octopamine

Ligand id: 2149

Name: octopamine

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 3
Rotatable bonds 2
Topological polar surface area 66.48
Molecular weight 153.08
XLogP 0.13
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Natural/Endogenous Targets
Target
TA1 receptor
Selectivity at GPCRs
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Target Sp. Type Action Value Parameter Concentration range (M) Reference
TA1 receptor Rn Agonist Full agonist 5.9 pEC50 - 3
pEC50 5.9 [3]
TA1 receptor Mm Agonist Full agonist 5.4 – 5.8 pEC50 - 4,7
pEC50 5.4 – 5.8 [4,7]
TA1 receptor Hs Agonist Full agonist 4.8 – 5.8 pEC50 - 1-2,4-6
pEC50 4.8 – 5.8 [1-2,4-6]
Additional information and targets (data relate to human unless otherwise stated)
Description Data Reference
Ligand mentioned in the following text fields