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. 2021 Oct 5;2021:6480381. doi: 10.1155/2021/6480381

Table 4.

Lowest binding energy of 6 components of HQSJZD docked with AChE.

Mol ID Compound name CAS number MW Inhibition (%) against AChE AChE docking score (Kcal/mol)
ZINC597013 Donepezil 120014-06-4 379.5 90.18 −11.62
MOL000098 Quercetin 117-39-5 302.25 −4.63 −8.38
MOL000422 Kaempferol 520-18-3 286.25 −14.88 −7.98
MOL000392 Formononetin 485-72-3 268.28 60.15 −8.71
MOL000439 Isorhamnetin 480-19-3 316.28 6.35 −8.1
MOL000296 Hederagenin 465-99-6 472.70 45.72 −12.47
MOL000417 Calycosin 20575-57-9 284.26 9.53 −8.68