Glycoside
GD032213
Name:
NoneFormula:
C12H13O5N4F3Smiles:
OC[C@@H]1O[C@H](n2cnc3c(OCC(F)(F)F)ncnc32)[C@H](O)[C@H]1OAglycone:
FC(F)(F)COc1ncnc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.58 |
| AlogP: | -0.62 | Num_rotatable_bonds: | 4 |
| MolWt: | 350.25 | Num_heavy_atoms: | 24 |
| TPSA: | 122.75 | NumAromaticRings: | 2 |
Unique Aglycone
AD20685
Formula: C7H4ON4F3
Smiles:
FC(F)(F)COc1ncnc2c1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.29 |
| AlogP: | 1.33 | Num_rotatable_bonds: | 2 |
| MolWt: | 217.13 | Num_heavy_atoms: | 15 |
| TPSA: | 61.47 | NumAromaticRings: | 1 |
