Table 1.

Physicochemical and Pharmacokinetic parameters of PQS

Parameters	PQS
TPSA (A2)	183.61
n-ROTB	7
Mol. Wt	468.51
Molar Vol	119.48
Log P	1.06
n-HB donor	2
n-HB acceptor	8
Lipinski’s violation	0
GI absorption	Low
CYP1A2 inhibitor	No
CYP3A4 inhibitor	Yes
Log Kp (skin permeation)	−8.42 cm/s
Bioavailability score	0.55
PAINS	0 alert
Synthetic accessibility	3.27