-031574, A0598, ST24043040, A-8703, C14213, BRD-K24453427-001-02-9, BRD-K24453427-001-04-5, I14-19309, 4-(Bis(p-hydroxyphenyl)methylene)cyclohexa-2,5-dien-1-one, 2,5-Cyclohexadien-1-one, 4-(bis(p-hydroxyphenyl)methylene)-, 4-[Bis(4-hydroxyphenyl)methylene]-2,5-cyclohexadien-1-one #, 2,5-Cyclohexadien-1-one, 4-(bis(p-hydroxyphenyl)methylene)- (8CI)


ID: 665

chemical graph of compound 665



InChIKey: FYEMNIIBXSJOLP-UHFFFAOYSA-N
SMILES: CC(C)NNC(=O)C1=CC=NC=C1.OS(=O)(=O)O

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 5702132
synonyms found at PubChem are:
IPRONIAZID SULFATE, NCGC00094820-01, DSSTox_CID_25852, DSSTox_RID_81174, DSSTox_GSID_45852, CAS-36504-56-0, AC1NWAR7, SPECTRUM1500634, CHEMBL1534878, DTXSID8045852, SCHEMBL15200763, HMS500G03, HMS1921M11, Pharmakon1600-01500634, Tox21_111341, CCG-39720, NSC757380, Tox21_111341_1, NSC-757380, NCGC00015565-06, NCGC00094820-02, NCGC00094820-03, SR-01000075585-6, N'-propan-2-ylpyridine-4-carbohydrazide; sulfuric acid, 36504-56-0


ID: 666

chemical graph of compound 666



InChIKey: FYPMFJGVHOHGLL-UHFFFAOYSA-N
SMILES: CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SC(C)(C)SC2=CC(=C(C(=C2)C(C)(C)C)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:

