CFam Chemical Families Database
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You are searching for "CFAMM00237940" in compound.

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CFAM Mol ID CFAMM00237940
Family CFFID1409 Angiopoietin-1 receptor and Tyrosine-protein kinase Lck Inhibitor A-420983 Family
Superfamily CFSID1122 Angiopoietin-1 receptor and Tyrosine-protein kinase Lck Inhibitor A-420983 Superfamily
Class CFCCD257 Class 1070
External ID CHEMBL198239 External Source CHEMBL
PubChem CID 20817330 Functional Category Bioactive
Molecule Name SureCN6434845
IUPAC Name N-[4-[4-amino-1-[1-(oxan-4-yl)piperidin-4-yl]pyrazolo[3,4-d]pyrimidin-3-yl]-2-methoxyphenyl]-2-fluoro-4-(trifluoromethyl)benzamide
Synonyms AGN-PC-0308NE;CHEBI:434353;N-[4-[4-amino-1-[1-(oxan-4-yl)piperidin-4-yl]pyrazolo[3,4-d]pyrimidin-3-yl]-2-methoxyphenyl]-2-fluoro-4-(trifluoromethyl)benzamide
InChi InChI=1S/C30H31F4N7O3/c1-43-24-14-17(2-5-23(24)38-29(42)21-4-3-18(15-22(21)31)30(32,33)34)26-25-27(35)36-16-37-28(25)41(39-26)20-6-10-40(11-7-20)19-8-12-44-13-9-19/h2-5,14-16,19-20H,6-13H2,1H3,(H,38,42)(H2,35,36,37)
InChiKey GEQAHGXLBPYTMU-UHFFFAOYSA-N
Formula C30H31F4N7O3 Molecular Weight 613.61
Cross Link CHEMBL198239
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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