CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00137624" 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 CFAMM00137624
Family CFFCD133 Integrin beta-1 Inhibitor R411 Family
Superfamily CFSCD121 Integrin beta-1 Inhibitor R411 Superfamily
Class CFCCD104 Class 917
External ID CHEMBL2332727 External Source CHEMBL
PubChem CID 69715313 Functional Category Bioactive
Molecule Name (2S)-2-[(2,6-dichlorobenzoyl)amino]-3-[4-[1,4-dimethyl-2-oxo-6-(trifluoromethyl)pyridin-3-yl]phenyl]propanoic acid
IUPAC Name (2S)-2-[(2,6-dichlorobenzoyl)amino]-3-[4-[1,4-dimethyl-2-oxo-6-(trifluoromethyl)pyridin-3-yl]phenyl]propanoic acid
Synonyms SureCN6236106
InChi InChI=1S/C24H19Cl2F3N2O4/c1-12-10-18(24(27,28)29)31(2)22(33)19(12)14-8-6-13(7-9-14)11-17(23(34)35)30-21(32)20-15(25)4-3-5-16(20)26/h3-10,17H,11H2,1-2H3,(H,30,32)(H,34,35)/t17-/m0/s1
InChiKey UJSGTHFOHGFQMM-KRWDZBQOSA-N
Formula C24H19Cl2F3N2O4 Molecular Weight 527.32
Cross Link CHEMBL2332727
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
 

 

27526 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', 'CFAMM00137624'),None, txtsearch, CFAMM00137624|