CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00428260" 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.

Search Results

CFAM Mol ID CFAMM00428260
Family CFFBM14398 Type-1A angiotensin II receptor and Type-1B angiotensin II receptor ligand 1-[2-[4-[[5-[2-(benzenesulfinyl)acetyl]-4-methylsulfanyl-2-propylimidazol-1-yl]methyl]phenyl]phenyl]sulfonyl-3-benzylurea family
Superfamily CFSBM6314 Type-1A angiotensin II receptor and Type-1B angiotensin II receptor Binder Superfamily
Class CFCAD395 Class 395
External ID CHEMBL84908 External Source CHEMBL
PubChem CID 44322271 Functional Category Bioactive
Molecule Name AGN-PC-074NH8
IUPAC Name 1-[2-[4-[[5-[2-(benzenesulfinyl)acetyl]-2-ethyl-4-methylsulfanylimidazol-1-yl]methyl]phenyl]phenyl]sulfonyl-3-benzylurea
Synonyms CHEBI:242723;1-[2-[4-[[5-[2-(benzenesulfinyl)acetyl]-2-ethyl-4-methylsulfanylimidazol-1-yl]methyl]phenyl]phenyl]sulfonyl-3-benzylurea
InChi InChI=1S/C35H34N4O5S3/c1-3-32-37-34(45-2)33(30(40)24-46(42)28-14-8-5-9-15-28)39(32)23-26-18-20-27(21-19-26)29-16-10-11-17-31(29)47(43,44)38-35(41)36-22-25-12-6-4-7-13-25/h4-21H,3,22-24H2,1-2H3,(H2,36,38,41)
InChiKey STIORDPFHFJQIX-UHFFFAOYSA-N
Formula C35H34N4O5S3 Molecular Weight 686.86
Cross Link CHEMBL84908
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
 

 

60853 visits since 2014 .........

 



Dr. Chen Yuzong

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


All rights reserved.

   
 
 
Computer-aided Drug Design
about BIDD |  databases |  software |  teaching |  research |  links

 

Department of Computational Science | National University of Singapore | Blk S17, 3 Science Drive 2, Singapore 117543

hdnkeywordtype:MiniFieldStorage('hdnkeywordtype', 'compound'),None, hdnkeywordtype, compound|txtsearch:MiniFieldStorage('txtsearch', 'CFAMM00428260'),None, txtsearch, CFAMM00428260|