Ligand id: 553

Name: metoprolol

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Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 9
Topological polar surface area 50.72
Molecular weight 267.18
XLogP 1.63
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Selectivity at GPCRs
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Target Sp. Type Action Value Parameter Concentration range (M) Reference
β1-adrenoceptor Hs Antagonist Antagonist 7.0 – 7.6 pKi - 1-4
pKi 7.0 – 7.6 [1-4]
β2-adrenoceptor Hs Antagonist Antagonist 6.3 pKi - 4
pKi 6.3 [4]
Ligand mentioned in the following text fields