Ligand id: 3497

Name: CP-481,715

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 4
Rotatable bonds 12
Topological polar surface area 138.43
Molecular weight 482.23
XLogP 3.31
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

1. Gladue RP, Tylaska LA, Brissette WH, Lira PD, Kath JC, Poss CS, Brown MF, Paradis TJ, Conklyn MJ, Ogborne KT et al.. (2003)
CP-481,715, a potent and selective CCR1 antagonist with potential therapeutic implications for inflammatory diseases.
J. Biol. Chem., 278 (42): 40473-80. [PMID:12909630]