CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00283177" 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.

Search Results

CFAM Mol ID CFAMM00283177
Family CFFID3049 5-hydroxytryptamine receptor 1A and Sodium-dependent dopamine transporter Ligand 2-(2-chlorophenoxy)-3-(piperidin-4-yl)pyridine Family
Superfamily CFSID439 5-hydroxytryptamine receptor 1A and Sodium-dependent dopamine transporter Binder Superfamily
Class CFCCD191 Class 1004
External ID CHEMBL113130 External Source CHEMBL
PubChem CID 44340796 Functional Category Bioactive
Molecule Name (2S)-1-[6-chloro-5-[(E)-2-pyridin-4-ylethenyl]pyridin-3-yl]oxy-N-methyl-3-phenylpropan-2-amine
IUPAC Name (2S)-1-[6-chloro-5-[(E)-2-pyridin-4-ylethenyl]pyridin-3-yl]oxy-N-methyl-3-phenylpropan-2-amine
Synonyms CHEBI:284824
InChi InChI=1S/C22H22ClN3O/c1-24-20(13-18-5-3-2-4-6-18)16-27-21-14-19(22(23)26-15-21)8-7-17-9-11-25-12-10-17/h2-12,14-15,20,24H,13,16H2,1H3/b8-7+/t20-/m0/s1
InChiKey UJQGZCZLGBZBNJ-DUIUGDAFSA-N
Formula C22H22ClN3O Molecular Weight 379.88
Cross Link CHEMBL113130
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
 

 

26816 visits since 2014 .........

 



Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


All rights reserved.

   
 
 
Computer-aided Drug Design
about BIDD |  databases |  software |  teaching |  research |  links

 

Department of Computational Science | National University of Singapore | Blk S17, 3 Science Drive 2, Singapore 117543

hdnkeywordtype:MiniFieldStorage('hdnkeywordtype', 'compound'),None, hdnkeywordtype, compound|txtsearch:MiniFieldStorage('txtsearch', 'CFAMM00283177'),None, txtsearch, CFAMM00283177|