CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00007992" 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 CFAMM00007992
Family CFFAD42 5-alpha reductase inhibitor azasteroid derivative Dutasteride family
Superfamily CFSAD42 5-alpha reductase inhibitor azasteroid derivative Dutasteride Superfamily
Class CFCAD42 Class 42
External ID CHEMBL364626 External Source CHEMBL
PubChem CID 5329889 Functional Category Bioactive
Molecule Name isoindolinone analog 4f
IUPAC Name 1-[4-(1-oxo-2,3-dihydroisoindol-4-yl)phenyl]-3-[4-(trifluoromethyl)phenyl]urea
Synonyms AC1NS7UT;SureCN1335343;1-[4-(1-oxo-2,3-dihydroisoindol-4-yl)phenyl]-3-[4-(trifluoromethyl)phenyl]urea
InChi InChI=1S/C22H16F3N3O2/c23-22(24,25)14-6-10-16(11-7-14)28-21(30)27-15-8-4-13(5-9-15)17-2-1-3-18-19(17)12-26-20(18)29/h1-11H,12H2,(H,26,29)(H2,27,28,30)
InChiKey YVMPCLMMNBMFFZ-UHFFFAOYSA-N
Formula C22H16F3N3O2 Molecular Weight 411.38
Cross Link CHEMBL364626
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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