Glycoside
GD010396
Name:
NoneFormula:
C19H19O5N4ClSmiles:
Cc1nn(C2O[C@H](CO)[C@H](O)[C@H]2O)c2c(=O)n(Cc3ccc(Cl)cc3)cnc12Aglycone:
CC1=N[N]c2c1ncn(Cc1ccc(Cl)cc1)c2=OSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.39 |
| AlogP: | 0.21 | Num_rotatable_bonds: | 4 |
| MolWt: | 406.83 | Num_heavy_atoms: | 28 |
| TPSA: | 122.63 | NumAromaticRings: | 3 |
Unique Aglycone
AD08034
Formula: C14H10ON4Cl
Smiles:
CC1=N[N]c2c1ncn(Cc1ccc(Cl)cc1)c2=O| HBA: | 5 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.15 |
| AlogP: | 1.92 | Num_rotatable_bonds: | 2 |
| MolWt: | 273.7 | Num_heavy_atoms: | 19 |
| TPSA: | 61.35 | NumAromaticRings: | 2 |
