Glycoside
GD055352
Name:
NoneFormula:
C13H14O6N2FClSmiles:
O=C(NCc1cc(F)cnc1Cl)C(=O)[C@H](O)[C@@H](O)[C@@H](O)COAglycone:
NCc1cc(F)cnc1ClSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.42 |
| AlogP: | -1.87 | Num_rotatable_bonds: | 7 |
| MolWt: | 336.7 | Num_heavy_atoms: | 22 |
| TPSA: | 139.98 | NumAromaticRings: | 1 |
Unique Aglycone
AD28029
Formula: C7H6N2FCl
Smiles:
NCc1cc(F)cnc1Cl| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | 1.33 | Num_rotatable_bonds: | 1 |
| MolWt: | 160.58 | Num_heavy_atoms: | 10 |
| TPSA: | 38.91 | NumAromaticRings: | 1 |
