CFam Chemical Families Database
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You are searching for "CFAMM00453333" in compound.

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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 CFAMM00453333
Family CFFBM19832 Aurora kinase B and Aurora kinase A inhibitor SureCN5594082 family
Superfamily CFSBM7121 Lethal factor and Aurora kinase A Binder Superfamily
Class CFCCD423 Class 1236
External ID CHEMBL1093515 External Source CHEMBL
PubChem CID 46886394 Functional Category Bioactive
Molecule Name SureCN5594082
IUPAC Name 4-methyl-3-[(E)-2-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]ethenyl]-1H-indazole-5-carbonitrile
Synonyms CHEBI:723776
InChi InChI=1S/C23H25N5/c1-17-20(15-24)7-9-22-23(17)21(25-26-22)8-6-18-4-3-5-19(14-18)16-28-12-10-27(2)11-13-28/h3-9,14H,10-13,16H2,1-2H3,(H,25,26)/b8-6+
InChiKey XTWXMJDVQOEURD-SOFGYWHQSA-N
Formula C23H25N5 Molecular Weight 371.48
Cross Link CHEMBL1093515
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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