CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00314864" 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 CFAMM00314864
Family CFFBM740 Sodium-dependent serotonin transporter and D(2) dopamine receptor ligand AGN-PC-07ZFK2 family
Superfamily CFSBM434 D(2) dopamine receptor and Renin Binder Superfamily
Class CFCBM168 Class 3218
External ID CHEMBL1087818 External Source CHEMBL
PubChem CID 46889016 Functional Category Bioactive
Molecule Name AGN-PC-07ZFJE
IUPAC Name N-[3-[2-[8-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)methyl]-3-azabicyclo[3.2.1]octan-3-yl]ethoxy]phenyl]methanesulfonamide
Synonyms CHEBI:729186;N-[3-[2-[8-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)methyl]-3-azabicyclo[3.2.1]octan-3-yl]ethoxy]phenyl]methanesulfonamide
InChi InChI=1S/C26H33N3O4S/c1-34(31,32)28-22-3-2-4-23(15-22)33-12-11-29-16-20-7-8-21(17-29)24(20)13-18-5-6-19-9-10-26(30)27-25(19)14-18/h2-6,14-15,20-21,24,28H,7-13,16-17H2,1H3,(H,27,30)
InChiKey YOOMBGFSQWGFNO-UHFFFAOYSA-N
Formula C26H33N3O4S Molecular Weight 483.62
Cross Link CHEMBL1087818
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
 

 

27036 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', 'CFAMM00314864'),None, txtsearch, CFAMM00314864|