AZD9056

Ligand id: 7826

Name: AZD9056

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 3
Rotatable bonds 11
Topological polar surface area 61.36
Molecular weight 418.24
XLogP 5.48
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
N-(1-adamantylmethyl)-2-chloro-5-[3-(3-hydroxypropylamino)propyl]benzamide
Synonyms
AZD 9056 | AZD-9056
Database Links
CAS Registry No. 345304-65-6 (source: Scifinder)
GtoPdb PubChem SID 223366157
PubChem CID 10161381
Search Google for chemical match using the InChIKey HSQAARMBHJCUOK-UHFFFAOYSA-N
Search Google for chemicals with the same backbone HSQAARMBHJCUOK
Search UniChem for chemical match using the InChIKey HSQAARMBHJCUOK-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone HSQAARMBHJCUOK
Comments
AZD9056 is a potent, selective, orally bioavailable P2X7 receptor antagonist.
This compound was in the AstraZeneca/NCATS repurposing list from 2012.