Glycoside
GD000928
Name:
NoneFormula:
C18H20O4N6Smiles:
NC1=Nc2c(ncn2C2O[C@H](CO)[C@H](O)[C@H]2O)C2=N[C@H](c3ccccc3)CN12Aglycone:
NC1=NC2=C(N=C[N]2)C2=NC(c3ccccc3)CN12Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.39 |
| AlogP: | -0.74 | Num_rotatable_bonds: | 3 |
| MolWt: | 384.4 | Num_heavy_atoms: | 28 |
| TPSA: | 141.72 | NumAromaticRings: | 2 |
Unique Aglycone
AD00972
Formula: C13H11N6
Smiles:
NC1=NC2=C(N=C[N]2)C2=NC(c3ccccc3)CN12| HBA: | 6 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.15 |
| AlogP: | 0.59 | Num_rotatable_bonds: | 1 |
| MolWt: | 251.27 | Num_heavy_atoms: | 19 |
| TPSA: | 80.44 | NumAromaticRings: | 1 |
