Table 3 Physicochemical properties of some designed compounds
S/NO | MF | MW | NRB | HBAcc | HBDon | TPSA | MLogP | MR | Lipinski violations |
|---|---|---|---|---|---|---|---|---|---|
1 | C10H7N3O7 | 281.18 | 3 | 7 | 1 | 149.25 | − 1.63 | 71.15 | 0 |
2 | C10H6N4O9 | 326.18 | 4 | 9 | 1 | 195.07 | − 2.01 | 79.97 | 0 |
5 | C10H8N2O5 | 236.18 | 2 | 5 | 1 | 103.43 | − 0.36 | 62.33 | 0 |
7 | C10H8N2O6 | 252.18 | 2 | 6 | 2 | 123.66 | − 0.88 | 64.35 | 0 |
8 | C10H7N3O9 | 313.18 | 3 | 9 | 3 | 189.71 | − 2.2 | 75.2 | 0 |
16 | C10H8N2O5 | 236.18 | 2 | 5 | 1 | 103.43 | − 0.36 | 62.33 | 0 |
18 | C10H9NO3 | 191.18 | 1 | 3 | 1 | 57.61 | 0.61 | 53.51 | 0 |