CFam Chemical Families Database
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You are searching for "CFAMM00280769" in compound.

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CFAM Mol ID CFAMM00280769
Family CFFID2958 Collagenase 3 and Macrophage metalloelastase Inhibitor 5-(4'-cyanobiphenyl-4-yl)-3-hydroxypentanoic Acid Family
Superfamily CFSID2081 Collagenase 3 and Macrophage metalloelastase Inhibitor 5-(4'-cyanobiphenyl-4-yl)-3-hydroxypentanoic Acid Superfamily
Class CFCID1268 Class 2618
External ID 53716965 External Source PubChem
PubChem CID 53716965 Functional Category Patent Compound
Molecule Name AGN-PC-09XVAB
IUPAC Name 4-[4-(2-cyanophenyl)phenyl]butanoic acid
Synonyms 4-[4-(2-cyanophenyl)phenyl]butanoic acid
InChi InChI=1S/C17H15NO2/c18-12-15-5-1-2-6-16(15)14-10-8-13(9-11-14)4-3-7-17(19)20/h1-2,5-6,8-11H,3-4,7H2,(H,19,20)
InChiKey CENBNGMMZYKBQL-UHFFFAOYSA-N
Formula C17H15NO2 Molecular Weight 265.31
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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