Compd. no | M. Wt g/mol | LogP | TPSA | GI abs | HBA | HBD | nRotb | Violations |
---|---|---|---|---|---|---|---|---|
4a | 230.22 | 0.63 | 76.36 Ǻ2 | high | 4 | 1 | 0 | 0 |
7a | 318.33 | 2.21 | 76.36 Ǻ2 | high | 4 | 1 | 0 | 0 |
7b | 348.36 | 2.22 | 85.59 Ǻ2 | high | 5 | 1 | 2 | 0 |
7c | 352.77 | 2.78 | 76.36 Ǻ2 | high | 4 | 1 | 1 | 0 |
9c | 364.36 | 1.88 | 113.74 Ǻ2 | high | 6 | 2 | 3 | 0 |
15b | 350.33 | 1.68 | 105.82 Ǻ2 | high | 6 | 2 | 2 | 0 |
16a | 336.30 | 1.34 | 124.74 Ǻ2 | high | 6 | 3 | 2 | 0 |
16b | 350.33 | 1.67 | 124.74 Ǻ2 | high | 6 | 3 | 2 | 0 |
16c | 366.33 | 1.30 | 133.97 Ǻ2 | high | 7 | 3 | 3 | 0 |