CFam Chemical Families Database
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You are searching for "CFAMM00306644" 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 CFAMM00306644
Family CFFBM67 Type-1A angiotensin II receptor and Type-1B angiotensin II receptor ligand AGN-PC-074SGU family
Superfamily CFSBM10 Type-2 angiotensin II receptor and Type-1 angiotensin II receptor Binder Superfamily
Class CFCAD395 Class 395
External ID CHEMBL431592 External Source CHEMBL
PubChem CID 44322967 Functional Category Bioactive
Molecule Name AGN-PC-074NWV
IUPAC Name propan-2-yl 2-[3-[[4-[2-(butoxycarbonylsulfamoyl)phenyl]phenyl]methyl]-2-butyl-4-oxoimidazo[4,5-c]pyridin-5-yl]-2-phenylacetate
Synonyms CHEBI:244379;propan-2-yl 2-[3-[[4-[2-(butoxycarbonylsulfamoyl)phenyl]phenyl]methyl]-2-butyl-4-oxoimidazo[4,5-c]pyridin-5-yl]-2-phenylacetate
InChi InChI=1S/C39H44N4O7S/c1-5-7-18-34-40-32-23-24-42(35(38(45)50-27(3)4)30-14-10-9-11-15-30)37(44)36(32)43(34)26-28-19-21-29(22-20-28)31-16-12-13-17-33(31)51(47,48)41-39(46)49-25-8-6-2/h9-17,19-24,27,35H,5-8,18,25-26H2,1-4H3,(H,41,46)
InChiKey VNDDUGBRNUTRBI-UHFFFAOYSA-N
Formula C39H44N4O7S Molecular Weight 712.85
Cross Link CHEMBL431592
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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