CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00429844" 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 CFAMM00429844
Family CFFBM14707 5-hydroxytryptamine receptor 1A ligand AGN-PC-0034EG family
Superfamily CFSBM3541 5-hydroxytryptamine receptor 1A and Neuronal acetylcholine receptor subunit alpha-7 Binder Superfamily
Class CFCCD258 Class 1071
External ID CHEMBL94115 External Source CHEMBL
PubChem CID 14960329 Functional Category Bioactive
Molecule Name AGN-PC-0034EH
IUPAC Name 1-decyl-4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazine
Synonyms CHEBI:251698;Piperazine, 1-decyl-4-(2,3-dihydro-1,4-benzodioxin-5-yl)-
InChi InChI=1S/C22H36N2O2/c1-2-3-4-5-6-7-8-9-13-23-14-16-24(17-15-23)20-11-10-12-21-22(20)26-19-18-25-21/h10-12H,2-9,13-19H2,1H3
InChiKey ZWPCABJDUWYWJX-UHFFFAOYSA-N
Formula C22H36N2O2 Molecular Weight 360.53
Cross Link CHEMBL94115
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
 

 

75740 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', 'CFAMM00429844'),None, txtsearch, CFAMM00429844|