Glycoside
GD055995
Name:
NoneFormula:
C13H12O6N2Cl2Smiles:
O=C(Nc1ccnc(Cl)c1Cl)C(=O)[C@H](O)[C@H](O)[C@@H](O)COAglycone:
Nc1ccnc(Cl)c1ClSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.36 |
| AlogP: | -1.03 | Num_rotatable_bonds: | 6 |
| MolWt: | 339.13 | Num_heavy_atoms: | 21 |
| TPSA: | 139.98 | NumAromaticRings: | 1 |
Unique Aglycone
AD28175
Formula: C7H4N2Cl2
Smiles:
Nc1ccnc(Cl)c1Cl| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.97 | Num_rotatable_bonds: | 0 |
| MolWt: | 163.01 | Num_heavy_atoms: | 9 |
| TPSA: | 38.91 | NumAromaticRings: | 1 |
