Glycoside
GD067989
Name:
NoneFormula:
C11H12O4N5F3SSmiles:
Nc1nc(SC(F)(F)F)nc2c1ncn2[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1OAglycone:
Nc1nc(SC(F)(F)F)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.55 |
| AlogP: | -0.37 | Num_rotatable_bonds: | 3 |
| MolWt: | 367.31 | Num_heavy_atoms: | 24 |
| TPSA: | 139.54 | NumAromaticRings: | 2 |
Unique Aglycone
AD32219
Formula: C6H3N5F3S
Smiles:
Nc1nc(SC(F)(F)F)nc2c1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | 1.58 | Num_rotatable_bonds: | 1 |
| MolWt: | 234.19 | Num_heavy_atoms: | 15 |
| TPSA: | 78.26 | NumAromaticRings: | 1 |
