cisapride

Ligand id: 240

Name: cisapride

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 10
Topological polar surface area 86.05
Molecular weight 465.18
XLogP 2.79
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 GPCRs
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Target Type Action Affinity Units Concentration range (M) Reference
5-HT4 receptor Agonist Partial agonist 6.4 – 7.4 pKi - 2-3,6-8,11
pKi 6.4 – 7.4 [2-3,6-8,11]
Selectivity at human ion channels
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Target Type Action Affinity Units Concentration range (M) Reference
Kv11.1 Channel blocker - 7.4 pIC50 - 10
pIC50 7.4 (IC50 4.45x10-8 M) [10]
Selectivity at mouse GPCRs
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Target Type Action Affinity Units Concentration range (M) Reference
5-HT4 receptor Agonist Full agonist 7.5 pKi - 5
pKi 7.5 [5]
5-HT7 receptor Agonist Full agonist 5.8 pKi - 9
pKi 5.8 [9]
Selectivity at rat GPCRs
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Target Type Action Affinity Units Concentration range (M) Reference
5-HT4 receptor Agonist Partial agonist 6.8 – 8.0 pKi - 1,4
pKi 6.8 – 8.0 [1,4]