CFam Chemical Families Database
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You are searching for "CFAMM00313217" in compound.

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CFAM Mol ID CFAMM00313217
Family CFFBM555 Hydroxycarboxylic acid receptor 2 ligand AGN-PC-07ZGMC family
Superfamily CFSBM337 Hydroxycarboxylic acid receptor 2 Binder Superfamily 2
Class CFCCD415 Class 1228
External ID CHEMBL1083743 External Source CHEMBL
PubChem CID 17751630 Functional Category Bioactive
Molecule Name AGN-PC-01LS1R
IUPAC Name 2-[[2-amino-3-[3-(5-fluoropyridin-2-yl)-1,2,4-oxadiazol-5-yl]propanoyl]amino]-5-(3,5-difluorophenyl)cyclohexene-1-carboxylic acid
Synonyms SureCN13933815;CHEBI:732369;2-[[2-amino-3-[3-(5-fluoropyridin-2-yl)-1,2,4-oxadiazol-5-yl]propanoyl]amino]-5-(3,5-difluorophenyl)cyclohexene-1-carboxylic acid
InChi InChI=1S/C23H20F3N5O4/c24-13-2-4-19(28-10-13)21-30-20(35-31-21)9-17(27)22(32)29-18-3-1-11(7-16(18)23(33)34)12-5-14(25)8-15(26)6-12/h2,4-6,8,10-11,17H,1,3,7,9,27H2,(H,29,32)(H,33,34)
InChiKey HBYNOPHXXILWRU-UHFFFAOYSA-N
Formula C23H20F3N5O4 Molecular Weight 487.43
Cross Link CHEMBL1083743
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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