Glycoside
GD064862
Name:
NoneFormula:
C13H17O5N5F2Smiles:
OC[C@H]1O[C@@H](n2cnc3c(NCC(F)(F)CO)ncnc32)[C@H](O)[C@@H]1OAglycone:
OCC(F)(F)CNc1ncnc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.62 |
| AlogP: | -1.52 | Num_rotatable_bonds: | 6 |
| MolWt: | 361.31 | Num_heavy_atoms: | 25 |
| TPSA: | 145.78 | NumAromaticRings: | 2 |
Unique Aglycone
AD31214
Formula: C8H8ON5F2
Smiles:
OCC(F)(F)CNc1ncnc2c1N=C[N]2| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.38 |
| AlogP: | 0.43 | Num_rotatable_bonds: | 4 |
| MolWt: | 228.18 | Num_heavy_atoms: | 16 |
| TPSA: | 84.5 | NumAromaticRings: | 1 |
