vilazodone

Ligand id: 7427

Name: vilazodone

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 7
Topological polar surface area 102.29
Molecular weight 441.22
XLogP 2.71
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

View interactive charts of activity data from GtoPdb and ChEMBL (where available) across species

Selectivity at GPCRs
Key to terms and symbols Click column headers to sort
Target Sp. Type Action Affinity Units Concentration range (M) Reference
5-HT1A receptor Hs Agonist Partial agonist 9.7 pKi - 1
pKi 9.7 (Ki 2x10-10 M) [1]
Description: Binding of vilazodone to human 5-HT1A receptors against [3H]8-OH-DPAT (DPAT)
5-HT1A receptor Hs Agonist Partial agonist 9.5 pIC50 - 2
pIC50 9.5 (IC50 3x10-10 M) [2]
D3 receptor Hs Agonist Agonist 7.2 pIC50 - 2
pIC50 7.2 (IC50 7.1x10-8 M) [2]
5-HT4 receptor Hs Agonist Agonist 6.6 pIC50 - 2
pIC50 6.6 (IC50 2.52x10-7 M) [2]
H1 receptor Hs Agonist Agonist 6.5 pIC50 - 2
pIC50 6.5 (IC50 3.17x10-7 M) [2]
D2 receptor Hs Agonist Agonist 6.2 pIC50 - 2
pIC50 6.2 (IC50 6.66x10-7 M) [2]
Selectivity at transporters
Key to terms and symbols Click column headers to sort
Target Sp. Type Action Affinity Units Concentration range (M) Reference
SERT Hs Inhibitor Inhibition 8.8 – 9.3 pIC50 - 1-2
pIC50 8.8 – 9.3 (IC50 1.58x10-9 – 5x10-10 M) [1-2]