CFam Chemical Families Database
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You are searching for "CFAMM00448234" 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 CFAMM00448234
Family CFFBM18609 Glucocorticoid receptor ligand SureCN12238714 family
Superfamily CFSBM7360 Glucocorticoid receptor and Progesterone receptor Binder Superfamily 10
Class CFCBM2214 Class 5264
External ID CHEMBL567028 External Source CHEMBL
PubChem CID 45486438 Functional Category Bioactive
Molecule Name SureCN12238704
IUPAC Name (1S)-1-[(5aR,6S)-1-(4-fluorophenyl)-5a-methyl-6,7,8,9-tetrahydro-5H-imidazo[1,5-b]isoquinolin-6-yl]-1-(3-methylthiophen-2-yl)ethanol
Synonyms CHEBI:680072
InChi InChI=1S/C25H27FN2OS/c1-16-11-12-30-23(16)25(3,29)21-6-4-5-18-13-20-22(17-7-9-19(26)10-8-17)27-15-28(20)14-24(18,21)2/h7-13,15,21,29H,4-6,14H2,1-3H3/t21-,24-,25-/m0/s1
InChiKey UUGJKSUOOIUEHL-TUSQITKMSA-N
Formula C25H27FN2OS Molecular Weight 422.56
Cross Link CHEMBL567028
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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