CFam Chemical Families Database
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You are searching for "CFAMM00137637" in compound.

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CFAM Mol ID CFAMM00137637
Family CFFCD133 Integrin beta-1 Inhibitor R411 Family
Superfamily CFSCD121 Integrin beta-1 Inhibitor R411 Superfamily
Class CFCCD104 Class 917
External ID CHEMBL359603 External Source CHEMBL
PubChem CID 9916018 Functional Category Bioactive
Molecule Name SureCN5092081
IUPAC Name 3-[4-[(2,6-dichlorobenzoyl)amino]phenyl]-2-[3-[2,2-dimethylpropanoyl(2-methylpropyl)amino]phenyl]propanoic acid
Synonyms CHEBI:405017
InChi InChI=1S/C31H34Cl2N2O4/c1-19(2)18-35(30(39)31(3,4)5)23-9-6-8-21(17-23)24(29(37)38)16-20-12-14-22(15-13-20)34-28(36)27-25(32)10-7-11-26(27)33/h6-15,17,19,24H,16,18H2,1-5H3,(H,34,36)(H,37,38)
InChiKey WEJSUWDWHXERKS-UHFFFAOYSA-N
Formula C31H34Cl2N2O4 Molecular Weight 569.52
Cross Link CHEMBL359603
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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Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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