Glycoside
GD049889
Name:
NoneFormula:
C13H16O5N4Smiles:
OC[C@H]1O[C@@H](O)[C@H](Nc2ncnc3cnccc23)[C@@H](O)[C@@H]1OAglycone:
Nc1ncnc2cnccc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.46 |
| AlogP: | -1.76 | Num_rotatable_bonds: | 3 |
| MolWt: | 308.29 | Num_heavy_atoms: | 22 |
| TPSA: | 140.85 | NumAromaticRings: | 2 |
Unique Aglycone
AD26376
Formula: C7H6N4
Smiles:
Nc1ncnc2cnccc12| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.61 | Num_rotatable_bonds: | 0 |
| MolWt: | 146.15 | Num_heavy_atoms: | 11 |
| TPSA: | 64.69 | NumAromaticRings: | 2 |
