CFam Chemical Families Database
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You are searching for "CFAMM00241469" in compound.

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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 CFAMM00241469
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 CHEMBL188023 External Source CHEMBL
PubChem CID 11167057 Functional Category Bioactive
Molecule Name 6-[(4-nitrophenyl)methylsulfanyl]-9-[(2-thiophen-2-ylphenyl)methyl]purine
IUPAC Name 6-[(4-nitrophenyl)methylsulfanyl]-9-[(2-thiophen-2-ylphenyl)methyl]purine
Synonyms CHEBI:413737
InChi InChI=1S/C23H17N5O2S2/c29-28(30)18-9-7-16(8-10-18)13-32-23-21-22(24-14-25-23)27(15-26-21)12-17-4-1-2-5-19(17)20-6-3-11-31-20/h1-11,14-15H,12-13H2
InChiKey FALPNWUGUXVWDF-UHFFFAOYSA-N
Formula C23H17N5O2S2 Molecular Weight 459.54
Cross Link CHEMBL188023
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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