UNC0006

Ligand id: 7651

Name: UNC0006

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 7
Topological polar surface area 44.81
Molecular weight 461.16
XLogP 4.36
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
7-{4-[4-(2,3-dichlorophenyl)-1,4-diazepan-1-yl]butoxy}-1,2,3,4-tetrahydroquinolin-2-one
Database Links
ChEMBL Ligand CHEMBL2165126
PubChem CID 56597938
Search Google for chemical match using the InChIKey NGCKUAWDNUFNBB-UHFFFAOYSA-N
Search Google for chemicals with the same backbone NGCKUAWDNUFNBB
Search UniChem for chemical match using the InChIKey NGCKUAWDNUFNBB-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone NGCKUAWDNUFNBB
Comments
UNC0006 is an analog of aripiprazole and is a β-arrestin–biased dopamine D2 receptor ligand [1]