CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00418920" 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 CFAMM00418920
Family CFFBM12912 Peroxisome proliferator-activated receptor delta and Peroxisome proliferator-activated receptor gamma ligand AGN-PC-076BJV family
Superfamily CFSBM5899 Beta-2 adrenergic receptor and Peroxisome proliferator-activated receptor gamma Binder Superfamily
Class CFCBM122 Class 3172
External ID CHEMBL236218 External Source CHEMBL
PubChem CID 44434358 Functional Category Bioactive
Molecule Name AGN-PC-076BJY
IUPAC Name 3-[4-[3-[[(7-bromo-1H-indole-2-carbonyl)amino]methyl]phenoxy]-2-methylphenyl]propanoic acid
Synonyms SureCN4616350;CHEBI:500278;3-[4-[3-[[(7-bromo-1H-indole-2-carbonyl)amino]methyl]phenoxy]-2-methylphenyl]propanoic acid
InChi InChI=1S/C26H23BrN2O4/c1-16-12-21(10-8-18(16)9-11-24(30)31)33-20-6-2-4-17(13-20)15-28-26(32)23-14-19-5-3-7-22(27)25(19)29-23/h2-8,10,12-14,29H,9,11,15H2,1H3,(H,28,32)(H,30,31)
InChiKey UWORFOWXVNUTEY-UHFFFAOYSA-N
Formula C26H23BrN2O4 Molecular Weight 507.38
Cross Link CHEMBL236218
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
 

 

27515 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', 'CFAMM00418920'),None, txtsearch, CFAMM00418920|