Ligand id: 9543

Name: BX-430

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 5
Topological polar surface area 54.02
Molecular weight 410.96
XLogP 4.89
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Ase AR, Honson NS, Zaghdane H, Pfeifer TA, Séguéla P. (2015)
Identification and characterization of a selective allosteric antagonist of human P2X4 receptor channels.
Mol. Pharmacol., 87 (4): 606-16. [PMID:25597706]
2. Jacobson KA, Müller CE. (2016)
Medicinal chemistry of adenosine, P2Y and P2X receptors.
Neuropharmacology, 104: 31-49. [PMID:26686393]
3. North RA, Jarvis MF. (2013)
P2X receptors as drug targets.
Mol. Pharmacol., 83 (4): 759-69. [PMID:23253448]