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. 2021 Jan 23;9(1):14. doi: 10.1007/s40203-020-00067-6

Table 2.

Physicochemical properties of alkaloids with remarkable binding energy with acetylcholinesterase, butyrylcholinesterase, and β-site amyloid precursor protein cleaving enzyme-1

S/N Compounds Molecular weight H-bond acceptor H-bond donor MLogP Lipinski’s violations
S Donepezil 379.49 4 0 3.06 0
S Elenbecestat 437.44 8 2 1.54 0
1 Genistin 432.38 10 6 − 1.61 1
2 Naphthalen-2-yl-acetic acid, 6-hydroxy-6-methyl-cyclodecyl ester 354.48 3 1 4.02 0
3 Naringin 580.53 14 8 − 2.77 3
4 Orientin 448.38 11 8 − 2.51 2
5 Vitexin 432.38 10 7 − 2.02 1

MLOGP cctanol/water partition coefficient