CFam Chemical Families Database
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You are searching for "CFAMM00378471" 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 CFAMM00378471
Family CFFBM7249 Substance-K receptor and Cytochrome P450 2D6 ligand 158848-32-9 family
Superfamily CFSBM554 5-hydroxytryptamine receptor 6 and Cannabinoid receptor 2 Binder Superfamily
Class CFCBM214 Class 3264
External ID CHEMBL166161 External Source CHEMBL
PubChem CID 3570748 Functional Category Bioactive
Molecule Name 158848-32-9
IUPAC Name 3-[2-[4-(benzenesulfinylmethyl)-4-methoxypiperidin-1-yl]ethyl]-5-fluoro-1H-indole
Synonyms GR-159,897;Tocris-1274;AC1MT6MT;SureCN8271428;CTK8H1201;CHEBI:380028;HMS3267L05;NCGC00025092-01;NCGC00025092-02
InChi InChI=1S/C23H27FN2O2S/c1-28-23(17-29(27)20-5-3-2-4-6-20)10-13-26(14-11-23)12-9-18-16-25-22-8-7-19(24)15-21(18)22/h2-8,15-16,25H,9-14,17H2,1H3
InChiKey BANYJBHWTOJQDU-UHFFFAOYSA-N
Formula C23H27FN2O2S Molecular Weight 414.54
Cross Link CHEMBL166161
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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