Table 4 Physicochemical properties of synthesized compounds
Entry | MWa | LogPb | HBDc | HBAd | TPSA (A2) e | n-RBf | Lipinski violation |
|---|---|---|---|---|---|---|---|
7a | 443.95 | 4.81 | 0 | 3 | 38.13 | 5 | 0 |
7b | 427.51 | 4.71 | 0 | 4 | 38.13 | 5 | 0 |
7c | 469.57 | 3.37 | 0 | 5 | 56.59 | 7 | 0 |
7d | 477.52 | 5.11 | 0 | 6 | 38.13 | 6 | 0 |
7e | 427.51 | 4.71 | 0 | 4 | 38.13 | 5 | 0 |
7f | 443.97 | 4.81 | 0 | 3 | 38.13 | 5 | 0 |
7g | 501.62 | 5.4 | 0 | 4 | 47.36 | 7 | 0 |
7h | 457.99 | 5.01 | 0 | 3 | 38.13 | 5 | 2 |
Rule of Lipinski | ≤ 500 | ≤ 5 | ≤ 5 | ≤ 10 | ≤ 140 | ≤ 10 | ≤ 1 |