[Retracted] Computer-Aided Prediction and Identification of Phytochemicals as Potential Drug Candidates against MERS-CoV

Table 2

Pharmacokinetic parameters important for bioavailability of compounds’ drug-likeness properties of selected phytochemicals.

Sr. no.	Ligand	Mass (<500 D)	HBD (≤5)	HBA (≤10)	Log (<5)	Molar refractivity (40-130)	Violations
1	Rosavin	428	6	10	2.75	101.31	1
2	Betaxanthin	358	2	6	1.71	84.39	0
3	Quercetin	302	5	7	0.52	64.36	0
4	Citromitin	404	0	8	3.56	99.23	0
5	Pluviatilol	356	1	6	3.10	90.31	0
6	Ichangin	488	1	9	4.54	125.39	0
7	Digitogenin	448	3	5	6.06	140.22	2
8	Methyl deacetylnomilinate	504	2	9	4.81	128.66	1
9	Kobusinol A	374	2	6	3.07	97.76	0
10	Cyclocalamin	502	1	9	4.90	130.08	1

HBD: hydrogen bond donors; HBA: hydrogen bond acceptors; log : the logarithm of octanol/water partition coefficient.