Glycoside
GD084011
Name:
NoneFormula:
C16H20O5N5F3Smiles:
C[C@@H]1CO[C@H](C(F)(F)F)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
CC1COC(C(F)(F)F)CN1c1ncnc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.69 |
| AlogP: | -0.41 | Num_rotatable_bonds: | 3 |
| MolWt: | 419.36 | Num_heavy_atoms: | 29 |
| TPSA: | 125.99 | NumAromaticRings: | 2 |
Unique Aglycone
AD37484
Formula: C11H11ON5F3
Smiles:
CC1COC(C(F)(F)F)CN1c1ncnc2c1N=C[N]2| HBA: | 6 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.55 |
| AlogP: | 1.54 | Num_rotatable_bonds: | 1 |
| MolWt: | 286.24 | Num_heavy_atoms: | 20 |
| TPSA: | 64.71 | NumAromaticRings: | 1 |
