risperidone

Ligand id: 96

Name: risperidone

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 0
Rotatable bonds 4
Topological polar surface area 49.58
Molecular weight 410.21
XLogP 4.01
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
Key to terms and symbols Click column headers to sort
Target Type Action Affinity Units Concentration range (M) Reference
5-HT2A receptor Antagonist Inverse agonist 9.3 – 10.0 pKi - 5,7,14
pKi 9.3 – 10.0 [5,7,14]
D2 receptor Antagonist Antagonist 9.4 pKi - 1
pKi 9.4 (Ki 4.4x10-10 M) [1]
5-HT7 receptor Antagonist Inverse agonist 8.3 – 8.7 pKi - 12,16
pKi 8.3 – 8.7 [12,16]
α1A-adrenoceptor Antagonist Antagonist 8.4 pKi - 17
pKi 8.4 [17]
α1B-adrenoceptor Antagonist Antagonist 8.0 pKi - 17
pKi 8.0 [17]
5-HT1D receptor Antagonist Antagonist 7.8 – 8.0 pKi - 9,14
pKi 7.8 – 8.0 [9,14]
H1 receptor Antagonist Antagonist 7.6 – 7.8 pKi - 7,14
pKi 7.6 – 7.8 [7,14]
5-HT2C receptor Antagonist Inverse agonist 7.5 – 7.6 pKi - 3,7
pKi 7.5 – 7.6 [3,7]
α1D-adrenoceptor Antagonist Antagonist 7.4 pKi - 17
pKi 7.4 [17]
D3 receptor Antagonist Antagonist 7.0 pKi - 10
pKi 7.0 [10]
5-HT1B receptor Antagonist Antagonist 6.6 – 7.3 pKi - 8,14-15
pKi 6.6 – 7.3 [8,14-15]
5-HT1A receptor Antagonist Antagonist 6.4 – 6.5 pKi - 11,14
pKi 6.4 – 6.5 [11,14]
5-ht1e receptor Antagonist Antagonist 5.9 pKi - 14
pKi 5.9 [14]
5-HT1F receptor Antagonist Antagonist 5.9 pKi - 14
pKi 5.9 [14]
5-HT6 receptor Antagonist Antagonist 5.6 pKi - 4
pKi 5.6 [4]
Selectivity at rat GPCRs
Key to terms and symbols Click column headers to sort
Target Type Action Affinity Units Concentration range (M) Reference
5-HT7 receptor Antagonist Inverse agonist 8.9 – 9.0 pKd - 6,13
pKd 8.9 – 9.0 [6,13]
5-HT2A receptor Antagonist Antagonist 8.5 pKi - 2
pKi 8.5 [2]
5-HT1A receptor Antagonist Antagonist 6.2 pKi - 6
pKi 6.2 [6]
5-HT6 receptor Antagonist Inverse agonist 6.0 – 6.4 pKi - 6,13
pKi 6.0 – 6.4 [6,13]