CFam Chemical Families Database
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You are searching for "CFAMM00471095" 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 CFAMM00471095
Family CFFBM24691 Tyrosine-protein kinase ABL1 and Proto-oncogene tyrosine-protein kinase Src inhibitor AGN-PC-09MAYO family
Superfamily CFSBM9765 Beta-lactamase and Ras-related protein Rab-9A Binder Superfamily 8
Class CFCCD437 Class 1250
External ID CHEMBL415264 External Source CHEMBL
PubChem CID 23655480 Functional Category Bioactive
Molecule Name AGN-PC-046WXP
IUPAC Name 1-(2-chloro-2-phenylethyl)-N-[2-(4-methylphenyl)ethyl]-6-methylsulfanylpyrazolo[3,4-d]pyrimidin-4-amine
Synonyms CHEBI:502589;1-(2-chloro-2-phenylethyl)-N-[2-(4-methylphenyl)ethyl]-6-methylsulfanylpyrazolo[3,4-d]pyrimidin-4-amine
InChi InChI=1S/C23H24ClN5S/c1-16-8-10-17(11-9-16)12-13-25-21-19-14-26-29(22(19)28-23(27-21)30-2)15-20(24)18-6-4-3-5-7-18/h3-11,14,20H,12-13,15H2,1-2H3,(H,25,27,28)
InChiKey SNWKJSWMWRHVNL-UHFFFAOYSA-N
Formula C23H24ClN5S Molecular Weight 437.99
Cross Link CHEMBL415264
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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