Table 5.

Summary of drug property predictions of ATP, RTP and top four ZINC candidates obtained from the SwissADME webserver.

Molecule	SILICOS-IT class	GI adsorption	CYP1A2 inhibitor	CYP2C19 inhibitor	CYP2C9 inhibitor	CYP2D6 inhibitor	CYP3A4 inhibitor	Bioavalability score	PAINS alerts
ATP	Soluble	Low	No	No	No	No	No	0.11	0
RDV	Slightly soluble	Low	No	No	No	No	Yes	0.17	0
ZINC097971592	Poorly soluble	High	Yes	No	Yes	No	No	0.56	0
ZINC002146610	Soluble	High	No	No	No	No	No	0.56	0
ZINC069492350	Soluble	Low	No	No	No	No	No	0.11	0
ZINC408592119	Poorly soluble	High	No	Yes	Yes	No	Yes	0.56	0