Glycoside
GD060421
Name:
NoneFormula:
C14H15O5N5Smiles:
OC[C@H]1O[C@@H](n2cnc3c(Nc4ccoc4)ncnc32)[C@@H](O)[C@@H]1OAglycone:
C1=Nc2c(ncnc2Nc2ccoc2)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.36 |
| AlogP: | -0.23 | Num_rotatable_bonds: | 4 |
| MolWt: | 333.3 | Num_heavy_atoms: | 24 |
| TPSA: | 138.69 | NumAromaticRings: | 3 |
Unique Aglycone
AD29856
Formula: C9H6ON5
Smiles:
C1=Nc2c(ncnc2Nc2ccoc2)[N]1| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 1.72 | Num_rotatable_bonds: | 2 |
| MolWt: | 200.18 | Num_heavy_atoms: | 15 |
| TPSA: | 77.41 | NumAromaticRings: | 2 |
