CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00227405" 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 CFAMM00227405
Family CFFID1096 D(2) dopamine receptor and D(3) dopamine receptor Ligand 4-(4-benzyl-piperazin-1-yl)-5-chloro-1h-indole Family
Superfamily CFSID894 D(2) dopamine receptor and D(3) dopamine receptor Binder Superfamily 3
Class CFCCD303 Class 1116
External ID CHEMBL2218635 External Source CHEMBL
PubChem CID 49838404 Functional Category Bioactive
Molecule Name AGN-PC-088FYQ
IUPAC Name 1-[(2-chloro-4-fluorophenyl)methyl]-4-(1H-indol-4-yl)piperazine-2,3-dione
Synonyms SureCN13076076;1-[(2-chloro-4-fluorophenyl)methyl]-4-(1H-indol-4-yl)piperazine-2,3-dione
InChi InChI=1S/C19H15ClFN3O2/c20-15-10-13(21)5-4-12(15)11-23-8-9-24(19(26)18(23)25)17-3-1-2-16-14(17)6-7-22-16/h1-7,10,22H,8-9,11H2
InChiKey DOBIHUXFEGVSKO-UHFFFAOYSA-N
Formula C19H15ClFN3O2 Molecular Weight 371.79
Cross Link CHEMBL2218635
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
 

 

55287 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', 'CFAMM00227405'),None, txtsearch, CFAMM00227405|