CFam Chemical Families Database
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You are searching for "CFAMM00308093" in compound.

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CFAM Mol ID CFAMM00308093
Family CFFBM150 Carbonic anhydrase 2 and Carbonic anhydrase 1 inhibitor 2-(2,6-diethyl-4-phenylpyridin-1-ium-1-yl)-N-(2-sulfamoyl-1,3-benzothiazol-6-yl)acetamide;perchlorate family
Superfamily CFSBM94 Carbonic anhydrase 2 and Prelamin-A/C Binder Superfamily 2
Class CFCID348 Class 1698
External ID CHEMBL279450 External Source CHEMBL
PubChem CID 44273640 Functional Category Bioactive
Molecule Name AGN-PC-0749BU
IUPAC Name 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[[1-(cyclohexylmethyl)piperidin-3-yl]methyl]acetamide
Synonyms CHEBI:124801;2-(1,3-benzothiazol-2-ylsulfanyl)-N-[[1-(cyclohexylmethyl)piperidin-3-yl]methyl]acetamide
InChi InChI=1S/C22H31N3OS2/c26-21(16-27-22-24-19-10-4-5-11-20(19)28-22)23-13-18-9-6-12-25(15-18)14-17-7-2-1-3-8-17/h4-5,10-11,17-18H,1-3,6-9,12-16H2,(H,23,26)
InChiKey DSBULHATUKJWAF-UHFFFAOYSA-N
Formula C22H31N3OS2 Molecular Weight 417.63
Cross Link CHEMBL279450
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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