Hydrotropic Solubilization by Urea Derivatives: A Molecular Dynamics Simulation Study

Table 2

Diffusion coefficients (× 10⁻⁹ m²/s) of HA in water solutions and amorphous states.

Hydrotropic agents		Diffusion coefficient of HA in solutions by simulation	Diffusion coefficient of HA in solution by Wilke-Chang estimation	Diffusion coefficient of HA in amorphous state by simulation
UR	UR + Water; NF + UR + Water	2.018; 1.721	2.395	0.011
MU	MU + Water; NF + MU + Water	0.790; 0.615	1.317	0.005
EU	EU + Water; NF + EU + Water	0.525; 0349	1.125	0.002
BU	BU + Water; NF + BU + Water	0.396; 0.315	0.962	0.002