CFam Chemical Families Database
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You are searching for "CFAMM00426529" in compound.

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CFAM Mol ID CFAMM00426529
Family CFFBM14144 Glucocorticoid receptor ligand 1-[(4aS)-6-(4-tert-butylphenyl)sulfonyl-1-(4-fluorophenyl)-4,5,7,8-tetrahydropyrazolo[3,4-g]isoquinolin-4a-yl]-N,N-dimethylmethanamine family
Superfamily CFSAD466 Prostaglandin G/H synthase 2 Inhibitor Celecoxib Superfamily
Class CFCAD428 Class 428
External ID CHEMBL255843 External Source CHEMBL
PubChem CID 11533163 Functional Category Bioactive
Molecule Name 1-[(4aS)-1-(4-fluorophenyl)-6-(4-fluorophenyl)sulfonyl-4,5,7,8-tetrahydropyrazolo[3,4-g]isoquinolin-4a-yl]-N,N-dimethylmethanamine
IUPAC Name 1-[(4aS)-1-(4-fluorophenyl)-6-(4-fluorophenyl)sulfonyl-4,5,7,8-tetrahydropyrazolo[3,4-g]isoquinolin-4a-yl]-N,N-dimethylmethanamine
Synonyms SureCN1618876
InChi InChI=1S/C25H26F2N4O2S/c1-29(2)16-25-14-18-15-28-31(22-7-3-20(26)4-8-22)24(18)13-19(25)11-12-30(17-25)34(32,33)23-9-5-21(27)6-10-23/h3-10,13,15H,11-12,14,16-17H2,1-2H3/t25-/m0/s1
InChiKey IUXAJJWCPLUGKF-VWLOTQADSA-N
Formula C25H26F2N4O2S Molecular Weight 484.56
Cross Link CHEMBL255843
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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National University of Singapore, Singapore


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