CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00187747" in compound.

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CFAM Mol ID CFAMM00187747
Family CFFID332 Neprilysin Inhibitor Thiorphan Family
Superfamily CFSID268 Neprilysin Inhibitor Thiorphan Superfamily
Class CFCID188 Class 1538
External ID ZINC02098718 External Source ZINC
PubChem CID 1754752 Functional Category Natural Product
Molecule Name AC1LWNWT
IUPAC Name (2S)-4-methylsulfanyl-2-(3-phenylpropylcarbamoylamino)butanoate
Synonyms ZINC02098718;(2S)-4-methylsulfanyl-2-(3-phenylpropylcarbamoylamino)butanoate
InChi InChI=1S/C15H22N2O3S/c1-21-11-9-13(14(18)19)17-15(20)16-10-5-8-12-6-3-2-4-7-12/h2-4,6-7,13H,5,8-11H2,1H3,(H,18,19)(H2,16,17,20)/p-1/t13-/m0/s1
InChiKey HYOMPMWOJFOEAJ-ZDUSSCGKSA-M
Formula C15H21N2O3S- Molecular Weight 309.40
Cross Link
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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