nimodipine

Ligand id: 2523

Name: nimodipine

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 10
Topological polar surface area 117
Molecular weight 418.17
XLogP 4.6
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
Cav1.1 Gating inhibitor Antagonist ~6.0 pIC50 -
pIC50 ~6.0 (IC50 ~1x10-6 M)
Voltage: -70.0 mV
Cav1.4 Gating inhibitor Antagonist ~6.0 pIC50 -
pIC50 ~6.0 (IC50 ~1x10-6 M)
Voltage: -70.0 mV
CFTR Activator Potentiation - - -
Selectivity at human nuclear hormone receptors
Key to terms and symbols Click column headers to sort
Target Type Action Affinity Units Concentration range (M) Reference
Mineralocorticoid receptor Antagonist Antagonist 6.8 pIC50 - 1
pIC50 6.8 (IC50 1.6x10-7 M) inhibition of aldosterone-induced luciferase activity in a reporter system driven by the mineralocorticoid receptor ligand binding domain [1]
Selectivity at rat ion channels
Key to terms and symbols Click column headers to sort
Target Type Action Affinity Units Concentration range (M) Reference
Cav1.2 Gating inhibitor Antagonist 6.8 pIC50 - 4
pIC50 6.8 [4]
Voltage: -80.0 mV
Cav1.3 Gating inhibitor Antagonist 5.7 – 6.6 pIC50 - 2,4
pIC50 5.7 – 6.6 [2,4]
Voltage: -80.0 – -40.0 mV
Targets where the ligand is described in the comment field
Target Comment