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Table 3 Docking results based on the LigScore1, LigScore2, PLP1, PLP2, Jain, PMF and Dock Score of the compounds 1, 2 and 3 into the α-glucosidase enzyme (PDB: 1UOK)

From: Target guided isolation, in-vitro antidiabetic, antioxidant activity and molecular docking studies of some flavonoids from Albizzia Lebbeck Benth. bark

S. no. Compound LigScore1 LigScore2 PLP1 PLP2 JAIN PMF Dock score Internal energy (kcal/mol)
1 4′,7-Dihydroxy-3′-methoxyflavone (Compound 1) 4.03 3.43 48.65 49.25 2.1 125.25 61.18 -3.53
2 3′,4′,7,8-tetrahydroxyflavanone (Compound 2) 4.08 4.19 43.78 49.02 1.03 86.89 68.86 -3.189
3 Luteolin (Compound 3) 4.7 4.47 43.67 47.4 -0.15 94.85 66.91 -2.423