compound 13 [PMID: 19456099]

Ligand id: 3127

Name: compound 13 [PMID: 19456099]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 3
Rotatable bonds 9
Topological polar surface area 105.67
Molecular weight 377.14
XLogP 3.45
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Song Y, Liu CI, Lin FY, No JH, Hensler M, Liu YL, Jeng WY, Low J, Liu GY, Nizet V et al.. (2009)
Inhibition of staphyloxanthin virulence factor biosynthesis in Staphylococcus aureus: in vitro, in vivo, and crystallographic results.
J. Med. Chem., 52 (13): 3869-80. [PMID:19456099]