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


CID is 4912
synonyms found at PubChem are:
probucol, Lorelco, 23288-49-5, Biphenabid, Bisphenabid, Lurselle, Bisbid, Lesterol, Lursell, Panavir, DH-581, Probucolum, Sinlestal, Probucolum [INN-Latin], DH 581, Superlipid, Acetone bis(3,5-di-tert-butyl-4-hydroxyphenyl) mercaptole, 4,4'-(Isopropylidenedithio)bis(2,6-di-tert-butylphenol), UNII-P3CTH044XJ, NSC 86225, NSC 652160, Acetone, bis(3,5-di-tert-butyl-4-hydroxyphenyl) mercaptole, CCRIS 7510, Probucol [USAN:BAN:INN:JAN], C31H48O2S2, LORELCO (TN), EINECS 245-560-9, CHEMBL608, BRN 2026253, P3CTH044XJ, MLS000028492, CHEBI:8427, FYPMFJGVHOHGLL-UHFFFAOYSA-N, 4,4'-(propane-2,2-diyldisulfanediyl)bis(2,6-di-tert-butylphenol), NSC86225, ZERO/001429, 4,4'-[(1-Methylethylidene)bis(thio)]bis-[2,6-bis(1,1-dimethylethyl)phenol], NSC652160, 2,6-ditert-butyl-4-[2-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanylpropan-2-ylsulfanyl]phenol, DE-3872, 4,4'-(Isopropylidenedithio)bis(2, 6-di-tert-butylphenol), 4,4'-(Isopropylidenedithio)bis[2, 6-di-tert-butylphenol], 4,4'-(Isopropylidenedithio)bis[2,6-di-tert-butylphenol], NCGC00016777-01, Acetone, bis (3,5-di-tert-butyl-4-hydroxyphenyl) mercaptole, SMR000058265, CAS-23288-49-5, 4,4'-(propane-2,2-diylbis(sulfanediyl))bis(2,6-di-tert-butylphenol), Phenol, 4,4'-[(1-methylethylidene)bis(thio)]bis[2,6-bis(1,1-dimethylethyl)-, DSSTox_CID_25440, DSSTox_RID_80881, DSSTox_GSID_45440, 2,6-di-tert-butyl-4-({2-[(3,5-di-tert-butyl-4-hydroxyphenyl)sulfanyl]propan-2-yl}sulfanyl)phenol, W-107409, 4,4'- (Isopropylidenedithio)bis(2,6-di-tert-butylphenol), 4,4'- (Isopropylidenedithio)bis(2, 6-di-tert-butylphenol), 2,6-bis(tert-butyl)-4-{1-[3,5-bis(tert-butyl)-4-hydroxyphenylthio]-isopropylth io}phenol, Phenol, 4,4'-((1-methylethylidene)bis(thio))bis(2,6-bis(1,1-dimethylethyl)-, SR-01000695447, phenbutol, Serterol, DH581, Probucol,(S), Prestwick_408, Probucol [USAN:USP:INN:BAN:JAN], PubChem17621, Spectrum_001296, Opera_ID_1820, Prestwick0_000384, Prestwick1_000384, Prestwick2_000384, Prestwick3_000384, Spectrum2_001400, Spectrum3_001438, Spectrum4_000414, Spectrum5_001343, Aventis Brand of Probucol, Hoechst Brand of Probucol, Almirall Brand of Probucol, D0H2DQ, SCHEMBL4150, Probucol (JAN/USP/INN), BSPBio_000567, BSPBio_003176, KBioGR_000708, KBioGR_002394, KBioSS_001776, KBioSS_002399, Probucol, analytical standard, DivK1c_000599, SPECTRUM1501109, Probucol (JP17/USP/INN), SPBio_001420, SPBio_002488, AC1L1J88, BPBio1_000625, GTPL7277, DTXSID2045440, CTK8G2582, HMS501N21, KBio1_000599, KBio2_001776, KBio2_002394, KBio2_004344, KBio2_004962, KBio2_006912, KBio2_007530, KBio3_002396, KBio3_002873, KS-00000XMC, cMAP_000039, MolPort-002-042-265, NINDS_000599, HMS1569M09, HMS1921D21, HMS2092D05, HMS2096M09, HMS2233C08, HMS3655P19, HMS3713M09, Pharmakon1600-01501109, BCP06487, HY-B0388, ZINC1530755, Tox21_110605, BDBM50007260, BG0666, CCG-38986, MFCD00079281, NSC-86225, NSC757837, s2119, SBB001675, STK762566, AKOS001740866, Tox21_110605_1, API0003932, CS-2473, DB01599, KS-1459, MCULE-4445301513, NSC-652160, NSC-757837, IDI1_000599, Phenol, 4,4'-((1-methylethylidene)bis(thio))bis(2,6-bis(1,1-dimethylethyl))-, NCGC00016777-02, NCGC00016777-03, NCGC00016777-04, NCGC00016777-05, NCGC00016777-07, NCGC00016777-08, NCGC00094895-01, NCGC00094895-02, NCGC00094895-03, NCGC00094895-04, CC-33926, CJ-24018, LS-13188, SC-47042, ST075698, SBI-0051640.P002, AB2000521, AB00052202, FT-0630498, P2002, C07373, D00476, S-8042, AB00052202_14, AB00052202_15, 288P495, C-23041, Acetone,5-di-tert-butyl-4-hydroxyphenyl) mercaptole, SR-01000695447-2, SR-01000695447-3, BRD-K72029282-001-04-8, BRD-K72029282-001-15-4, I14-31835, Acetone bis(3,5-di-t-butyl-4-hydroxyphenyl) mercaptole, Z1551900339, Probucol, United States Pharmacopeia (USP) Reference Standard, Phenol,4'-[(1-methylethylidene)bis(thio)]bis[2,6-bis(1,1-dimethylethyl)-, 2,6-di-tert-butyl-4-(2-(3,5-di-tert-butyl-4-hydroxyphenylthio)propan-2-ylthio)phenol, 4,4'-[(1-methylethylidene)bis(thio)]bis[2,6-bis(1,1-dimethylethyl)phenol], 2,6-di(tert-butyl)-4-[(1-{[3,5-di(tert-butyl)-4-hydroxyphenyl]sulfanyl}-1-methylethyl)sulfanyl]phenol, 2,6-di(tert-butyl)-4-{1-[3,5-di(tert-butyl)-4-hydroxyphenylsulfanyl]-1-methylethylsulfanyl}phenol, 2,6-di(tert-butyl)-4-{1-[3,5-di(tert-butyl)-4-hydroxyphenylsulfanyl]-1-methylethylsulfanyl}phenol(probucol), 2,6-Di-tert-butyl-4-[1-(3,5-di-tert-butyl-4-hydroxy-phenylsulfanyl)-1-methyl-ethylsulfanyl]-phenol, 2,6-Ditert-butyl-4-((1-[(3,5-ditert-butyl-4-hydroxyphenyl)sulfanyl]-1-methylethyl)sulfanyl)phenol #, 2,6-ditert-butyl-4-[1-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanyl-1-methyl-ethyl]sulfanyl-phenol


