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. 2018 Jan 15;12:149–158. doi: 10.2147/DDDT.S149973

Table 5.

Rank of selected models

Model Equation R s Fcalc/Ftable Q2 SPRESS
6 qC1, qC2, qC3, u, logP 0.976 0.144 15.920 0.651 0.390
3 qC1, qO10, qC5, qC7, logP 0.886 0.306 2.917 0.022 0.668
5 qC4, qC4a, qC10a, V 0.839 0.321 2.975 0.446 0.710
2 qC1, qC5, qC7, logP 0.827 0.332 2.698 0.139 0.630
1/4 qC2, qC4, qC8a 0.789 0.331 3.303 0.356 0.628

Notes: qCn, net atomic charge on atom C number n; logP, octanol/water partition coefficient; V, molecular volume; u, dipole moment.