nafamostat

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

View interactive charts of activity data from ChEMBL and GtoPdb across species (New!)

Selectivity at human ion channels
Key to terms and symbols Click column headers to sort
Target Type Action Affinity Units Concentration range (M) Reference
ASIC3 Channel blocker - ~5.6 pIC50 -
pIC50 ~5.6 (IC50 ~2.5x10-6 M) transient component
ASIC1 Channel blocker - ~4.9 pIC50 -
pIC50 ~4.9 (IC50 ~1.3x10-5 M) ASIC1a
ASIC2 Channel blocker - ~4.2 pIC50 -
pIC50 ~4.2 (IC50 ~7x10-5 M)
TRPM7 Channel blocker Inhibition 3.2 pIC50 - 1
pIC50 3.2 (IC50 6.17x10-4 M) Reversible inhibition, voltage and divalent cation dependent [1]
Voltage: -100.0 – 100.0 mV
Selectivity at human enzymes
Key to terms and symbols Click column headers to sort
Target Type Action Affinity Units Concentration range (M) Reference
tryptase alpha/beta 1 Inhibitor Inhibition 10.0 pIC50 - 3
pIC50 10.0 (IC50 9.53x10-11 M) [3]
protease, serine 1 Inhibitor Inhibition 7.8 pIC50 - 2
pIC50 7.8 (IC50 1.7x10-8 M) [2]
complement C1r Inhibitor Inhibition 4.9 pIC50 - 2
pIC50 4.9 (IC50 1.2x10-5 M) [2]