Glycoside
GD084869
Name:
NoneFormula:
C18H18O4N8Smiles:
OC[C@H]1O[C@@H](n2cnc3c(Nc4cnn(-c5ccccn5)c4)ncnc32)[C@H](O)[C@@H]1OAglycone:
C1=Nc2c(ncnc2Nc2cnn(-c3ccccn3)c2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.28 |
| AlogP: | -0.24 | Num_rotatable_bonds: | 5 |
| MolWt: | 410.39 | Num_heavy_atoms: | 30 |
| TPSA: | 156.26 | NumAromaticRings: | 4 |
Unique Aglycone
AD37975
Formula: C13H9N8
Smiles:
C1=Nc2c(ncnc2Nc2cnn(-c3ccccn3)c2)[N]1| HBA: | 8 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 1.71 | Num_rotatable_bonds: | 3 |
| MolWt: | 277.27 | Num_heavy_atoms: | 21 |
| TPSA: | 94.98 | NumAromaticRings: | 3 |
