Glycoside
GD083985
Name:
NoneFormula:
C18H20O5N6Smiles:
NC(=O)c1ncn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1Nc1cnn(-c2ccccc2)c1Aglycone:
NC(=O)C1=C(Nc2cnn(-c3ccccc3)c2)[N]C=N1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.28 |
| AlogP: | -0.48 | Num_rotatable_bonds: | 6 |
| MolWt: | 400.4 | Num_heavy_atoms: | 29 |
| TPSA: | 160.68 | NumAromaticRings: | 3 |
Unique Aglycone
AD37464
Formula: C13H11ON6
Smiles:
NC(=O)C1=C(Nc2cnn(-c3ccccc3)c2)[N]C=N1| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 0.58 | Num_rotatable_bonds: | 4 |
| MolWt: | 267.27 | Num_heavy_atoms: | 20 |
| TPSA: | 99.4 | NumAromaticRings: | 2 |
