Ligand id: 4262

Name: nafamostat

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 4
Rotatable bonds 5
Topological polar surface area 140.57
Molecular weight 347.14
XLogP 4.23
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Chen X, Numata T, Li M, Mori Y, Orser BA, Jackson MF, Xiong ZG, MacDonald JF. (2010)
The modulation of TRPM7 currents by nafamostat mesilate depends directly upon extracellular concentrations of divalent cations.
Mol Brain, 3: 38. [PMID:21122141]
2. Hays SJ, Caprathe BW, Gilmore JL, Amin N, Emmerling MR, Michael W, Nadimpalli R, Nath R, Raser KJ, Stafford D et al.. (1998)
2-amino-4H-3,1-benzoxazin-4-ones as inhibitors of C1r serine protease.
J. Med. Chem., 41 (7): 1060-7. [PMID:9544206]
3. Mori S, Itoh Y, Shinohata R, Sendo T, Oishi R, Nishibori M. (2003)
Nafamostat mesilate is an extremely potent inhibitor of human tryptase.
J. Pharmacol. Sci., 92 (4): 420-3. [PMID:12939527]