CFam Chemical Families Database
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You are searching for "CFAMM00334310" in compound.

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CFAM Mol ID CFAMM00334310
Family CFFBM2447 Carbonic anhydrase 9 and Carbonic anhydrase 2 inhibitor AGN-PC-088JBL family
Superfamily CFSBM1029 Tyrosine-protein kinase Yes and Proto-oncogene tyrosine-protein kinase Src Binder Superfamily
Class CFCCD527 Class 1340
External ID CHEMBL1270632 External Source CHEMBL
PubChem CID 52948213 Functional Category Bioactive
Molecule Name AGN-PC-09M8R7
IUPAC Name 2-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]-5-naphthalen-2-yl-1-(4-sulfamoylphenyl)pyrrole-3-carboxamide
Synonyms CHEBI:809876;2-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]-5-naphthalen-2-yl-1-(4-sulfamoylphenyl)pyrrole-3-carboxamide
InChi InChI=1S/C29H33N5O3S/c1-21-27(29(35)31-13-14-33-17-15-32(2)16-18-33)20-28(24-8-7-22-5-3-4-6-23(22)19-24)34(21)25-9-11-26(12-10-25)38(30,36)37/h3-12,19-20H,13-18H2,1-2H3,(H,31,35)(H2,30,36,37)
InChiKey BPTSKIQPUKLKRH-UHFFFAOYSA-N
Formula C29H33N5O3S Molecular Weight 531.67
Cross Link CHEMBL1270632
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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