ID: 667

chemical graph of compound 667



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

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 904
synonyms found at PubChem are:
acetanilide, N-Phenylacetamide, 103-84-4, Acetanil, Acetamidobenzene, Antifebrin, Acetylaniline, Acetanilid, N-Acetylaniline, Acetamide, N-phenyl-, Acetic acid anilide, Acetoanilide, Phenalgene, Acetylaminobenzene, Phenalgin, Aniline, N-acetyl-, N-acetylarylamine, Benzenamine, N-acetyl-, USAF EK-3, NSC 7636, AN [Analgesic], Caswell No. 003E, Ethananilide, UNII-SP86R356CC, N-Phenyl-acetamide, N-Acetylaminobenzene, Acetic acid amide, N-phenyl-, CCRIS 4452, HSDB 2665, Acetanilide (Antifebrin), EINECS 203-150-7, C8H9NO, AI3-01045, SP86R356CC, CHEBI:28884, NSC7636, FZERHIULMFGESH-UHFFFAOYSA-N, N-Phenylacetamide;N-Phenylacetamide, NCGC00091326-01, DSSTox_CID_2543, DSSTox_RID_76620, DSSTox_GSID_22543, N-Phenylacetamide (Acetanilide), Acetamide, N-(phenyl-d5)-, n-phenylacetamid, Acetanilide [NF], CAS-103-84-4, SMR001306799, PhNHAc, N-phenyl acetamide, Acetanilide, 99%, Spectrum_000178, AC1L1AAE, Spectrum2_001434, Spectrum3_000935, Spectrum4_001034, Spectrum5_000989, WLN: 1VMR, ACMC-1AR90, Ethanimidic acid, N-phenyl-, SCHEMBL24681, KBioGR_001587, KBioSS_000658, Acetanilide, 98% 100g, KSC492K1L, MLS002207284, MLS002415707, DivK1c_000073, SPECTRUM1501173, SPBio_001568, AC1Q5N69, ARONIS003513, CHEMBL269644, DTXSID2022543, SCHEMBL14255226, Acetanilide, LR, >=98.5%, CTK3B8627, CTK3J2515, HMS500D15, KBio1_000073, KBio2_000658, KBio2_003226, KBio2_005794, KBio3_001970, KS-00003WHS, MolPort-000-564-428, NINDS_000073, ACETANILIDE (RING-13C6), ACETIC ACID,AMIDE,N-PHENYL, BCPP000440, HMS1921N07, HMS2092J11, HMS2234E18, HMS3374L04, HMS3651D07, Pharmakon1600-01501173, ZINC142824, BCP02363, NSC-7636, Tox21_111113, Tox21_200925, ANW-74570, CCG-38984, LS-366, MFCD00008674, NSC757879, s2538, SBB040833, STK046402, AKOS000121114, AKOS030596060, Tox21_111113_1, BCP9000226, MCULE-1268638727, NE10600, NSC-757879, RTR-000889, TRA0025008, Acetanilide, NIST(R) SRM(R) 141d, IDI1_000073, KS-00000W21, NCGC00091326-02, NCGC00091326-03, NCGC00091326-04, NCGC00091326-06, NCGC00258479-01, 55576-55-1, AJ-12477, AN-24658, AS-13389, CJ-01073, I054, SC-78966, ST040202, ZB004945, SBI-0051673.P002, AB2000635, KB-259064, KB-294800, ST2419721, TR-000889, 795-EP2269979A1, 795-EP2277880A1, 795-EP2288595A2, 795-EP2292610A1, 795-EP2296664A1, 795-EP2298729A1, 795-EP2308872A1, 795-EP2316829A1, B2071, CS-0010112, FT-0621730, FT-0621731, 1947-EP2275407A1, 1947-EP2298752A1, 1947-EP2301918A1, C07565, AB00052235_07, AB00052235_08, Acetanilide, purified by sublimation, >=99.9%, Acetanilide, puriss. p.a., >=99.5% (CHN), AH-034/32461060, SR-05000001777, I01-2061, Q-200578, SR-05000001777-1, BRD-K11094367-001-04-4, F0808-0907, Acetanilide, zone-refined, purified by sublimation, >=99.95%, Acetaminophen Related Compound D, United States Pharmacopeia (USP) Reference Standard, Acetanilide Melting Point Standard, United States Pharmacopeia (USP) Reference Standard, InChI=1/C8H9NO/c1-7(10)9-8-5-3-2-4-6-8/h2-6H,1H3,(H,9,10, N-phenylacetamide;Acetanil;Acetamidobenzene;Acetylaniline;NSC 7636;Antifebrin, 88070-49-9, Acetanilide (Acetaminophen Related Compound D), Pharmaceutical Secondary Standard; Certified Reference Material, Acetanilide melting point standard, Pharmaceutical Secondary Standard; Certified Reference Material


