Phytochemicals Analysis, In Vitro Antibacterial Activities of Extracts, and Molecular Docking Studies of the Isolated Compounds from Melhania zavattarii Cufod Leaves

Table 7

ADME property of isolated compounds 1 and 2 predicted by PreADMET software.

Compounds	Chemical formula	LogKp (cm/s)	GI absorption	BBB permeability	Inhibitor interaction (swiss ADME/PreADMET)
					P-gp substrate	CYP1A2 inhibitor	CYP2C19 inhibitor	CYP2C9 inhibitor	CYP2D6 inhibitor	CYP3A4 inhibitor
1	C46H80O2	1.75	Low	No	Yes	No	No	No	No	No
2	C40H56O2	1.75	Low	No	Yes	No	No	No	No	No
Chloramphenicol	C11H12Cl2N2O5	−7.46	High	No	No	No	No	No	No	No

Note. LogKp = skin permeation value, GI = gastro-intestinal, BBB = blood brain barrier, P-gp = P-glycoprotein, and CYP = cytochrome P.