5-BDBD

Ligand id: 9541

Name: 5-BDBD

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 1
Topological polar surface area 54.6
Molecular weight 354
XLogP 3.65
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
5-(3-bromophenyl)-1,3-dihydro-[1]benzofuro[3,2-e][1,4]diazepin-2-one
Database Links
BindingDB Ligand 50399207
ChEMBL Ligand CHEMBL2180179
PubChem CID 9841560
Search Google for chemical match using the InChIKey NKYMVQPXXTZHSF-UHFFFAOYSA-N
Search Google for chemicals with the same backbone NKYMVQPXXTZHSF
Search UniChem for chemical match using the InChIKey NKYMVQPXXTZHSF-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone NKYMVQPXXTZHSF
Comments
5-BDBD is a potent P2X4 receptor antagonist [1-2].