CFam Chemical Families Database
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You are searching for "CFAMM00261359" in compound.

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CFAM Mol ID CFAMM00261359
Family CFFID2155 Epidermal growth factor receptor and Abelson tyrosine-protein kinase 2 Inhibitor SKI-758 Family
Superfamily CFSCD217 Abelson tyrosine-protein kinase 2 and Proto-oncogene tyrosine-protein kinase Src Inhibitor Bosutinib Superfamily
Class CFCCD157 Class 970
External ID CHEMBL415625 External Source CHEMBL
PubChem CID 16099169 Functional Category Bioactive
Molecule Name 4-(2,4-dichloro-5-methoxyanilino)-7-[5-[(4-methylpiperazin-1-yl)methyl]furan-2-yl]quinoline-3-carbonitrile
IUPAC Name 4-(2,4-dichloro-5-methoxyanilino)-7-[5-[(4-methylpiperazin-1-yl)methyl]furan-2-yl]quinoline-3-carbonitrile
Synonyms 3-quinolinecarbonitrile analog 7
InChi InChI=1S/C27H25Cl2N5O2/c1-33-7-9-34(10-8-33)16-19-4-6-25(36-19)17-3-5-20-23(11-17)31-15-18(14-30)27(20)32-24-13-26(35-2)22(29)12-21(24)28/h3-6,11-13,15H,7-10,16H2,1-2H3,(H,31,32)
InChiKey OFEUTPUQWISIIW-UHFFFAOYSA-N
Formula C27H25Cl2N5O2 Molecular Weight 522.43
Cross Link CHEMBL415625
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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