ID: 668

chemical graph of compound 668



InChIKey: FZHKNEWQWRWDJI-UHFFFAOYSA-N
SMILES: CC1=C(N=CC=C1)NC2=NC(=CS2)C3=CC(=C(C=C3)OC)C

biological descriptors:

CFTR relevance: CFTR corrector

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

reference list:

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


CID is 4416391
synonyms found at PubChem are:
AC1N9U4M, Oprea1_174232, SCHEMBL838280, MolPort-008-345-333, ZINC6391717, STK947466, AKOS005641136, MCULE-1699686726, EU-0013908, 4-(4-methoxy-3-methylphenyl)-N-(3-methylpyridin-2-yl)thiazol-2-amine, [4-(4-Methoxy-3-methyl-phenyl)-thiazol-2-yl]-(3-methyl-pyridin-2-yl)-amine, 4-(4-methoxy-3-methylphenyl)-N-(3-methylpyridin-2-yl)-1,3-thiazol-2-amine, N-[4-(4-methoxy-3-methylphenyl)-1,3-thiazol-2-yl]-3-methylpyridin-2-amine


ID: 669

chemical graph of compound 669



InChIKey: GAAKALASJNGQKD-UHFFFAOYSA-N
SMILES: C1CN(CCN1CCC2=CC=C(C=C2)N)C3=CC=CC(=C3)C(F)(F)F

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 121930
synonyms found at PubChem are:
PAPP, p-NH2-PE-Tfmpp, LY-165163, LY-165,163, UNII-8HAJ699EWG, 1814-64-8, LY 165163, 8HAJ699EWG, 4-[2-[4-[3-(Trifluoromethyl)phenyl]piperazin-1-yl]ethyl]aniline, 1-(2-(4-Aminophenyl)ethyl)-4-(3-trifluoromethylphenyl)piperazine, 4-(2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)aniline, LY 165,163, p-Aminophenethyl-m-trifluoromethylphenyl piperazine, 4-[2-[4-[3-(Trifluoromethyl)phenyl]-1-piperazinyl]ethyl]benzeneamine, Benzenamine, 4-(2-(4-(3-(trifluoromethyl)phenyl)-1-piperazinyl)ethyl)-, NSC628235, C19H22F3N3, Lopac-S-009, Biomol-NT_000160, D0T4PS, GTPL18, AC1L3TO7, AC1Q4K3D, Lopac0_001132, MLS000859974, LY-165,163, solid, BPBio1_000375, SCHEMBL3976547, CHEMBL1256693, CHEBI:92250, CTK8D5097, DTXSID30171136, HMS2232I03, HMS3263D05, HMS3369D03, ZINC1619831, Tox21_501132, MFCD00055098, AKOS030547154, CCG-205206, LP01132, NCGC00015907-01, NCGC00015907-02, NCGC00015907-03, NCGC00015907-04, NCGC00015907-05, NCGC00094399-01, NCGC00094399-02, NCGC00094399-03, NCGC00261817-01, NCI60_009079, SMR000326833, LS-173712, EU-0101132, S-009, SR-01000075576, J-011585, SR-01000075576-1, BRD-K14282469-001-01-5, PAPP (LY-165,163) SELECTIVE 5-HT1A SERO, LY-165,163; p-Aminophenethyl-m-trifluoromethylphenyl piperazine


