CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00306633" 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 CFAMM00306633
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 CHEMBL307359 External Source CHEMBL
PubChem CID 44311619 Functional Category Bioactive
Molecule Name AGN-PC-074H3K
IUPAC Name 3-methylbutyl N-[2-[4-[[4-ethyl-5-[(2-phenylsulfanylphenyl)methylcarbamoyl]-2-propylimidazol-1-yl]methyl]-3-fluorophenyl]phenyl]sulfonylcarbamate
Synonyms CHEBI:214277;3-methylbutyl N-[2-[4-[[4-ethyl-5-[(2-phenylsulfanylphenyl)methylcarbamoyl]-2-propylimidazol-1-yl]methyl]-3-fluorophenyl]phenyl]sulfonylcarbamate
InChi InChI=1S/C41H45FN4O5S2/c1-5-14-38-44-35(6-2)39(40(47)43-26-30-15-10-12-19-36(30)52-32-16-8-7-9-17-32)46(38)27-31-22-21-29(25-34(31)42)33-18-11-13-20-37(33)53(49,50)45-41(48)51-24-23-28(3)4/h7-13,15-22,25,28H,5-6,14,23-24,26-27H2,1-4H3,(H,43,47)(H,45,48)
InChiKey XIENNQKFBNHYTB-UHFFFAOYSA-N
Formula C41H45FN4O5S2 Molecular Weight 756.95
Cross Link CHEMBL307359
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
 

 

60877 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', 'CFAMM00306633'),None, txtsearch, CFAMM00306633|