Glycoside
GD069437
Name:
NoneFormula:
C16H15O6N2ClSmiles:
O=C(Nc1cnc2cc(Cl)ccc2c1)C(=O)[C@H](O)[C@H](O)[C@@H](O)COAglycone:
Nc1cnc2cc(Cl)ccc2c1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.27 |
| AlogP: | -0.53 | Num_rotatable_bonds: | 6 |
| MolWt: | 354.75 | Num_heavy_atoms: | 24 |
| TPSA: | 139.98 | NumAromaticRings: | 2 |
Unique Aglycone
AD32954
Formula: C10H7N2Cl
Smiles:
Nc1cnc2cc(Cl)ccc2c1| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.47 | Num_rotatable_bonds: | 0 |
| MolWt: | 178.62 | Num_heavy_atoms: | 12 |
| TPSA: | 38.91 | NumAromaticRings: | 2 |
