CFam Chemical Families Database
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You are searching for "CFAMM00396359" in compound.

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CFAM Mol ID CFAMM00396359
Family CFFBM9540 Type-1 angiotensin II receptor and Type-2 angiotensin II receptor ligand 2-[4-[[6-[(2-methoxyphenyl)methylcarbamoyl]-4-methyl-2-propylbenzimidazol-1-yl]methyl]phenyl]benzoic acid family
Superfamily CFSBM1014 Type-1 angiotensin II receptor and Coagulation factor X Binder Superfamily
Class CFCCD443 Class 1256
External ID CHEMBL377813 External Source CHEMBL
PubChem CID 11845802 Functional Category Bioactive
Molecule Name AGN-PC-00HCT3
IUPAC Name 2-[4-[[5-[acetyl(ethyl)amino]-2-(4-chlorophenyl)phenyl]methoxy]-2-fluorophenyl]-1-cyclohexylbenzimidazole-5-carboxylic acid
Synonyms SureCN14613848;CHEBI:453699;1H-Benzimidazole-5-carboxylic acid, 2-[4-[[4-(acetylethylamino)-4'-chloro[1,1'-biphenyl]-2-yl]methoxy]-2-fluorophenyl]-1-cyclohexyl-;2-[4-[[5-[acetyl(ethyl)amino]-2-(4-chlorophenyl)phenyl]methoxy]-2-fluorophenyl]-1-cyclohexylbenzimidazole-5-carboxylic acid
InChi InChI=1S/C37H35ClFN3O4/c1-3-41(23(2)43)29-14-16-31(24-9-12-27(38)13-10-24)26(19-29)22-46-30-15-17-32(33(39)21-30)36-40-34-20-25(37(44)45)11-18-35(34)42(36)28-7-5-4-6-8-28/h9-21,28H,3-8,22H2,1-2H3,(H,44,45)
InChiKey BZXSEKPYPNQRCD-UHFFFAOYSA-N
Formula C37H35ClFN3O4 Molecular Weight 640.14
Cross Link CHEMBL377813
Structure

Statistics of CFAM Database

 
CFAM currently contains 490,279 molecules in 87,136 families, 34,880 superfamilies and 11,643 classes.
 

How to cite our database

 
C. Zhang, L. Tao, C. Qin, P. Zhang, S.Y. Chen, X. Zeng, F. Xu, Z. Chen, S.Y. Yang and Y.Z. CFam: A Chemical Families Database Based on Iterative Selection of Functional Seeds and Seed-Directed Compound Clustering. Nucl. Acids Res. 43 (D1): D558-D565 (2015) (First published online: November 20, 2014).
 

Last update by

 
2014.08.29
 

 

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Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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