Glycoside
GD085093
Name:
NoneFormula:
C20H26O6N4Smiles:
O=C([C@H](O)C(=O)[C@H](O)CO)[C@@H](O)[C@@H](CNNc1ccccc1)NNc1ccccc1Aglycone:
c1ccc(NNCCNNc2ccccc2)cc1Sugarmoiety:
O=C(C(O)O)C(O)C(=O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 8 | FractionCSP3: | 0.3 |
| AlogP: | -1.2 | Num_rotatable_bonds: | 13 |
| MolWt: | 418.45 | Num_heavy_atoms: | 30 |
| TPSA: | 163.18 | NumAromaticRings: | 2 |
Unique Aglycone
AD35469
Formula: C14H18N4
Smiles:
c1ccc(NNCCNNc2ccccc2)cc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.14 |
| AlogP: | 2.22 | Num_rotatable_bonds: | 7 |
| MolWt: | 242.33 | Num_heavy_atoms: | 18 |
| TPSA: | 48.12 | NumAromaticRings: | 2 |
