Table 5. The pharmacokinetic profile of compound III and the top predicted hit 1.

Cpd	Mwt	TPSA	LogP	Solubility	BBB permeability	GIT absorption	Lipinski rule violations
III	635.77	183.83	5.02	Poor	No	Low	2
1	436.48	135.28	2.75	Moderate	No	High	0