CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00104327" in compound.

Total 1 results found.

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 CFAMM00104327
Family CFFAD829 14-alpha sterol demethylase Inhibitor Butoconazole Family
Superfamily CFSAD693 14-alpha sterol demethylase Inhibitor Butoconazole Superfamily
Class CFCAD626 Class 626
External ID DAP001267 External Source TTD
PubChem CID 47472 Functional Category Approved Drug
Molecule Name Butoconazole
IUPAC Name 1-[4-(4-chlorophenyl)-2-(2,6-dichlorophenyl)sulfanylbutyl]imidazole
Synonyms Butoconazol;Butoconazolum;Femstat;Butaconazole;Butoconazol [INN-Spanish];Butoconazolum [INN-Latin];Gynazole-1;Gynofort;64872-76-0;Butoconazole [INN:BAN]
InChi InChI=1S/C19H17Cl3N2S/c20-15-7-4-14(5-8-15)6-9-16(12-24-11-10-23-13-24)25-19-17(21)2-1-3-18(19)22/h1-5,7-8,10-11,13,16H,6,9,12H2
InChiKey SWLMUYACZKCSHZ-UHFFFAOYSA-N
Formula C19H17Cl3N2S Molecular Weight 411.78
Cross Link CHEMBL1295 DB00639
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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