loxapine

Ligand id: 205

Name: loxapine

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 0
Rotatable bonds 1
Topological polar surface area 28.07
Molecular weight 327.11
XLogP 4.31
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
H1 receptor Hs Antagonist Antagonist 8.2 pKi - 4
pKi 8.2 [4]
D2 receptor Hs Antagonist Antagonist 7.9 – 8.3 pKi - 4,9
pKi 7.9 – 8.3 (Ki 1.2x10-8 – 5x10-9 M) [4,9]
D4 receptor Hs Antagonist Antagonist 8.1 pKi - 9
pKi 8.1 (Ki 7.8x10-9 M) [9]
5-HT2A receptor Hs Antagonist Inverse agonist 8.1 pKi - 4
pKi 8.1 [4]
5-HT2C receptor Hs Antagonist Inverse agonist 7.8 – 8.0 pKi - 2,4
pKi 7.8 – 8.0 [2,4]
D3 receptor Hs Antagonist Antagonist 7.7 pKi - 8
pKi 7.7 (Ki 2.1x10-8 M) [8]
5-HT6 receptor Hs Antagonist Inverse agonist 7.4 – 7.6 pKi - 3,6
pKi 7.4 – 7.6 [3,6]
5-HT6 receptor Rn Antagonist Inverse agonist 7.2 – 7.8 pKi - 5,7
pKi 7.2 – 7.8 [5,7]
5-HT7 receptor Rn Antagonist Antagonist 6.8 – 7.4 pKi - 7,10
pKi 6.8 – 7.4 [7,10]
Selectivity at ion channels
Key to terms and symbols Click column headers to sort
Target Sp. Type Action Affinity Units Concentration range (M) Reference
KNa1.1 Hs Activator Agonist 5.4 pEC50 - 1
pEC50 5.4 (EC50 4.4x10-6 M) [1]