CFam Chemical Families Database
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You are searching for "CFAMM00392138" in compound.

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CFAM Mol ID CFAMM00392138
Family CFFBM8993 Integrin alpha-V and Integrin beta-5 inhibitor SureCN2489170 family
Superfamily CFSBM4413 Tryptophan 5-hydroxylase 1 and Integrin beta-5 Binder Superfamily
Class CFCID670 Class 2020
External ID CHEMBL364808 External Source CHEMBL
PubChem CID 44399616 Functional Category Bioactive
Molecule Name AGN-PC-075IP0
IUPAC Name 3-(6-methylsulfonylpyridin-3-yl)-3-[5-[2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethoxy]indol-1-yl]propanoic acid
Synonyms CHEBI:419854;3-(6-methylsulfonylpyridin-3-yl)-3-[5-[2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethoxy]indol-1-yl]propanoic acid
InChi InChI=1S/C27H28N4O5S/c1-37(34,35)25-9-5-20(17-29-25)24(16-26(32)33)31-13-10-19-15-22(7-8-23(19)31)36-14-11-21-6-4-18-3-2-12-28-27(18)30-21/h4-10,13,15,17,24H,2-3,11-12,14,16H2,1H3,(H,28,30)(H,32,33)
InChiKey JSXRQHGDURETKY-UHFFFAOYSA-N
Formula C27H28N4O5S Molecular Weight 520.60
Cross Link CHEMBL364808
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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