CFam Chemical Families Database
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You are searching for "CFAMM00431948" in compound.

Total 1 results found.

Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

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CFAM Mol ID CFAMM00431948
Family CFFBM15051 Type-2 angiotensin II receptor and Type-1A angiotensin II receptor ligand SureCN9131686 family
Superfamily CFSID251 Renin Inhibitor Enalkiren Superfamily
Class CFCID176 Class 1526
External ID CHEMBL320336 External Source CHEMBL
PubChem CID 14457647 Functional Category Bioactive
Molecule Name AGN-PC-001HAF
IUPAC Name 1-[6-(hydroxymethyl)-1-[(4-methoxy-3-methylphenyl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl]-2,2-diphenylethanone
Synonyms SureCN10543673;CHEBI:281194;1-[6-(hydroxymethyl)-1-[(4-methoxy-3-methylphenyl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl]-2,2-diphenylethanone
InChi InChI=1S/C30H31N3O3/c1-21-15-22(13-14-28(21)36-2)17-32-20-31-26-18-33(25(19-34)16-27(26)32)30(35)29(23-9-5-3-6-10-23)24-11-7-4-8-12-24/h3-15,20,25,29,34H,16-19H2,1-2H3
InChiKey VGJGIWFFVOTPNK-UHFFFAOYSA-N
Formula C30H31N3O3 Molecular Weight 481.59
Cross Link CHEMBL320336
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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Dr. Chen Yuzong

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


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