ID: 670

chemical graph of compound 670



InChIKey: GAAOKTBHSXYRNH-UHFFFAOYSA-N
SMILES: CCN(CCCl)CC1=CC=CC=C1C.Cl

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 42604
synonyms found at PubChem are:
AC1L2867, 2-chloroethyl-ethyl-[(2-methylphenyl)methyl]azanium chloride, Xylamine hydrochloride, 57913-68-5, n-(2-chloroethyl)-n-ethyl-2-methylbenzylamine hydrochloride, N-(2-Chloroethyl)-N-ethyl-2-methylbenzylamine, N-CHLOROETHYL-N-ETHYL-2'-METHYLBENZYLAMINE HYDROCHLORIDE, CHEMBL1355604, CTK8G3796, DTXSID60587867, CCG-39198, NCGC00094936-01, KB-309386, FT-0746088, C-48816, 2-chloro-N-ethyl-N-(2-methylbenzyl)ethanamine hydrochloride, (2-chloroethyl)(ethyl)[(2-methylphenyl)methyl]amine hydrochloride, 2-Chloro-N-ethyl-N-[(2-methylphenyl)methyl]ethan-1-amine--hydrogen chloride (1/1)


ID: 671

chemical graph of compound 671



InChIKey: GADIKQPUNWAMEB-UHFFFAOYSA-N
SMILES: CCC1=C2C3=CC(=C(C=C3NC2=CN=C1C(=O)OC)OC)OC

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 104999
synonyms found at PubChem are:
DMCM, 82499-00-1, Methyl 6,7-dimethoxy-4-ethyl-beta-carboline-3-carboxylate, UNII-1309288N1J, CHEMBL17468, METHYL-6,7-DIMETHOXY-4-ETHYL-BETA-CARBOLINE-3-CARBOXYLATE, methyl 4-ethyl-6,7-dimethoxy-9H-pyrido[3,4-b]indole-3-carboxylate, 1309288N1J, Methyl 4-ethyl-6,7-dimethoxy-9H-pyrido(3,4-b)indole-3-carboxylate, 4-Ethyl-6,7-dimethoxy-9H-pyrido(3,4-b)indole-3-carboxylic acid, methyl ester, 9H-Pyrido(3,4-b)indole-3-carboxylic acid, 4-ethyl-6,7-dimethoxy-, methyl ester, C17H18N2O4, Lopac-E-007, Biomol-NT_000249, D0GQ1S, AC1L2XV2, AC1Q5ZP9, Lopac0_000543, SCHEMBL472510, BPBio1_001013, GTPL4179, BDBM81951, CHEBI:92263, GADIKQPUNWAMEB-UHFFFAOYSA-N, methyl 4-ethyl-6,7-dimethoxy-9h-|A-carboline-3-carboxylate, ZINC2516023, BDBM50065229, PDSP1_001756, PDSP1_001780, PDSP2_001739, PDSP2_001763, AKOS015897178, CAS_104999, CCG-204633, NSC_104999, KS-0000003O, NCGC00015392-01, NCGC00015392-02, NCGC00015392-03, NCGC00015392-04, NCGC00093931-01, NCGC00093931-02, NCGC00093931-03, LS-133444, E-007, EU-0100543, SR-01000075869, I07-0311, SR-01000075869-1, BRD-K14844937-001-01-6, 4-Ethyl-6,7-dimethoxy-9H-carbazole-3-carboxylic acid methyl ester, 4-Ethyl-6,7-dimethoxy-9H-beta-carboline-3-carboxylic acid methyl ester, 4-Ethyl-6,7-dimethoxy-9H-beta-carboline-3-carboxylic acid methyl ester(DMCM)


ID: 672

chemical graph of compound 672



InChIKey: GAMKNLFIHBMGQT-UHFFFAOYSA-N
SMILES: CCCCCCCCCCCCCCCC(=O)OC(CC(=O)O)C[N+](C)(C)C.[Cl-]

