CFam Chemical Families Database
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You are searching for "CFAMM00440762" in compound.

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CFAM Mol ID CFAMM00440762
Family CFFBM17145 RAC-alpha serine/threonine-protein kinase and RAC-beta serine/threonine-protein kinase inhibitor SureCN1501766 family
Superfamily CFSID1829 Potassium voltage-gated channel subfamily H member 2 and Vascular endothelial growth factor receptor 2 Ligand BMS-645737 Superfamily
Class CFCID1133 Class 2483
External ID CHEMBL488428 External Source CHEMBL
PubChem CID 44560680 Functional Category Bioactive
Molecule Name 2-[4-[[4-[(5E)-5-(6-oxopyridin-3-ylidene)-1,2-dihydro-1,2,4-triazol-3-yl]piperidin-1-yl]methyl]phenyl]-3-phenyl-6H-1,6-naphthyridin-5-one
IUPAC Name 2-[4-[[4-[(5E)-5-(6-oxopyridin-3-ylidene)-1,2-dihydro-1,2,4-triazol-3-yl]piperidin-1-yl]methyl]phenyl]-3-phenyl-6H-1,6-naphthyridin-5-one
Synonyms CHEBI:548072
InChi InChI=1S/C33H29N7O2/c41-29-11-10-25(19-35-29)32-37-31(38-39-32)24-13-16-40(17-14-24)20-21-6-8-23(9-7-21)30-26(22-4-2-1-3-5-22)18-27-28(36-30)12-15-34-33(27)42/h1-12,15,18-19,24H,13-14,16-17,20H2,(H,34,42)(H,35,41)(H,37,38,39)
InChiKey WODXCEOADJHAKH-UHFFFAOYSA-N
Formula C33H29N7O2 Molecular Weight 555.63
Cross Link CHEMBL488428
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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