Ligand id: 1223

Name: clobenpropit

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 7
Topological polar surface area 92.36
Molecular weight 308.09
XLogP 3.01
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Buckland KF, Williams TJ, Conroy DM. (2003)
Histamine induces cytoskeletal changes in human eosinophils via the H(4) receptor.
Br J Pharmacol, 140: 1117-1127. [PMID:14530216]
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Molecular and pharmacological characterization of the mouse histamine H3 receptor.
Eur J Pharmacol, 467: 57-65. [PMID:12706455]
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Genomic organization and characterization of splice variants of the human histamine H3 receptor.
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Two novel and selective nonimidazole histamine H3 receptor antagonists A-304121 and A-317920: I. In vitro pharmacological effects.
J Pharmacol Exp Ther, 305: 887-896. [PMID:12606603]
5. Ligneau X, Morisset S, Tardivel-Lacombe J, Gbahou F, Ganellin CR, Stark H, Schunack W, Schwartz JC, Arrang JM. (2000)
Distinct pharmacology of rat and human histamine H(3) receptors: role of two amino acids in the third transmembrane domain.
Br J Pharmacol, 131: 1247-1250. [PMID:11090094]
6. Lim HD, van Rijn RM, Ling P, Bakker RA, Thurmond RL, Leurs R. (2005)
Evaluation of histamine H1-, H2-, and H3-receptor ligands at the human histamine H4 receptor: identification of 4-methylhistamine as the first potent and selective H4 receptor agonist.
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Cloning and pharmacological characterization of a fourth histamine receptor (H(4)) expressed in bone marrow.
Mol Pharmacol, 59: 420-426. [PMID:11179434]
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Comparison of human, mouse, rat, and guinea pig histamine H4 receptors reveals substantial pharmacological species variation.
J Pharmacol Exp Ther, 299: 121-130. [PMID:11561071]
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The rat H3 receptor: gene organization and multiple isoforms.
Biochem Biophys Res Commun, 280: 75-80. [PMID:11162480]
11. Morse KL, Behan J, Laz TM, West RE, Greenfeder SA, Anthes JC, Umland S, Wan Y, Hipkin RW, Gonsiorek W, Shin N, Gustafson EL, Qiao X, Wang S, Hedrick JA, Greene J, Bayne M, Monsma FJ. (2001)
Cloning and characterization of a novel human histamine receptor.
J Pharmacol Exp Ther, 296: 1058-1066. [PMID:11181941]
12. Wieland K, Bongers G, Yamamoto Y, Hashimoto T, Yamatodani A, Menge WM, Timmerman H, Lovenberg TW, Leurs R. (2001)
Constitutive activity of histamine h(3) receptors stably expressed in SK-N-MC cells: display of agonism and inverse agonism by H(3) antagonists.
J Pharmacol Exp Ther, 299: 908-914. [PMID:11714875]
13. Wulff BS, Hastrup S, Rimvall K. (2002)
Characteristics of recombinantly expressed rat and human histamine H3 receptors.
Eur J Pharmacol, 453: 33-41. [PMID:12393057]