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 363417
synonyms found at PubChem are:
palmitoyl-dl-carnitine chloride, 6865-14-1, (+/-)-Palmitoylcarnitine chloride, MLS002153285, 3-carboxy-n,n,n-trimethyl-2-(palmitoyloxy)propan-1-aminium chloride, Palmitoyl-DL- carnitine chloride, P-1100, P-1105, CHEMBL1256761, NSC628323, SR-01000076069, C23H46NO4.Cl, Palmitoylcarnitine chlorid, DL-Palmitoyl carnitine HCl, Palmityl dl-carnitine chloride, Palmitoyl carnitine hydrochloride, O-Palmitoyl-dl-carnitine chloride, NSC 628323, AC1Q1SGU, AC1L7MO9, BMK1-F9, SCHEMBL515545, PALMITOYL-DL-CARNITINE Cl, MolPort-003-983-794, HMS2232I17, HMS3262N18, HMS3266B11, HMS3370O16, Tox21_500948, 7612AH, BS0142, 3-Carboxy-N,N,N-trimethyl-2-((1-oxohexadecyl)oxy)-1-propanaminium chloride, AKOS024284765, Ammonium, (3-carboxy-2-hydroxypropyl)trimethyl-, chloride, palmitate, (+-)-, CCG-222252, LP00948, MCULE-1423669260, NSC-628323, 1-Propanaminium, 3-carboxy-N,N,N-trimethyl-2-((1-oxohexadecyl)oxy)-, chloride, NCGC00094252-01, NCGC00261633-01, SMR000326758, ST079282, EU-0100948, A-8734, P 4509, SR-01000076069-1, SR-01000076069-3, 3-hexadecanoyloxy-4-(trimethylamino)butanoic acid, chloride, (2-hexadecanoyloxy-4-hydroxy-4-oxobutyl)-trimethylazanium chloride, 1-Propanaminium,3-carboxy-N,N,N-trimethyl-2-[(1-oxohexadecyl)oxy]-,chloride(1:1), 127719-10-2, 52234-80-7, 6819-24-5, 68960-79-2


ID: 673

chemical graph of compound 673



InChIKey: GAPWCQHXCIXKLV-WXPPGMDDSA-N
SMILES: CC1=C2CC=C3[C@](C2=CC(=C1O)O)(CC[C@@]4([C@@]3(CC[C@@]5([C@H]4C[C@](CC5)(C)C(=O)OC)C)C)C)C

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 24861846
synonyms found at PubChem are:
PRISTIMEROL, CHEMBL56163, SCHEMBL12998329, (2R,4aS,6aS,6aS,14aS,14bR)-10,11-dihydroxy-2,4a,6a,6a,9,14a-hexamethyl-3,4,5,6,8,13,14,14b-octahydro-1H-picene-2-carboxylic acid methyl ester


ID: 674

chemical graph of compound 674



InChIKey: GAQAKFHSULJNAK-UHFFFAOYSA-N
SMILES: CCOC(=O)NC1=CC2=C(C=C1)SC3=CC=CC=C3N2C(=O)CCN4CCOCC4.Cl

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 34632
synonyms found at PubChem are:
MORICIZINE HYDROCHLORIDE, Moracizine hydrochloride, Ethmozine, Ethmosine, 29560-58-5, Ethmozin, Etmozin, Moricizine HCl, UNII-71OK3Z1ESP, 71OK3Z1ESP, MLS000830274, Moricizine hydrochloride [USP], EN 313, moracizine HCl, SMR000036736, Ethyl 10-(3-morpholinopropionyl)phenothiazine-2-carbamate hydrochloride, Ethyl 10-(beta-N-morpholinylpropionyl)phenothiazine-2-carbamate hydrochloride, DSSTox_CID_27766, DSSTox_RID_82543, Ethyl ether of 10-(beta-morpholylpropionyl)phenthiazinecarbamino acid hydrochloride, DSSTox_GSID_47786, (10-(3-(4-Morpholinyl)-1-oxopropyl)-10H-phenothiazin-2-yl)carbamic acid, ethyl ester, monohydrochloride, Moricizine hydrochloride (USP), Ethyl 10-(3-morpholinopropionyl)phenothiazine-2-carbamate, hydrochloride, Phenothiazine-2-carbamic acid, 10-(3-morpholinopropionyl)-, ethyl ester, hydrochloride, CHEBI:60937, Carbamic acid, (10-(3-(4-morpholinyl)-1-oxopropyl)-10H-phenothiazin-2-yl)-, ethyl ester, monohydrochloride, Carbamic acid, (10-(3-(4-morpholinyl)-l-oxopropyl)-10H-phenothiazin-2yl)-, ethyl ester, hydrochloride, CAS-29560-58-5, NCGC00016809-01, NCGC00016809-07, Ethmozine (TN), Opera_ID_267, AC1Q3EDS, AC1L1RZ0, Cambridge id 5229972, SCHEMBL41358, MLS000080120, REGID_for_CID_34632, CHEMBL1200334, DTXSID1047786, GAQAKFHSULJNAK-UHFFFAOYSA-N, MolPort-000-917-706, HMS1571C04, ethyl 10-(3-morpholinopropanoyl)-, Tox21_110622, AKOS030506898, Tox21_110622_1, API0003427, CCG-221051, VA11324, ACM29560585, NCGC00180924-01, CC-31001, LS-105268, E-313, E-350, FT-0630550, D02087, SR-01000614327, SR-01000614327-4, ethyl N-[10-(3-morpholin-4-ylpropanoyl)phenothiazin-2-yl]carbamate hydrochloride, ethyl-[10-(3-morpholin-4-ylpropanoyl)-10h-phenothiazin-2-yl]carbamathydrochlorid, Carbamic acid, N-(10-(3-(4-morpholinyl)-1-oxopropyl)-10H-phenothiazin-2-yl)-, ethyl ester, hydrochloride (1:1), AC1LCXWF, ethyl N-[10-(3-morpholin-4-ylpropanoyl)phenothiazin-2-yl]carbamate; hydron; chloride, MolPort-000-704-120, AKOS024357574, MCULE-2107794795, ST50985948, ethoxy-N-[10-(3-morpholin-4-ylpropanoyl)phenothiazin-2-yl]carboxamide, chlorid e, ethyl {10-[3-(morpholin-4-yl)propanoyl]-10HH-phenothiazin-2-yl}carbamate hydrochloride, 4-(3-{2-[(ethoxycarbonyl)amino]-10H-phenothiazin-10-yl}-3-oxopropyl)morpholin-4-ium chloride


