Ligand Id: 129
Ligand name S33084

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 8
Topological polar surface area 65.36
Molecular weight 451.23
XLogP 7.48
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Summary Biological activity References Structure Similar ligands

Selectivity data from the Guide to Receptors and Channels (GRAC), 5th Edition.

Selectivity at human targets (unless otherwise stated)
Key to terms and symbols Click column headers to sort
Receptor Type Action Affinity Units Concentration range (M) Reference
D3 receptor Antagonist Antagonist 9.6 pKi - 1

Selectivity data from IUPHAR-DB

Selectivity at human GPCRs
Key to terms and symbols Click column headers to sort
Receptor Type Action Affinity Units Concentration range (M) Reference
D3 receptor Antagonist Antagonist 9.6 pKi - 1
5-HT2C receptor Antagonist Antagonist 7.1 pKi - 1
5-HT1D receptor Antagonist Antagonist 6.9 pKi - 1
5-HT2B receptor Antagonist Antagonist 6.8 pKi - 1
5-HT1B receptor Antagonist Antagonist 6.1 pKi - 1
5-HT2A receptor Antagonist Antagonist 6.0 pKi - 1

Please note: The activity data given on this ligand page represents selected literature values and may not include all reported data.
For more details please contact: curators@iuphar-db.org