CFam Chemical Families Database
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You are searching for "CFAMM00289862" 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 CFAMM00289862
Family CFFID3378 Reverse transcriptase Inhibitor 10-propyl-10h-dibenzo[b,f][1,4]thiazepin-11-one Family
Superfamily CFSID1719 Cholinesterase and Reverse transcriptase Binder Superfamily
Class CFCAD545 Class 545
External ID CHEMBL549958 External Source CHEMBL
PubChem CID 44517771 Functional Category Bioactive
Molecule Name AGN-PC-076VD6
IUPAC Name 3-(4-fluorophenyl)-2-(4-methylsulfonylphenyl)-2H-1,3-benzothiazin-4-one
Synonyms CHEBI:665517;3-(4-fluorophenyl)-2-(4-methylsulfonylphenyl)-2H-1,3-benzothiazin-4-one
InChi InChI=1S/C21H16FNO3S2/c1-28(25,26)17-12-6-14(7-13-17)21-23(16-10-8-15(22)9-11-16)20(24)18-4-2-3-5-19(18)27-21/h2-13,21H,1H3
InChiKey CAZFILKGZKZPEU-UHFFFAOYSA-N
Formula C21H16FNO3S2 Molecular Weight 413.49
Cross Link CHEMBL549958
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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