Ligand id: 7908

Name: encorafenib

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 11
Hydrogen bond donors 3
Rotatable bonds 11
Topological polar surface area 148.51
Molecular weight 539.15
XLogP 2.45
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

1. Stuart DD, Li N, Poon DJ, Aardalen K, Kaufman S, Merritt H, Salangsang F, Lorenzana E, Li A, Ghoddusi M et al.. (2012)
Preclinical profile of LGX818: A potent and selective RAF kinase inhibitor [Abstract]. Proceedings: AACR 103rd Annual Meeting 2012-- Mar 31-Apr 4, 2012; Chicago, IL.
Cancer Research, 72 (8 (Supplement 1)): Abstract 3790.