CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00141595" 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 CFAMM00141595
Family CFFCD186 Prostaglandin G/H synthase 2 Inhibitor Rpr 200765a Family
Superfamily CFSCD170 Prostaglandin G/H synthase 2 Inhibitor Rpr 200765a Superfamily
Class CFCCD107 Class 920
External ID 53775804 External Source PubChem
PubChem CID 53775804 Functional Category Patent Compound
Molecule Name AGN-PC-09YMTI
IUPAC Name 2-[4-(4-fluorophenyl)-5-[2-(prop-2-enylamino)pyrimidin-4-yl]-1H-imidazol-2-yl]-5-methyl-N-propyl-1,3-dioxane-5-carboxamide
Synonyms SureCN5769900;2-[4-(4-fluorophenyl)-5-[2-(prop-2-enylamino)pyrimidin-4-yl]-1H-imidazol-2-yl]-5-methyl-N-propyl-1,3-dioxane-5-carboxamide
InChi InChI=1S/C25H29FN6O3/c1-4-11-27-23(33)25(3)14-34-22(35-15-25)21-31-19(16-6-8-17(26)9-7-16)20(32-21)18-10-13-29-24(30-18)28-12-5-2/h5-10,13,22H,2,4,11-12,14-15H2,1,3H3,(H,27,33)(H,31,32)(H,28,29,30)
InChiKey DRUZPITXWCKFQV-UHFFFAOYSA-N
Formula C25H29FN6O3 Molecular Weight 480.53
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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