cabergoline

Ligand id: 37

Name: cabergoline

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 2
Rotatable bonds 11
Topological polar surface area 67.92
Molecular weight 451.29
XLogP 3.04
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
D2 receptor Hs Agonist Partial agonist 9.0 – 9.2 pKi - 1
pKi 9.0 – 9.2 [1]
D3 receptor Hs Agonist Partial agonist 9.1 pKi - 1
pKi 9.1 [1]
5-HT2B receptor Hs Agonist Full agonist 8.9 pKi - 1
pKi 8.9 [1]
5-HT2A receptor Hs Agonist Full agonist 8.2 pKi - 1
pKi 8.2 [1]
5-HT1D receptor Hs Agonist Partial agonist 8.1 pKi - 1
pKi 8.1 [1]
α2A-adrenoceptor Hs Antagonist Antagonist 7.9 pKi - 1
pKi 7.9 [1]
5-HT1A receptor Hs Agonist Full agonist 7.7 pKi - 1
pKi 7.7 [1]
α2C-adrenoceptor Hs Antagonist Antagonist 7.7 pKi - 1
pKi 7.7 [1]
D5 receptor Hs Agonist Full agonist 7.7 pKi - 1
pKi 7.7 [1]
D4 receptor Hs Agonist Partial agonist 7.3 pKi - 1
pKi 7.3 [1]
α2B-adrenoceptor Hs Antagonist Antagonist 7.1 pKi - 1
pKi 7.1 [1]
D1 receptor Hs Agonist Full agonist 6.7 pKi - 1
pKi 6.7 [1]
α1A-adrenoceptor Hs Antagonist Antagonist 6.5 pKi - 1
pKi 6.5 [1]
5-HT1B receptor Hs Agonist Full agonist 6.3 pKi - 1
pKi 6.3 [1]
5-HT2C receptor Hs Agonist Full agonist 6.2 pKi - 1
pKi 6.2 [1]
Ligand mentioned in the following text fields