Ligand id: 480

Name: A61603

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 3
Rotatable bonds 3
Topological polar surface area 99.17
Molecular weight 309.11
XLogP 1.13
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Ford APDW, Daniels DV, Chang DJ, Gever JR, Jasper JR, Lesnick JD, Clarke DE. (1997)
Pharmacological pleiotropism of the human recombinant α1A-adrenoceptor: implications for α1-adrenoceptor classification.
Br. J. Pharmacol., 121: 1127-1135. [PMID:9249248]
2. Knepper SM, Buckner SA, Brune ME, DeBernardis JF, Meyer MD, Hancock AA. (1995)
A-61603, a potent alpha-1-adrenergic receptor agonist, selective for the alpha-1A receptor subtype.
J Pharmacol Exp Ther, 274: 97-103. [PMID:7616455]