CFam Chemical Families Database
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You are searching for "CFAMM00241452" 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 CFAMM00241452
Family CFFID1520 Mitogen-activated protein kinase 14 Inhibitor 9-benzyl-6-phenylsulfanyl-9h-purine Family
Superfamily CFSID1186 Mitogen-activated protein kinase 14 Binder Superfamily
Class CFCID792 Class 2142
External ID CHEMBL184288 External Source CHEMBL
PubChem CID 11272406 Functional Category Bioactive
Molecule Name AGN-PC-005QGB
IUPAC Name 6-[(4-nitrophenyl)methylsulfanyl]-9-[[2-[3-(trifluoromethyl)phenyl]phenyl]methyl]purine
Synonyms CHEBI:413515;6-[(4-nitrophenyl)methylsulfanyl]-9-[[2-[3-(trifluoromethyl)phenyl]phenyl]methyl]purine
InChi InChI=1S/C26H18F3N5O2S/c27-26(28,29)20-6-3-5-18(12-20)22-7-2-1-4-19(22)13-33-16-32-23-24(33)30-15-31-25(23)37-14-17-8-10-21(11-9-17)34(35)36/h1-12,15-16H,13-14H2
InChiKey FULIAINSSHZWML-UHFFFAOYSA-N
Formula C26H18F3N5O2S Molecular Weight 521.51
Cross Link CHEMBL184288
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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