CFam Chemical Families Database
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You are searching for "CFAMM00435659" in compound.

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CFAM Mol ID CFAMM00435659
Family CFFBM15703 Integrin beta-3 and Integrin alpha-V inhibitor (3R)-3-(1,3-benzodioxol-5-yl)-3-[[(3R)-5-oxo-1-[3-(1,4,5,6-tetrahydropyrimidin-2-ylamino)phenyl]pyrrolidine-3-carbonyl]amino]propanoic acid family
Superfamily CFSID2854 Genome polyprotein Inhibitor Azapeptide Derivative Superfamily
Class CFCCD141 Class 954
External ID CHEMBL99709 External Source CHEMBL
PubChem CID 44330191 Functional Category Bioactive
Molecule Name AGN-PC-074S2I
IUPAC Name 3-(1,3-benzodioxol-5-yl)-3-[[1-[3-(benzylcarbamoylamino)phenyl]-5-oxopyrrolidine-3-carbonyl]amino]propanoic acid
Synonyms CHEBI:261132;3-(1,3-benzodioxol-5-yl)-3-[[1-[3-(benzylcarbamoylamino)phenyl]-5-oxopyrrolidine-3-carbonyl]amino]propanoic acid
InChi InChI=1S/C29H28N4O7/c34-26-12-20(28(37)32-23(14-27(35)36)19-9-10-24-25(11-19)40-17-39-24)16-33(26)22-8-4-7-21(13-22)31-29(38)30-15-18-5-2-1-3-6-18/h1-11,13,20,23H,12,14-17H2,(H,32,37)(H,35,36)(H2,30,31,38)
InChiKey RWBOWRDCKZVMOU-UHFFFAOYSA-N
Formula C29H28N4O7 Molecular Weight 544.56
Cross Link CHEMBL99709
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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Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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