DOI

Ligand id: 147

Name: DOI

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 1
Hydrogen bond donors 1
Rotatable bonds 4
Topological polar surface area 44.48
Molecular weight 321.02
XLogP 2.27
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 Agonist Full agonist 7.4 – 9.2 pKi - 3,6,9
pKi 7.4 – 9.2 (Ki 3.98x10-8 – 6.31x10-10 M) [3,6,9]
5-HT2C receptor Agonist Full agonist 7.2 – 8.6 pKi - 4,6-7
pKi 7.2 – 8.6 (Ki 6.31x10-8 – 2.51x10-9 M) [4,6-7]
5-HT2B receptor Agonist Full agonist 7.6 – 7.7 pKi - 5-7
pKi 7.6 – 7.7 (Ki 2.51x10-8 – 1.99x10-8 M) [5-7]
5-HT1F receptor Agonist Full agonist 5.8 pKi - 1
pKi 5.8 [1]
5-ht1e receptor Agonist Full agonist 5.5 – 5.8 pKi - 1-2
pKi 5.5 – 5.8 [1-2]
Selectivity at rat GPCRs
Key to terms and symbols Click column headers to sort
Target Type Action Affinity Units Concentration range (M) Reference
5-HT2B receptor Agonist Full agonist 7.6 pKi - 5,10
pKi 7.6 [5,10]
5-HT2A receptor Agonist Full agonist 7.1 pKi - 8
pKi 7.1 [8]