Table 3.
Ligand | 2D Structures | Binding Affinity (kcal/mol) | |
---|---|---|---|
AChE | BuChE | ||
Galantamine | −7.7 | −8.7 | |
3-Caffeoylquinic acid | −9.2 | −8.6 | |
Methyl 4-caffeoylquinate | −8.8 | −8.9 | |
Kaempferol-acetyl-glycoside | −8.4 | −10.4 | |
Quercetin 3-rutinoside (Rutin) | −8.3 | −11.0 | |
Quercetin-acetyl-glycoside | −8.0 | −10.4 | |
Kaempferol 3-O-glucoside (Astragalin) | −7.9 | −9.7 | |
Quercetin 3-O-glucoside (Isoquercitrin) | −7.6 | −9.5 |