CFam Chemical Families Database
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You are searching for "CFAMM00165107" in compound.

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CFAM Mol ID CFAMM00165107
Family CFFCD567 Serine/threonine-protein kinase mTOR Inhibitor INK128 Family
Superfamily CFSCD351 Adenosine receptor A2a and Serine/threonine-protein kinase mTOR Binder Superfamily
Class CFCCD257 Class 1070
External ID CHEMBL1258118 External Source CHEMBL
PubChem CID 52946503 Functional Category Bioactive
Molecule Name AGN-PC-09M7P0
IUPAC Name N-[4-[4-amino-1-(4-morpholin-4-ylcyclohexyl)pyrazolo[3,4-d]pyrimidin-3-yl]phenyl]-7-chloro-1,3-benzoxazol-2-amine
Synonyms CHEBI:807125;N-[4-[4-amino-1-(4-morpholin-4-ylcyclohexyl)pyrazolo[3,4-d]pyrimidin-3-yl]phenyl]-7-chloro-1,3-benzoxazol-2-amine
InChi InChI=1S/C28H29ClN8O2/c29-21-2-1-3-22-25(21)39-28(34-22)33-18-6-4-17(5-7-18)24-23-26(30)31-16-32-27(23)37(35-24)20-10-8-19(9-11-20)36-12-14-38-15-13-36/h1-7,16,19-20H,8-15H2,(H,33,34)(H2,30,31,32)/t19-,20-
InChiKey HAJVSTFCLZBFNA-MXVIHJGJSA-N
Formula C28H29ClN8O2 Molecular Weight 545.04
Cross Link CHEMBL1258118
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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