PSB-12062

Ligand id: 9542

Name: PSB-12062

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 0
Rotatable bonds 2
Topological polar surface area 54.99
Molecular weight 337.08
XLogP 5.8
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
10-(4-methylphenyl)sulfonylphenoxazine
Synonyms
10-tosyl-10H-phenoxazine | compound 21 [PMID: 23075067]
Database Links
BindingDB Ligand 50399183
ChEMBL Ligand CHEMBL2180160
PubChem CID 2320735
Search Google for chemical match using the InChIKey DHZNMEIBMACSFH-UHFFFAOYSA-N
Search Google for chemicals with the same backbone DHZNMEIBMACSFH
Search UniChem for chemical match using the InChIKey DHZNMEIBMACSFH-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone DHZNMEIBMACSFH
Comments
PSB-12062 is a P2X4 receptor antagonist with an allosteric mode of action [1].