Ligand id: 559

Name: salmeterol

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 4
Rotatable bonds 16
Topological polar surface area 81.95
Molecular weight 415.27
XLogP 5.94
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

1. Baker JG. (2010)
The selectivity of beta-adrenoceptor agonists at human beta1-, beta2- and beta3-adrenoceptors.
Br. J. Pharmacol., 160 (5): 1048-61. [PMID:20590599]