adriforant

Ligand id: 8985

Name: adriforant

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 3
Rotatable bonds 5
Topological polar surface area 79.1
Molecular weight 262.19
XLogP 1.61
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

References
1. Ehling S, Roßbach K, Dunston SM, Stark H, Bäumer W. (2016)
Allergic inflammation is augmented via histamine H4 receptor activation: The role of natural killer cells in vitro and in vivo.
J. Dermatol. Sci., 83 (2): 106-15. [PMID:27155791]
2. Panula P, Chazot PL, Cowart M, Gutzmer R, Leurs R, Liu WL, Stark H, Thurmond RL, Haas HL. (2015)
International Union of Basic and Clinical Pharmacology. XCVIII. Histamine Receptors.
Pharmacol. Rev., 67 (3): 601-55. [PMID:26084539]
3. Werfel T, Layton G, Yeadon M, Whitlock L, Osterloh I, Jimenez P, Liu W, Lynch V, Asher A, Tsianakas A et al.. (2019)
Efficacy and safety of the histamine H4 receptor antagonist ZPL-3893787 in patients with atopic dermatitis.
J. Allergy Clin. Immunol., 143 (5): 1830-1837.e4. [PMID:30414855]