Glycoside
GD093170
Name:
NoneFormula:
C18H18O4N5F3Smiles:
OC[C@H]1O[C@@H](n2cnc3c(NCc4ccccc4C(F)(F)F)ncnc32)[C@H](O)[C@@H]1OAglycone:
FC(F)(F)c1ccccc1CNc1ncnc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.39 |
| AlogP: | 1.07 | Num_rotatable_bonds: | 5 |
| MolWt: | 425.37 | Num_heavy_atoms: | 30 |
| TPSA: | 125.55 | NumAromaticRings: | 3 |
Unique Aglycone
AD16698
Formula: C13H9N5F3
Smiles:
FC(F)(F)c1ccccc1CNc1ncnc2c1N=C[N]2| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.15 |
| AlogP: | 3.02 | Num_rotatable_bonds: | 3 |
| MolWt: | 292.24 | Num_heavy_atoms: | 21 |
| TPSA: | 64.27 | NumAromaticRings: | 2 |
