Measurement and Correlation for Solubility of Some Pyrimidine Derivatives in Different Solvents

Table 4

Constants 𝐴, 𝐵, and 𝐶 of (2), ARD and RMSD of pyrimidine derivatives in studied solvents.

Parameters	BKD-1	BKD-2	BKD-3	BKD-4	BKD-5
	Methanol
𝐴	−188.055	−11.7269	−52.2145	−77.6811	49.6358
𝐵	6084.210	−29.1148	1325.46	2035.83	−3161.55
𝐶	28.150	1.2097	7.2786	11.3586	−7.9434
10^5 RMSD	3.5676	0.6605	0.1126	1.0857	6.3598
100 ARD	4.964265	−0.05721	−0.07432	−0.09137	−5.21496
	DMF
𝐴	174.3	345.3	346.99	229.015	280.85
𝐵	−11941.99	−18676.27	−19519.51	−13181.27	−17033.54
𝐶	−24.72	−50.49	−50.43	−33.37	−40.22
10^5 RMSD	9.7924	28.56	11.145	10.602	14.764
100 ARD	−5.08489	−4.31126	−2.85585	−2.1483	−0.58617
	CCl4
𝐴	850.32	392.96	387.99	−136.24	121.48
𝐵	−45868.6	−24351.6	−21792.9	3214.51	−8815.27
𝐶	−123.73	−56.047	−56.61	20.75	−17.44
10^5 RMSD	0.2844	4.3974	3.4608	0.6593	4.9956
100 ARD	−0.19255	−5.97058	−5.53503	0.808956	−7.75314