CFam Chemical Families Database
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You are searching for "CFAMM00176426" 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 CFAMM00176426
Family CFFID58 72 kDa type IV collagenase Inhibitor Batimastat Family
Superfamily CFSID43 72 kDa type IV collagenase Inhibitor Batimastat Superfamily
Class CFCID26 Class 1376
External ID CHEMBL1080781 External Source CHEMBL
PubChem CID 46883428 Functional Category Bioactive
Molecule Name (2S)-2-amino-N-[(1S)-1-cyano-3-phenylpropyl]-3-thiophen-2-ylpropanamide
IUPAC Name (2S)-2-amino-N-[(1S)-1-cyano-3-phenylpropyl]-3-thiophen-2-ylpropanamide
Synonyms CHEBI:718813
InChi InChI=1S/C17H19N3OS/c18-12-14(9-8-13-5-2-1-3-6-13)20-17(21)16(19)11-15-7-4-10-22-15/h1-7,10,14,16H,8-9,11,19H2,(H,20,21)/t14-,16-/m0/s1
InChiKey BRVDRPWFUGZVRQ-HOCLYGCPSA-N
Formula C17H19N3OS Molecular Weight 313.42
Cross Link CHEMBL1080781
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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