Glycoside
GD085803
Name:
NoneFormula:
C18H17O5N5F2Smiles:
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4COc5cc(F)cc(F)c54)ncnc32)[C@H](O)[C@@H]1OAglycone:
Fc1cc(F)c2c(c1)OCC2Nc1ncnc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.39 |
| AlogP: | 0.26 | Num_rotatable_bonds: | 4 |
| MolWt: | 421.36 | Num_heavy_atoms: | 30 |
| TPSA: | 134.78 | NumAromaticRings: | 3 |
Unique Aglycone
AD38212
Formula: C13H8ON5F2
Smiles:
Fc1cc(F)c2c(c1)OCC2Nc1ncnc2c1N=C[N]2| HBA: | 6 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.15 |
| AlogP: | 2.21 | Num_rotatable_bonds: | 2 |
| MolWt: | 288.24 | Num_heavy_atoms: | 21 |
| TPSA: | 73.5 | NumAromaticRings: | 2 |