ID: 675

chemical graph of compound 675



InChIKey: GBABOYUKABKIAF-UHFFFAOYSA-N
SMILES: CCC1=CC2CC(C3=C(CN(C2)C1)C4=CC=CC=C4N3)(C5=C(C=C6C(=C5)C78CCN9C7C(C=CC9)(C(C(C8N6C)(C(=O)OC)O)OC(=O)C)CC)OC)C(=O)OC

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 5672
synonyms found at PubChem are:
Vinorelbine base, 71486-22-1, AC1L1KVK, CHEBI:93786, CTK8G3751, STL450984, AKOS030228758, AN-6508, I06-0084, I06-0085, methyl 4-(acetyloxy)-15-[4-ethyl-8-(methoxycarbonyl)-1,3,6,7,8,9-hexahydro-2,6-methanoazecino[4,3-b]indol-8-yl]-3-hydroxy-16-methoxy-1-methyl-6,7-didehydroaspidospermidine-3-carboxylate


ID: 676

chemical graph of compound 676



InChIKey: GBVCHRDRVDOMQV-RTWAWAEBSA-N
SMILES: CC(=CCC1=C(C=CC2=C1O[C@@H]3COC4=CC(=C(C=C4[C@@H]3C2=O)OC)OC)O)C

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 6708539
synonyms found at PubChem are:
Rotenonic acid, KBio2_001127, Spectrum_000647, SpecPlus_000073, AC1O8FCI, Spectrum2_000396, Spectrum3_000195, Spectrum4_001512, Spectrum5_000303, BSPBio_001749, KBioGR_002203, KBioSS_001127, SPECTRUM200851, DivK1c_006169, SCHEMBL752362, SPBio_000611, CHEMBL2181295, CHEBI:92599, KBio1_001113, KBio2_003695, KBio2_006263, KBio3_001249, GBVCHRDRVDOMQV-RTWAWAEBSA-N, CCG-38667, SDCCGMLS-0066410.P001, BRD-K34330170-001-01-8, (6aS,12aS)-9-Hydroxy-2,3-dimethoxy-8-(3-methyl-2-butenyl)-6a,12a-dihydrochromeno[3,4-b]chromen-12(6H)-one, (6aS,12aS)-9-hydroxy-2,3-dimethoxy-8-(3-methylbut-2-enyl)-6a,12a-dihydro-6H-chromeno[3,4-b]chromen-12-one


