CFam Chemical Families Database
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You are searching for "CFAMM00241480" in compound.

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CFAM Mol ID CFAMM00241480
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 CHEMBL565490 External Source CHEMBL
PubChem CID 45483718 Functional Category Bioactive
Molecule Name 2-N-(4-aminocyclohexyl)-6-N-[[5-(2-fluorophenyl)thiophen-2-yl]methyl]-9-propan-2-ylpurine-2,6-diamine;hydrochloride
IUPAC Name 2-N-(4-aminocyclohexyl)-6-N-[[5-(2-fluorophenyl)thiophen-2-yl]methyl]-9-propan-2-ylpurine-2,6-diamine;hydrochloride
Synonyms AGN-PC-07COV5;2-N-(4-aminocyclohexyl)-6-N-[[5-(2-fluorophenyl)thiophen-2-yl]methyl]-9-propan-2-ylpurine-2,6-diamine;hydrochloride
InChi InChI=1S/C25H30FN7S.ClH/c1-15(2)33-14-29-22-23(31-25(32-24(22)33)30-17-9-7-16(27)8-10-17)28-13-18-11-12-21(34-18)19-5-3-4-6-20(19)26;/h3-6,11-12,14-17H,7-10,13,27H2,1-2H3,(H2,28,30,31,32);1H/t16-,17-;
InChiKey YWAKCAZFEMDFMO-BHQIMSFRSA-N
Formula C25H31ClFN7S Molecular Weight 516.08
Cross Link CHEMBL565490
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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