TABLE 3.
Drug-likeness features of the compounds determined using the QikProp.
| Code # | #Rotor | CNS | Dipole | SASA | FOSA | FISA | PISA | WPSA | Volume | HBD | HBA | RO5/RO3 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|
| (8) | 2 | 0 | 6.46 | 651.22 | 122.38 | 81.98 | 296.47 | 150.39 | 1148.87 | 0 | 7 | 0/0 |
| (9) | 4 | −1 | 8.22 | 706.02 | 303.31 | 93.18 | 253.09 | 56.45 | 1282.21 | 0 | 8.5 | 0/0 |
| (10) | 2 | 0 | 4.72 | 649.50 | 117.66 | 94.99 | 332.05 | 104.80 | 1150.02 | 0 | 7 | 0/0 |
| (11) | 3 | −2 | 2.82 | 687.35 | 129.86 | 180.20 | 321.32 | 55.97 | 1214.53 | 0 | 8 | 0/0 |
| (12) | 2 | −1 | 6.11 | 637.33 | 129.14 | 107.55 | 344.68 | 55.96 | 1125.62 | 0 | 8.5 | 0/0 |
| (13) | 2 | −1 | 4.37 | 623.85 | 303.64 | 69.58 | 194.66 | 55.96 | 1120.87 | 0 | 9.2 | 0/0 |
| (14) | 2 | 0 | 7.16 | 688.86 | 117.68 | 74.40 | 440.07 | 56.71 | 1253.95 | 0 | 7 | 0/0 |