ID: 677

chemical graph of compound 677



InChIKey: GBWVAAKKEIOROG-UHFFFAOYSA-N
SMILES: CC(C(=O)O)NC(=O)C(CCSC)NC=O

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 4363
synonyms found at PubChem are:
N-formylmethionylalanine, N-Formyl-Met-Ala, KBio2_004238, Spectrum_001190, AC1L1HZV, Spectrum2_001060, Spectrum3_001519, Spectrum4_000055, Spectrum5_001229, BSPBio_003197, KBioGR_000549, KBioSS_001670, MLS002207228, DivK1c_000925, SPBio_001020, SCHEMBL4287202, CHEMBL2130597, CHEBI:91785, HMS502O07, KBio1_000925, KBio2_001670, KBio2_006806, KBio3_002697, DTXSID10274432, NINDS_000925, CCG-40124, IDI1_000925, N-Formyl-Met-Ala, >=95% (HPLC), NCGC00178212-01, SMR001306773, 2-[(2-formamido-4-methylsulfanylbutanoyl)amino]propanoic acid


ID: 678

chemical graph of compound 678



InChIKey: GCZZOZBWAZHCAN-UHFFFAOYSA-N
SMILES: C1=CC=C(C=C1)NC(=S)NC2=NC=CS2

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 1395
synonyms found at PubChem are:
1-phenyl-3-(2-thiazolyl)-2-thiourea, 14901-16-7, Thiourea, N-phenyl-N'-2-thiazolyl-, 1-Phenyl-3-(2-thiazolyl)thiourea, PHENYLTHIAZOLYLTHIOUREA, 1-Phenyl-3-(thiazol-2-yl)thiourea, Urea, 1-phenyl-3-(2-thiazolyl)-2-thio-, MLS000766102, U 14624, 1-phenyl-3-(1,3-thiazol-2-yl)thiourea, Thiourea,N-phenyl-N'-2-thiazolyl-, EINECS 238-970-4, NSC 139257, BRN 0789556, 1-Phenyl-3-thiazol-2-yl-thiourea, NSC139257, NSC-139257, SMR000528602, U-14,624, (phenylamino)(1,3-thiazol-2-ylamino)methane-1-thione, Prestwick_76, AC1LEX1Z, AC1Q7EKW, Lopac-P-4015, Lopac0_000898, cid_719408, SCHEMBL1321656, CHEMBL1256364, CTK4C6008, DTXSID20164153, GCZZOZBWAZHCAN-UHFFFAOYSA-N, MolPort-000-402-219, BDBM114545, HMS2886G14, HMS3262D18, ZINC8553055, Tox21_500898, CCG-53204, SBB015047, AKOS001571131, LP00898, MCULE-5028582889, MS-7715, VZ21625, KS-0000298R, NCGC00015811-01, NCGC00015811-02, NCGC00015811-03, NCGC00015811-04, NCGC00094214-01, NCGC00094214-02, NCGC00261583-01, BAS 00344416, CC-04978, ST072638, N-Phenyl-N'-(1,3-thiazol-2-yl)thiourea, Thiourea, 1-phenyl-3-(2-thiazolyl)-2-, DB-042964, KB-160331, LS-160661, EU-0100898, FT-0637155, N-Phenyl-N'-(1,3-thiazol-2-yl)thiourea #, P 4015, A808834, C-13910, SR-01000076066, U-14624, SR-01000076066-1, SR-01000076066-3


ID: 679

chemical graph of compound 679



InChIKey: GDCXPZPXAWTYJM-LDXVYITESA-N
SMILES: CCN1C=NC2=C1N=C(N=C2NC3=CC(=CC=C3)Cl)N[C@@H]4CCCC[C@@H]4N.Cl

biological descriptors:

CFTR relevance: unspecified

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

reference list:

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


CID is 11957495
synonyms found at PubChem are:
CGP-74514A hydrochloride, N2-(cis-2-Aminocyclohexyl)-N6-(3-chlorophenyl)-9-ethyl-9H-purine-2,6-diamine hydrochloride, CGP-74514A, EU-0100291, SCHEMBL2515986, CHEMBL1256911, Tox21_500291, IN2314, CCG-221595, LP00291, NCGC00093743-01, NCGC00260976-01, C 3353, SR-01000075754, J-003582, SR-01000075754-1, N2-(cis-2-Aminocyclohexyl)-N6-(3-chlorophenyl)-9-ethyl-9H-purine-2,6-diamine hydrochloride; Compound 13


ID: 680

chemical graph of compound 680



InChIKey: GDLBFKVLRPITMI-UHFFFAOYSA-N
SMILES: CC1=NS(=O)(=O)C2=C(N1)C=CC(=C2)Cl

biological descriptors:

CFTR relevance: unspecified

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

reference list: