Table 3.

The predicted binding energy of tested compounds 6a–6c at the PAS site.

Compounds	IC50 AChE (µM) HuAChE	Predicted Binding Energy in PAS (kcal/mol)
6a	0.74 ± 0.5	−5.68
6b	1.31 ± 0.2	−7.35
6c	0.077 ± 0.01	−6.32
Thioflavin T		−8.29