correolide

Ligand id: 2555

Name: correolide

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 16
Hydrogen bond donors 1
Rotatable bonds 13
Topological polar surface area 216.86
Molecular weight 788.33
XLogP 2.76
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

References
1. Felix JP, Bugianesi RM, Schmalhofer WA, Borris R, Goetz MA, Hensens OD, Bao JM, Kayser F, Parsons WH, Rupprecht K et al.. (1999)
Identification and biochemical characterization of a novel nortriterpene inhibitor of the human lymphocyte voltage-gated potassium channel, Kv1.3.
Biochemistry, 38 (16): 4922-30. [PMID:10213593]