Glycoside
GD058742
Name:
NoneFormula:
C15H16O5N4Smiles:
N#Cc1ccccc1-c1cn([C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)nn1Aglycone:
N#Cc1ccccc1C1=C[N]N=N1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.4 |
| AlogP: | -1.21 | Num_rotatable_bonds: | 3 |
| MolWt: | 332.32 | Num_heavy_atoms: | 24 |
| TPSA: | 144.65 | NumAromaticRings: | 2 |
Unique Aglycone
AD29313
Formula: C9H5N4
Smiles:
N#Cc1ccccc1C1=C[N]N=N1| HBA: | 4 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 1.84 | Num_rotatable_bonds: | 1 |
| MolWt: | 169.17 | Num_heavy_atoms: | 13 |
| TPSA: | 62.61 | NumAromaticRings: | 1 |
