Table 5.
Drug likeness properties of selected ligands.
| Ligand | MW | HBA | HBD | AlogP | logP | TPSA | nRB |
|---|---|---|---|---|---|---|---|
| Myricitrin | 464.1 | 12 | 8 | −3.398 | −3.398 | 206.6 | 3 |
| Quercetin 3-O-glucuronide | 478.07 | 13 | 8 | −3.232 | −3.232 | 223.67 | 4 |
| Kaempferol 3-O-glucuronide | 462.08 | 12 | 7 | −2.669 | −2.669 | 203.44 | 4 |
| Astragalin | 448.1 | 11 | 7 | −2.771 | −2.771 | 186.37 | 4 |
| Ellagic Acid-O-Arabinoside | 407.94 | 6 | 0 | −3.089 | −3.089 | 71.06 | 2 |
| Kaempferol-3-O-rutinoside | 594.16 | 15 | 9 | −4.018 | −4.018 | 245.29 | 6 |
| Isocorilagin | 634.08 | 18 | 11 | −3.242 | −3.242 | 310.66 | 3 |
| Furosin | 650.08 | 19 | 10 | −4.172 | −4.172 | 316.73 | 4 |
| Trigalloylglucose | 636.1 | 18 | 11 | −2.85 | −2.85 | 310.66 | 10 |
| Phyllanthusiin B | 964.05 | 28 | 11 | −4.599 | −4.599 | 406.63 | 6 |