CFam Chemical Families Database
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You are searching for "CFAMM00401285" in compound.

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Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

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CFAM Mol ID CFAMM00401285
Family CFFBM10320 Integrin beta-3 and Integrin alpha-V inhibitor SureCN5849872 family
Superfamily CFSBM5091 Integrin beta-3 and Integrin alpha-V Binder Superfamily 17
Class CFCCD172 Class 985
External ID CHEMBL202350 External Source CHEMBL
PubChem CID 10007481 Functional Category Bioactive
Molecule Name SureCN5849872
IUPAC Name (3S)-3-(1,3-benzodioxol-5-yl)-4-[2-[4-[(4-thiomorpholin-4-ylpyridin-2-yl)amino]butyl]-1,3-thiazol-4-yl]butanoic acid
Synonyms CHEBI:438775
InChi InChI=1S/C27H32N4O4S2/c32-27(33)15-20(19-4-5-23-24(14-19)35-18-34-23)13-21-17-37-26(30-21)3-1-2-7-28-25-16-22(6-8-29-25)31-9-11-36-12-10-31/h4-6,8,14,16-17,20H,1-3,7,9-13,15,18H2,(H,28,29)(H,32,33)/t20-/m0/s1
InChiKey OCFMIMLTAYUZOV-FQEVSTJZSA-N
Formula C27H32N4O4S2 Molecular Weight 540.70
Cross Link CHEMBL202350
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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