CFam Chemical Families Database
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You are searching for "CFAMM00126944" in compound.

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CFAM Mol ID CFAMM00126944
Family CFFCD8 RAC-gamma serine/threonine-protein kinase and Ribosomal protein S6 kinase beta-1 Inhibitor XL418 Family
Superfamily CFSCD8 RAC-gamma serine/threonine-protein kinase and Ribosomal protein S6 kinase beta-1 Inhibitor XL418 Superfamily
Class CFCCD6 Class 819
External ID CHEMBL2012701 External Source CHEMBL
PubChem CID 57345536 Functional Category Bioactive
Molecule Name N-[5-chloro-3-[4-(3-ethyl-2H-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-2-methylphenyl]-N',N'-dimethylethane-1,2-diamine
IUPAC Name N-[5-chloro-3-[4-(3-ethyl-2H-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-2-methylphenyl]-N',N'-dimethylethane-1,2-diamine
Synonyms AGN-PC-0BS6HC;SureCN1790980;N-[5-chloro-3-[4-(3-ethyl-2H-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-2-methylphenyl]-N',N'-dimethylethane-1,2-diamine
InChi InChI=1S/C22H31ClN8/c1-5-17-20-21(28-27-17)25-14-26-22(20)31-10-8-30(9-11-31)19-13-16(23)12-18(15(19)2)24-6-7-29(3)4/h12-14,24H,5-11H2,1-4H3,(H,25,26,27,28)
InChiKey ACXREQVXILYMKB-UHFFFAOYSA-N
Formula C22H31ClN8 Molecular Weight 442.99
Cross Link CHEMBL2012701
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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