Ligand id: 7117

Name: apraclonidine

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 3
Rotatable bonds 2
Topological polar surface area 62.44
Molecular weight 244.03
XLogP 1.37
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Munk SA, Harcourt D, Ambrus G, Denys L, Gluchowski C, Burke JA, Kharlamb AB, Manlapaz CA, Padillo EU, Runde E et al.. (1996)
Synthesis and evaluation of 2-[(5-methylbenz-1-ox-4-azin-6-yl)imino]imidazoline, a potent, peripherally acting alpha 2 adrenoceptor agonist.
J. Med. Chem., 39 (18): 3533-8. [PMID:8784451]