Table 7 Drug-likeness and physicochemical features of analogues (5a-p) via ADMETLab3.0 online server.
Compound | MW | nHA | nHD | nRot | TPSA | LogS | LogP |
|---|---|---|---|---|---|---|---|
5a | 253.09 | 5.0 | 2.0 | 6.0 | 54.88 | -3.617 | 1.712 |
5b | 239.07 | 5.0 | 3.0 | 5.0 | 65.88 | -3.526 | 1.314 |
5c | 207.08 | 3.0 | 2.0 | 4.0 | 36.42 | -4.285 | 2.9 |
5d | 211.05 | 3.0 | 2.0 | 4.0 | 36.42 | -3.88 | 2.49 |
5e | 270.98 | 3.0 | 2.0 | 4.0 | 36.42 | -4.5 | 2.91 |
5f | 238.05 | 6.0 | 2.0 | 5.0 | 79.56 | -4.11 | 1.95 |
5g | 223.08 | 4.0 | 2.0 | 5.0 | 45.65 | -3.88 | 2.16 |
5h | 236.11 | 4.0 | 2.0 | 5.0 | 39.66 | -3.82 | 2.12 |
5i | 242.03 | 6.0 | 2.0 | 5.0 | 79.56 | -4.69 | 2.56 |
5j | 301.95 | 6.0 | 2.0 | 5.0 | 79.56 | -4.61 | 2.78 |
5k | 284.06 | 8.0 | 2.0 | 7.0 | 98.02 | -4.33 | 1.54 |
5l | 238.05 | 6.0 | 2.0 | 5.0 | 79.56 | -4.88 | 2.82 |
5m | 286.09 | 5.0 | 2.0 | 6.0 | 58.54 | -5.07 | 3.53 |
5n | 333.99 | 4.0 | 2.0 | 5.0 | 49.31 | -5.58 | 3.94 |
5o | 316.10 | 6.0 | 2.0 | 7.0 | 67.77 | -4.65 | 2.94 |
5p | 274.07 | 4.0 | 2.0 | 5.0 | 49.31 | -5.19 | 3.61 |
