bufotenine

Ligand id: 144

Name: bufotenine

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 2
Rotatable bonds 3
Topological polar surface area 39.26
Molecular weight 204.13
XLogP 1.18
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
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Target Type Action Affinity Units Concentration range (M) Reference
5-HT1D receptor Antagonist Antagonist 7.7 – 8.0 pKi - 3
pKi 7.7 – 8.0 [3]
5-HT2A receptor Antagonist Antagonist 6.8 pKi - 1
pKi 6.8 [1]
Selectivity at mouse GPCRs
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Target Type Action Affinity Units Concentration range (M) Reference
5-HT7 receptor Agonist Full agonist 7.0 pKi - 5
pKi 7.0 [5]
5-HT5A receptor Antagonist Antagonist 5.3 – 6.0 pKi - 4,6
pKi 5.3 – 6.0 [4,6]
Selectivity at rat GPCRs
Key to terms and symbols Click column headers to sort
Target Type Action Affinity Units Concentration range (M) Reference
5-HT6 receptor Antagonist Antagonist 7.0 – 8.4 pKi - 2
pKi 7.0 – 8.4 [2]