CFam Chemical Families Database
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You are searching for "CFAMM00095001" 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 CFAMM00095001
Family CFFAD684 Prostaglandin G/H synthase 2 Inhibitor Niflumic Acid Family
Superfamily CFSAD580 Prostaglandin G/H synthase 2 Inhibitor Niflumic Acid Superfamily
Class CFCAD528 Class 528
External ID CHEMBL2170440 External Source CHEMBL
PubChem CID 56587965 Functional Category Bioactive
Molecule Name Bisanilinopyrimidine, 6n
IUPAC Name 4-[[4-(2-cyanoanilino)pyrimidin-2-yl]amino]benzoic acid
Synonyms AGN-PC-0BEDC7;4-[[4-(2-cyanoanilino)pyrimidin-2-yl]amino]benzoic acid;4-({4-[(2-Cyanophenyl)amino]pyrimidin-2-Yl}amino)benzoic Acid;0C5
InChi InChI=1S/C18H13N5O2/c19-11-13-3-1-2-4-15(13)22-16-9-10-20-18(23-16)21-14-7-5-12(6-8-14)17(24)25/h1-10H,(H,24,25)(H2,20,21,22,23)
InChiKey MEKVNSMGVQRYJI-UHFFFAOYSA-N
Formula C18H13N5O2 Molecular Weight 331.33
Cross Link CHEMBL2170440
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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