Glycoside
GD045568
Name:
NoneFormula:
C13H20O4N2Smiles:
Cc1cc(N)c(N[C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)cc1CAglycone:
Cc1cc(N)c(N)cc1CSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.54 |
| AlogP: | -0.26 | Num_rotatable_bonds: | 3 |
| MolWt: | 268.31 | Num_heavy_atoms: | 19 |
| TPSA: | 107.97 | NumAromaticRings: | 1 |
Unique Aglycone
AD25268
Formula: C8H12N2
Smiles:
Cc1cc(N)c(N)cc1C| HBA: | 2 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.25 |
| AlogP: | 1.47 | Num_rotatable_bonds: | 0 |
| MolWt: | 136.2 | Num_heavy_atoms: | 10 |
| TPSA: | 52.04 | NumAromaticRings: | 1 |
