Glycoside
GD078130
Name:
NoneFormula:
C18H18O4N6Smiles:
OC[C@H]1O[C@@H](n2cnc3c(Nc4cccc5[nH]ccc45)ncnc32)[C@@H](O)[C@@H]1OAglycone:
C1=Nc2c(ncnc2Nc2cccc3[nH]ccc23)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.28 |
| AlogP: | 0.66 | Num_rotatable_bonds: | 4 |
| MolWt: | 382.38 | Num_heavy_atoms: | 28 |
| TPSA: | 141.34 | NumAromaticRings: | 4 |
Unique Aglycone
AD35824
Formula: C13H9N6
Smiles:
C1=Nc2c(ncnc2Nc2cccc3[nH]ccc23)[N]1| HBA: | 6 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.61 | Num_rotatable_bonds: | 2 |
| MolWt: | 249.26 | Num_heavy_atoms: | 19 |
| TPSA: | 80.06 | NumAromaticRings: | 3 |
