Glycoside
GD077760
Name:
NoneFormula:
C19H22O4N6Smiles:
OC[C@H]1O[C@@H](n2cnc3c(N(Cc4ccccn4)C4CC4)ncnc32)[C@H](O)[C@@H]1OAglycone:
C1=Nc2c(ncnc2N(Cc2ccccn2)C2CC2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.47 |
| AlogP: | 0.0 | Num_rotatable_bonds: | 6 |
| MolWt: | 398.42 | Num_heavy_atoms: | 29 |
| TPSA: | 129.65 | NumAromaticRings: | 3 |
Unique Aglycone
AD35607
Formula: C14H13N6
Smiles:
C1=Nc2c(ncnc2N(Cc2ccccn2)C2CC2)[N]1| HBA: | 6 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.29 |
| AlogP: | 1.95 | Num_rotatable_bonds: | 4 |
| MolWt: | 265.3 | Num_heavy_atoms: | 20 |
| TPSA: | 68.37 | NumAromaticRings: | 2 |
