CHMFL-KIT-8140

Ligand id: 9301

Name: CHMFL-KIT-8140

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 3
Rotatable bonds 14
Topological polar surface area 114.05
Molecular weight 651.27
XLogP 6.24
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

References
1. Li B, Wang A, Liu J, Qi Z, Liu X, Yu K, Wu H, Chen C, Hu C, Wang W et al.. (2016)
Discovery of N-((1-(4-(3-(3-((6,7-Dimethoxyquinolin-3-yl)oxy)phenyl)ureido)-2-(trifluoromethyl)phenyl)piperidin-4-yl)methyl)propionamide (CHMFL-KIT-8140) as a Highly Potent Type II Inhibitor Capable of Inhibiting the T670I "Gatekeeper" Mutant of cKIT Kinase.
J. Med. Chem.,  [Epub ahead of print]. [PMID:27545040]