Ligand id: 6155

Name: CP-195543

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 5
Topological polar surface area 66.76
Molecular weight 428.12
XLogP 7.82
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

1. Showell HJ, Conklyn MJ, Alpert R, Hingorani GP, Wright KF, Smith MA, Stam E, Salter ED, Scampoli DN, Meltzer S et al.. (1998)
The preclinical pharmacological profile of the potent and selective leukotriene B4 antagonist CP-195543.
J. Pharmacol. Exp. Ther., 285 (3): 946-54. [PMID:9618393]
2. Yokomizo T, Kato K, Hagiya H, Izumi T, Shimizu T. (2001)
Hydroxyeicosanoids bind to and activate the low affinity leukotriene B4 receptor, BLT2.
J. Biol. Chem., 276 (15): 12454-9. [PMID:11278893]