Synthesis, Characterization, and Pharmacokinetic Studies of Thiazolidine-2,4-Dione Derivatives

Table 5

Drug likeness and medicinal chemistry of TZDs derivatives.

Ligands	Drug likeness rules					Medicinal chemistry
	Lipinski	Ghose	Veber	Egan	Muegge	PAINS	Brenk	Lead likeness	Synthetic accessibility
C1	Yes	No; 1 violation WLOGP <−0.4	Yes	Yes	Yes	0 alert	2 alerts: michael_1, thioester	Yes	3.29
C2	Yes	Yes	Yes	Yes	Yes	0 alert	2 alerts: michael_acceptor_1, thioester	No; 1 violation: MW > 350	3.40
C3	Yes	No; 2 violations: MW > 480,; MR > 130	No; 1 violation: TPSA >140	No; 1 violation: TPSA >131.6	Yes	0 alert	2 alerts: michael_acceptor_1, thioester	No; 1 violation: MW > 350	3.84
C4	Yes	Yes	Yes	Yes	Yes	0 alert	2 alerts: michael_acceptor_1, thioester	Yes	3.21
C5	Yes	Yes	Yes	Yes	Yes	0 alert	2 alerts: michael_acceptor_1, thioester	Yes	3.16