Research Article
QSPR Modeling of Fungicides Using Topological Descriptors
Table 8
Statistical parameters used in QSPR model for HM(G).
| Physiochemical property | N | A | b | r | r2 | F | |
| Solubility in water | 11 | ā60.409 | 0.275 | 0.174 | 0.030 | 0.280 | 0.610 | Boiling point | 13 | 393.103 | 0.154 | 0.209 | 0.044 | 0.504 | 0.493 | Density | 13 | 0.749 | 0.001 | 0.634 | 0.402 | 7.385 | 0.020 | Melting point | 13 | 25.196 | 0.138 | 0.161 | 0.026 | 0.293 | 0.599 | Molar mass | 13 | 154.568 | 0.284 | 0.772 | 0.596 | 16.218 | 0.002 | Flash point | 13 | 191.549 | 0.093 | 0.209 | 0.044 | 0.505 | 0.492 | Topological polar surface area | 13 | 17.964 | 0.068 | 0.262 | 0.069 | 0.813 | 0.387 | Heavy atom count | 13 | 8.695 | 0.023 | 0.870 | 0.757 | 34.253 | 0.000 | Complexity | 13 | ā30.761 | 0.701 | 0.795 | 0.633 | 18.934 | 0.001 | Refractive index | 13 | 1.351 | 0.000 | 0.585 | 0.342 | 5.709 | 0.036 |
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