QSPR Modeling of Fungicides Using Topological Descriptors

Table 4

Statistical parameters used in QSPR model for RA(G).

Physiochemical property	N	A	b	r	r^2	F
Solubility in water	11	187.306	−9.686	0.067	0.004	0.040	0.846
Boiling point	13	328.548	14.870	0.278	0.077	0.920	0.358
Density	13	0.610	0.069	0.601	0.361	6.218	0.030
Melting point	13	104.598	−0.217	0.003	0.000	0.000	0.991
Molar mass	13	120.460	19.059	0.712	0.506	11.280	0.006
Flash point	13	152.595	8.984	0.278	0.077	0.919	0.358
Topological polar surface area	13	11.439	4.395	0.233	0.054	0.633	0.443
Heavy atom count	13	2.545	1.858	0.981	0.961	274.362	0.000
Complexity	13	−56.575	41.290	0.643	0.414	7.770	0.018
Refractive index	13	1.428	0.018	0.312	0.098	1.190	0.299