CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00421213" 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 CFAMM00421213
Family CFFBM13233 Prostaglandin D2 receptor 2 ligand 2-[3-[(E)-2-cyano-3-(N-methylanilino)-3-oxoprop-1-enyl]-4-fluoroindol-1-yl]acetic acid family
Superfamily CFSBM5993 DNA polymerase beta and Retinal dehydrogenase 1 Binder Superfamily 6
Class CFCCD113 Class 926
External ID CHEMBL2391518 External Source CHEMBL
PubChem CID 11509269 Functional Category Bioactive
Molecule Name 2-[3-[(E)-2-cyano-3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxoprop-1-enyl]indol-1-yl]acetic acid
IUPAC Name 2-[3-[(E)-2-cyano-3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxoprop-1-enyl]indol-1-yl]acetic acid
Synonyms SureCN2087576
InChi InChI=1S/C23H19N3O3/c24-13-17(23(29)26-11-5-7-16-6-1-3-9-20(16)26)12-18-14-25(15-22(27)28)21-10-4-2-8-19(18)21/h1-4,6,8-10,12,14H,5,7,11,15H2,(H,27,28)/b17-12+
InChiKey GPOINCDNNRDNCO-SFQUDFHCSA-N
Formula C23H19N3O3 Molecular Weight 385.42
Cross Link CHEMBL2391518
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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