spiperone

Ligand id: 99

Name: spiperone

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 6
Topological polar surface area 52.65
Molecular weight 395.2
XLogP 3.64
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 Value Parameter Concentration range (M) Reference
D4 receptor Hs Antagonist Antagonist 9.3 pKi - 3
pKi 9.3 [3]
α1B-adrenoceptor Hs Antagonist Inverse agonist 9.2 pKi - 29
pKi 9.2 [29]
D3 receptor Hs Antagonist Antagonist 9.2 pKi - 23
pKi 9.2 [23]
5-HT2A receptor Rn Antagonist Antagonist 9.0 – 9.2 pKi - 4,21
pKi 9.0 – 9.2 [4,21]
D2 receptor Rn Antagonist Antagonist 8.4 – 9.4 pKi - 12,14,23,25
pKi 8.4 – 9.4 [12,14,23,25]
5-HT2A receptor Hs Antagonist Antagonist 7.8 – 9.4 pKi - 2,9,22
pKi 7.8 – 9.4 [2,9,22]
5-HT1B receptor Mm Antagonist Antagonist 8.3 pKi - 13
pKi 8.3 [13]
α1A-adrenoceptor Hs Antagonist Antagonist 8.3 pKi - 29
pKi 8.3 [29]
α1D-adrenoceptor Hs Antagonist Antagonist 8.1 pKi - 29
pKi 8.1 [29]
5-HT7 receptor Rn Antagonist Antagonist 7.7 – 8.0 pKi - 19-20
pKi 7.7 – 8.0 [19-20]
5-HT1A receptor Hs Antagonist Antagonist 6.7 – 8.8 pKi - 15-17
pKi 6.7 – 8.8 [15-17]
5-HT7 receptor Hs Antagonist Antagonist 7.0 – 8.0 pKi - 1,8,10
pKi 7.0 – 8.0 [1,8,10]
5-HT7 receptor Mm Antagonist Antagonist 7.2 pKi - 18
pKi 7.2 [18]
D1 receptor Hs Antagonist Antagonist 6.7 pKi - 24
pKi 6.7 [24]
5-HT2B receptor Hs Antagonist Antagonist 5.9 – 6.5 pKi - 9,11,27
pKi 5.9 – 6.5 [9,11,27]
5-HT2C receptor Hs Antagonist Antagonist 5.6 – 6.2 pKi - 5,7,9
pKi 5.6 – 6.2 [5,7,9]
5-HT6 receptor Rn Antagonist Antagonist 5.8 pKi - 19
pKi 5.8 [19]
5-HT1D receptor Hs Antagonist Antagonist 5.5 – 6.0 pKi - 6,28
pKi 5.5 – 6.0 [6,28]
5-HT2B receptor Rn Antagonist Antagonist 5.5 pKi - 26
pKi 5.5 [26]
D5 receptor Hs Antagonist Antagonist 5.3 pKi - 24
pKi 5.3 [24]