Glycoside
GD070551
Name:
NoneFormula:
C18H22O4N4Smiles:
O=C([C@@H](O)CO)[C@@H](O)/C(=C\NNc1ccccc1)NNc1ccccc1Aglycone:
C(=CNNc1ccccc1)NNc1ccccc1Sugarmoiety:
O=C(C(O)O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.17 |
| AlogP: | 0.34 | Num_rotatable_bonds: | 10 |
| MolWt: | 358.4 | Num_heavy_atoms: | 26 |
| TPSA: | 125.88 | NumAromaticRings: | 2 |
Unique Aglycone
AD33441
Formula: C14H16N4
Smiles:
C(=CNNc1ccccc1)NNc1ccccc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.0 |
| AlogP: | 2.69 | Num_rotatable_bonds: | 6 |
| MolWt: | 240.31 | Num_heavy_atoms: | 18 |
| TPSA: | 48.12 | NumAromaticRings: | 2 |
