Unveiling Neuroprotective Potential of Spice Plant-Derived Compounds against Alzheimer’s Disease: Insights from Computational Studies

Table 2

Pharmacological profile of the top 10 potential candidates for AChE that were derived from SwissADME and admetSAR web server.

	Compounds	MW (g/mol)	Num. of H-bondacceptors	Num. of H-bonddonors	MlogP	Molar refractivity	TPSA (Å^2)	AMES toxicity	Carcinogens	Violation
AChE	Fmoc-His(Trt)-Wang resin	603.71	4	1	4.64	178.48	73.22	None	None	2
	Cucurbitaxanthin A	584.87	3	2	6.15	186.28	49.69	None	None	2
	(3R,3R,15-cis)-b,b-carotene-3,3-diol	568.87	2	2	6.96	186.76	40.46	None	None	2
	Epsilon-carotene	536.87	0	0	8.96	184.43	0	None	None	2
	Quercetin	302.24	7	5	-0.56	78.03	131.36	None	None	0
	Quercetin-3-glucuronide	478.36	13	8	-2.6	110.77	227.58	None	None	2
	Myricetin	318.24	8	6	-1.08	80.06	151.59	None	None	1
	Folic acid	441.4	9	6	-0.62	111.92	213.28	None	None	2
	Quercetin 3-O-glucuronide	478.36	13	8	-2.6	110.77	227.58	None	None	2
	Luteolin	286.24	6	4	-0.03	76.01	111.13	None	None	0