CFam Chemical Families Database
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You are searching for "CFAMM00436294" in compound.

Total 1 results found.

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 CFAMM00436294
Family CFFBM15896 Angiotensin-converting enzyme and Histone-lysine N-methyltransferase 2A inhibitor Zofenopril family
Superfamily CFSBM6717 Angiotensin-converting enzyme and Histone-lysine N-methyltransferase 2A inhibitor Zofenopril Superfamily
Class CFCBM1235 Class 4285
External ID CHEMBL129559 External Source CHEMBL
PubChem CID 23337526 Functional Category Bioactive
Molecule Name AGN-PC-041KG0
IUPAC Name 1-[3-acetylsulfanyl-4-(3-fluorophenyl)-4-oxobutanoyl]pyrrolidine-2-carboxylic acid
Synonyms CHEBI:311284;1-[3-acetylsulfanyl-4-(3-fluorophenyl)-4-oxobutanoyl]pyrrolidine-2-carboxylic acid
InChi InChI=1S/C17H18FNO5S/c1-10(20)25-14(16(22)11-4-2-5-12(18)8-11)9-15(21)19-7-3-6-13(19)17(23)24/h2,4-5,8,13-14H,3,6-7,9H2,1H3,(H,23,24)
InChiKey JPSWAPMQXLKILU-UHFFFAOYSA-N
Formula C17H18FNO5S Molecular Weight 367.39
Cross Link CHEMBL129559
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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Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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