clonidine

Ligand id: 516

Name: clonidine

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 2
Topological polar surface area 36.42
Molecular weight 229.02
XLogP 2.4
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

References
1. Jasper JR, Lesnick JD, Chang LK, Yamanishi SS, Chang TK, Hsu SAO, Daunt DA, Bonhaus DW, Eglen RM. (1998)
Ligand efficacy and potency at recombinant alpha 2 adrenergic receptors - Agonist-mediated [35S]GTPgammaS binding.
Biochem Pharmacol.55: 1035-1043. [PMID:9605427]
2. Knaus A, Zong X, Beetz N, Jahns R, Lohse MJ, Biel M, Hein L. (2007)
Direct inhibition of cardiac hyperpolarization-activated cyclic nucleotide-gated pacemaker channels by clonidine.
Circulation115 (7): 872-80. [PMID:17261653]
3. Minneman KP, Theroux TL, Hollinger S, Han C, Esbenshade TA. (1994)
Selectivity of agonists for cloned α1-adrenergic receptor subtypes.
Mol. Pharmacol.46: 929-936. [PMID:7969082]
4. Peltonen JM, Pihlavisto M, Scheinin M. (1998)
Subtype-specific stimulation of [35S]GTPgammaS binding by recombinant alpha-2 adrenoceptors.
Eur J Pharmacol.355: 275-279. [PMID:9760042]
5. Pihlavisto M, Sjöholm B, Scheinin M, Wurster S. (1998)
Modulation of agonist binding to recombinant human alpha-2 adrenoceptors by sodium ions.
Biochim Biophys Acta Mol Cell Res.1448: 135-146. [PMID:9824686]
6. Zhang L, Schaner ME, Giacomini KM. (1998)
Functional characterization of an organic cation transporter (hOCT1) in a transiently transfected human cell line (HeLa).
J. Pharmacol. Exp. Ther.286 (1): 354-61. [PMID:9655880]