. 2021 Dec 23;37:100820. doi: 10.1016/j.cdc.2021.100820

Table 5.

Estimated properties of compounds based on stepwise regression method (STRM) and simultaneous regression method (SIRM).

Property	Units	Baricitinib				Camostat			Chloroquine			Dexamethasone			Favipiravir
Property	Units	STRM		SIRM	[47]	STRM	SIRM	[49]	STRM	SIRM	[50]	STRM	SIRM	[51]	STRM	SIRM	[52]
$T_{b}$	[K]	794.469		760.077		757.482	771.300		688.550	682.652		722.347	717.264		618.948	688.871
$T_{c}$	[K]	997.035		973.995		934.420	949.155		907.967	907.964		905.005	905.004		815.160	815.158
$P_{c}$	[bar]	0.076		0.091		0.140	0.145		0.152	0.147		0.100	0.109		0.063	0.064
$V_{c}$	[cc/mol]	58.885		903.061		1381.063	1410.628		1196.016	1175.118		−1061.953	1080.050		299.645	326.270
$T_{m}$	[K]	492.478		458.127	487.15	453.792	468.250	467.15	393.375	385.545	363.15	467.128	462.022	524.15	465.514	497.056	450.15
$G_{f}$	[kJ/mol]	632.951		395.881		−122.228	−121.518		737.893	757.660		−536.591	−574.299		−187.165	−173.038
$H_{f}$	[kJ/mol]	223.416		107.378		−706.079	−634.774		145.400	259.584		−1054.777	−994.887		−385.972	−417.504
$H_{f u s}$	[kJ/mol]	100.855		49.657		66.271	66.260		70.036	51.288		32.559	33.055		53.974	46.568
$\log K w_{0}$		0.5811		2.32		5.4578	3.6913		5.463	6.0219		1.743	1.844		−0.867	−2.097
$F_{P}$	[K]	–		607.007		–	150.022		570.936	552.786		723.751	736.511		–	–
$H_{V}$	[kJ/mol]	–		118.800		–	10.433		149.382	154.790		184.173	182.672		118.959	124.073
$H_{V b}$	[kJ/mol]	–		–		–	–		–	–		143.507	144.740		–	–
$S_{V b}$	[kJ/mol]	–		–		–	–		–	–		204.871	207.947		–	–
$δ$	[MPa^1/2]	27.197		27.445		23.924	26.165		14.350	16.843		27.291	26.661		27.886	27.635
$ω$		0.013		−0.002		0.023	–		0.013	−0.001		0.024	0.018		0.015	−0.001
$V_{m}$	[cc/kmol]	0.251		0.301		0.507	–		0.333	0.333		0.278	0.462		0.134	0.129
Property	Units		Fingolimod			Hydroxychloroquine			Thalidomide				Umifenovir
Property	Units		STRM	SIRM	[53]	STRM	SIRM	[55]	STRM	SIRM	[57]		STRM		SIRM		[58]
$T_{b}$	[K]		687.396	689.003		681.390	714.345		648.734	650.895			776.060		772.496
$T_{c}$	[K]		848.840	848.839		909.231	920.028		936.906	931.518			973.718		973.718
$P_{c}$	[bar]		0.106	0.115		1.335	0.142		2.419	0.069			0.142		0.146
$V_{c}$	[cc/mol]		1058.116	1069.218		865.489	1199.529		566.423	575.560			1292.282		–
$T_{m}$	[K]		398.693	396.310	400.15	417.170	414.588	367.1	441.490	440.390	543.15		447.213		448.603		415
$G_{f}$	[kJ/mol]		−21.235	−2.948		346.872	595.810		−229.399	−255.484			171.261		–
$H_{f}$	[kJ/mol]		−478.253	−448.244		−63.171	45.765		−456.385	−446.716			−397.082		–
$H_{f u s}$	[kJ/mol]		48.469	46.357		58.150	55.237		23.906	32.053			70.472		–
$\log K w_{0}$			4.532	4.064		3.2266	4.6854		0.0915	0.3946			6.251		6.1162
$F_{P}$	[K]		615.936	616.728		594.016	640.443		567.197	570.199			–		–
$H_{V}$	[kJ/mol]		162.707	162.094		144.748	178.760		147.419	152.094			–		–
$H_{V b}$	[kJ/mol]		98.831	–		–	–		99.785	159.024			–		–
$S_{V b}$	[kJ/mol]		134.617	–		–	–		168.272	181.299			–		–
$δ$	[MPa^1/2]		28.506	29.829		18.645	19.895		23.247	27.758			21.665		–
$ω$			0.022	–		0.013	–		0.011	−0.002			0.019		−0.013
$V_{m}$	[cc/kmol]		0.360	0.294		14.941	0.337		0.168	0.160			0.419		−1.453