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. 2025 Jan 4;19(1):4. doi: 10.1186/s13065-024-01371-4

Table 12.

Molecular docking data for Human Histamin H1 Receptor

Compounds ΔG (kcal/mol) H bond interaction Hydrofobic Interaction Electrostatic interaction
Desloratadine − 7.2 VAL71, LEU149, TRP152
Levocetirizine − 7.1 TYR158, PRO161, ILE197
Fexofenadine − 8.9 PHE116, PHE119, ILE120, ILE123, ALA151, PRO202
CAPE − 5.6 TYR210 LEU207, ALA211, TYR214 MET421
Quercetin − 6.6 GLU181, TYR1850 TRP93, CYS100, ARG175, CYS180 ARG97
Melatonin − 6.2 GLY164, TRP165, ASP183 VAL187, PHE190
Curcumin − 6.1 TRP152 LEU149, TRP152, PHE153
Vitamin C − 4.8 GLY164