CFam Chemical Families Database
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You are searching for "CFAMM00370900" in compound.

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CFAM Mol ID CFAMM00370900
Family CFFBM6215 Neprilysin inhibitor AGN-PC-047EOK family
Superfamily CFSBM3587 Neprilysin and Cathepsin K Binder Superfamily
Class CFCBM1350 Class 4400
External ID CHEMBL158290 External Source CHEMBL
PubChem CID 23701613 Functional Category Bioactive
Molecule Name AGN-PC-047EOI
IUPAC Name sodium;2-[(2-benzyl-3-sulfanylpropanoyl)-methylamino]ethanesulfonate
Synonyms CHEBI:359543;sodium;2-[(2-benzyl-3-sulfanylpropanoyl)-methylamino]ethanesulfonate
InChi InChI=1S/C13H19NO4S2.Na/c1-14(7-8-20(16,17)18)13(15)12(10-19)9-11-5-3-2-4-6-11;/h2-6,12,19H,7-10H2,1H3,(H,16,17,18);/q;+1/p-1
InChiKey NFCGTYNZDNZORO-UHFFFAOYSA-M
Formula C13H18NO4S2.Na Molecular Weight 339.41
Cross Link CHEMBL158290
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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