isoprenaline

Ligand id: 536

Name: isoprenaline

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 4
Rotatable bonds 4
Topological polar surface area 72.72
Molecular weight 211.12
XLogP 0.81
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
β1-adrenoceptor Agonist Full agonist 6.6 – 7.0 pKi - 1,6
pKi 6.6 – 7.0 [1,6]
β2-adrenoceptor Agonist Full agonist 6.4 pKi - 6
pKi 6.4 [6]
β3-adrenoceptor Agonist Full agonist 5.1 – 6.2 pKi - 2-7
pKi 5.1 – 6.2 [2-7]
Selectivity at mouse GPCRs
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Target Type Action Affinity Units Concentration range (M) Reference
β3-adrenoceptor Agonist Full agonist 4.2 – 5.3 pKi - 3,5
pKi 4.2 – 5.3 [3,5]
Selectivity at rat GPCRs
Key to terms and symbols Click column headers to sort
Target Type Action Affinity Units Concentration range (M) Reference
β3-adrenoceptor Agonist Full agonist 5.3 pKi - 3
pKi 5.3 [3]