CFam Chemical Families Database
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You are searching for "CFAMM00330560" in compound.

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CFAM Mol ID CFAMM00330560
Family CFFBM2113 Glycogen synthase kinase-3 alpha and Casein kinase II subunit alpha inhibitor 2-[[5-nitro-2-(3,4,5-trimethoxyanilino)pyrimidin-4-yl]amino]benzamide family
Superfamily CFSCD628 Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform Inhibitor Bay 80-6946 Superfamily
Class CFCCD37 Class 850
External ID CHEMBL208468 External Source CHEMBL
PubChem CID 44411276 Functional Category Bioactive
Molecule Name SureCN12528943
IUPAC Name N-cyclopropyl-3-[2-(3,4,5-trimethoxyanilino)pyrrolo[2,3-d]pyrimidin-7-yl]benzamide
Synonyms AGN-PC-0761XP;CHEBI:447172;N-cyclopropyl-3-[2-(3,4,5-trimethoxyanilino)pyrrolo[2,3-d]pyrimidin-7-yl]benzamide
InChi InChI=1S/C25H25N5O4/c1-32-20-12-18(13-21(33-2)22(20)34-3)28-25-26-14-16-9-10-30(23(16)29-25)19-6-4-5-15(11-19)24(31)27-17-7-8-17/h4-6,9-14,17H,7-8H2,1-3H3,(H,27,31)(H,26,28,29)
InChiKey LOKFDMXYKLQEMD-UHFFFAOYSA-N
Formula C25H25N5O4 Molecular Weight 459.50
Cross Link CHEMBL208468
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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