Glycoside
GD009121
Name:
NoneFormula:
C12H16O4N4Smiles:
Nc1cc2c(ccn2[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c(N)n1Aglycone:
Nc1cc2[nH]ccc2c(N)n1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.42 |
| AlogP: | -1.19 | Num_rotatable_bonds: | 2 |
| MolWt: | 280.28 | Num_heavy_atoms: | 20 |
| TPSA: | 139.78 | NumAromaticRings: | 2 |
Unique Aglycone
AD07187
Formula: C7H8N4
Smiles:
Nc1cc2[nH]ccc2c(N)n1| HBA: | 4 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.0 |
| AlogP: | 0.73 | Num_rotatable_bonds: | 0 |
| MolWt: | 148.17 | Num_heavy_atoms: | 11 |
| TPSA: | 80.72 | NumAromaticRings: | 2 |
