CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00060206" 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 CFAMM00060206
Family CFFAD427 Angiotensin-converting enzyme Inhibitor Benazepril Family
Superfamily CFSAD370 Angiotensin-converting enzyme Inhibitor Benazepril Superfamily
Class CFCAD348 Class 348
External ID 22116186 External Source PubChem
PubChem CID 22116186 Functional Category Patent Compound
Molecule Name AGN-PC-03KM4Q
IUPAC Name 2-[[3,4-dioxo-2-(4-phenylpiperazin-1-yl)cyclobuten-1-yl]amino]-3-phenylpropanoic acid
Synonyms 2-[[3,4-dioxo-2-(4-phenylpiperazin-1-yl)cyclobuten-1-yl]amino]-3-phenylpropanoic acid
InChi InChI=1S/C23H23N3O4/c27-21-19(24-18(23(29)30)15-16-7-3-1-4-8-16)20(22(21)28)26-13-11-25(12-14-26)17-9-5-2-6-10-17/h1-10,18,24H,11-15H2,(H,29,30)
InChiKey RYOJNFQELHUJHX-UHFFFAOYSA-N
Formula C23H23N3O4 Molecular Weight 405.45
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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