Ligand id: 534

Name: denopamine

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 8
Topological polar surface area 70.95
Molecular weight 317.16
XLogP 1.95
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Isogaya M, Sugimoto Y, Tanimura R, Tanaka R, Kikkawa H, Nagao T, Kurose H. (1999)
Binding pockets of the beta(1)- and beta(2)-adrenergic receptors for subtype-selective agonists.
Mol. Pharmacol., 56 (5): 875-85. [PMID:10531390]
2. Suzuki T, Nantel F, Bonin H, Valiquette M, Bouvier M. (1993)
Cellular characterization of the pharmacological selectivity and tachyphylactic properties of denopamine for the human beta adrenergic receptors.
J. Pharmacol. Exp. Ther., 267 (2): 785-90. [PMID:7902433]