(+)-butaclamol

Ligand id: 62

Name: (+)-butaclamol

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 1
Topological polar surface area 23.47
Molecular weight 361.24
XLogP 7.66
No. Lipinski's rules broken 1

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 Antagonist 8.6 pKi - 1
pKi 8.6 [1]
D2 receptor Antagonist Antagonist 7.5 – 8.7 pKi - 2-4,11
pKi 7.5 – 8.7 [2-4,11]
D5 receptor Antagonist Antagonist 7.6 pKi - 10
pKi 7.6 [10]
D1 receptor Antagonist Antagonist 6.5 – 8.5 pKi - 10,12
pKi 6.5 – 8.5 [10,12]
D3 receptor Antagonist Antagonist 6.7 – 8.0 pKi - 3,8,11
pKi 6.7 – 8.0 [3,8,11]
5-HT1A receptor Antagonist Antagonist 6.4 pKi - 5
pKi 6.4 [5]
D4 receptor Antagonist Antagonist 6.3 pKi - 6
pKi 6.3 [6]
Selectivity at mouse GPCRs
Key to terms and symbols Click column headers to sort
Target Type Action Affinity Units Concentration range (M) Reference
5-HT7 receptor Antagonist Antagonist 7.5 pKi - 7
pKi 7.5 [7]
Selectivity at rat GPCRs
Key to terms and symbols Click column headers to sort
Target Type Action Affinity Units Concentration range (M) Reference
D3 receptor Antagonist Antagonist 7.3 – 7.5 pKi - 2
pKi 7.3 – 7.5 [2]
5-HT7 receptor Antagonist Antagonist 7.0 pKi - 9
pKi 7.0 [9]