CFam Chemical Families Database
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You are searching for "CFAMM00429273" 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 CFAMM00429273
Family CFFBM14608 Type-2 angiotensin II receptor and Type-1A angiotensin II receptor ligand AGN-PC-074NDH family
Superfamily CFSBM6314 Type-1A angiotensin II receptor and Type-1B angiotensin II receptor Binder Superfamily
Class CFCAD395 Class 395
External ID CHEMBL313005 External Source CHEMBL
PubChem CID 44321626 Functional Category Bioactive
Molecule Name AGN-PC-074N2T
IUPAC Name ethyl 2-[2-butyl-5-methylsulfanyl-3-[[4-[2-(propylcarbamoylsulfamoyl)phenyl]phenyl]methyl]imidazol-4-yl]-2-hydroxypropanoate
Synonyms CHEBI:241510;ethyl 2-[2-butyl-5-methylsulfanyl-3-[[4-[2-(propylcarbamoylsulfamoyl)phenyl]phenyl]methyl]imidazol-4-yl]-2-hydroxypropanoate
InChi InChI=1S/C30H40N4O6S2/c1-6-9-14-25-32-27(41-5)26(30(4,37)28(35)40-8-3)34(25)20-21-15-17-22(18-16-21)23-12-10-11-13-24(23)42(38,39)33-29(36)31-19-7-2/h10-13,15-18,37H,6-9,14,19-20H2,1-5H3,(H2,31,33,36)
InChiKey AJAKYPNJLRSACU-UHFFFAOYSA-N
Formula C30H40N4O6S2 Molecular Weight 616.79
Cross Link CHEMBL313005
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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