thioridazine

Ligand id: 100

Name: thioridazine

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 4
Topological polar surface area 57.08
Molecular weight 370.15
XLogP 5.63
No. Lipinski's rules broken 1

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-HT6 receptor Rn Antagonist Inverse agonist 8.2 pKi - 7
pKi 8.2 [7]
5-HT2A receptor Hs Antagonist Antagonist 7.4 – 8.0 pKi - 3-4
pKi 7.4 – 8.0 [3-4]
H1 receptor Hs Antagonist Antagonist 7.7 pKi - 4
pKi 7.7 [4]
5-HT2C receptor Hs Antagonist Antagonist 7.2 – 7.3 pKi - 1,4
pKi 7.2 – 7.3 [1,4]
5-HT6 receptor Hs Antagonist Inverse agonist 7.2 pKi - 6
pKi 7.2 [6]
5-HT7 receptor Rn Antagonist Inverse agonist 7.2 pKi - 7
pKi 7.2 [7]
5-HT1A receptor Hs Antagonist Antagonist 7.1 pKi - 5
pKi 7.1 [5]
5-HT7 receptor Hs Antagonist Inverse agonist 7.1 pKi - 6
pKi 7.1 [6]
D1 receptor Hs Antagonist Antagonist 7.0 pKi - 8
pKi 7.0 [8]
D5 receptor Hs Antagonist Antagonist 5.6 pKi - 8
pKi 5.6 [8]
Selectivity at ion channels
Key to terms and symbols Click column headers to sort
Target Sp. Type Action Affinity Units Concentration range (M) Reference
Kir3.2 Mm Gating inhibitor Antagonist 4.2 pEC50 - 2
pEC50 4.2 [2]
Voltage: -70.0 mV