compound 22m [PMID: 19831390]

Ligand id: 8153

Name: compound 22m [PMID: 19831390]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 11
Hydrogen bond donors 4
Rotatable bonds 8
Topological polar surface area 145.56
Molecular weight 461.23
XLogP 2.04
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

1. Harrison BA, Whitlock NA, Voronkov MV, Almstead ZY, Gu KJ, Mabon R, Gardyan M, Hamman BD, Allen J, Gopinathan S et al.. (2009)
Novel class of LIM-kinase 2 inhibitors for the treatment of ocular hypertension and associated glaucoma.
J. Med. Chem., 52 (21): 6515-8. [PMID:19831390]