CFam Chemical Families Database
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You are searching for "CFAMM00435618" in compound.

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CFAM Mol ID CFAMM00435618
Family CFFBM15695 Carbonic anhydrase 2 and Carbonic anhydrase 1 inhibitor 2-(2,6-dimethyl-4-phenylpyridin-1-ium-1-yl)-N-[4-[(4-sulfamoylphenyl)sulfamoyl]phenyl]acetamide;perchlorate family
Superfamily CFSBM43 Carbonic anhydrase 2 and Carbonic anhydrase 4 Binder Superfamily 3
Class CFCCD362 Class 1175
External ID CHEMBL318014 External Source CHEMBL
PubChem CID 10793458 Functional Category Bioactive
Molecule Name N-(2-chloro-4-sulfamoylphenyl)-2-[4-phenyl-2,6-di(propan-2-yl)pyridin-1-ium-1-yl]acetamide;perchlorate
IUPAC Name N-(2-chloro-4-sulfamoylphenyl)-2-[4-phenyl-2,6-di(propan-2-yl)pyridin-1-ium-1-yl]acetamide;perchlorate
Synonyms CHEBI:267156
InChi InChI=1S/C25H28ClN3O3S.ClHO4/c1-16(2)23-12-19(18-8-6-5-7-9-18)13-24(17(3)4)29(23)15-25(30)28-22-11-10-20(14-21(22)26)33(27,31)32;2-1(3,4)5/h5-14,16-17H,15H2,1-4H3,(H2-,27,28,30,31,32);(H,2,3,4,5)
InChiKey XWEMPCOASLFLQP-UHFFFAOYSA-N
Formula C25H29ClN3O3S.ClO4 Molecular Weight 586.48
Cross Link CHEMBL318014
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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Professor in Department of Pharmacy
National University of Singapore, Singapore


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