Glycoside
GD080131
Name:
NoneFormula:
C15H17O7N4FSSmiles:
NC(=O)c1ncn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1NS(=O)(=O)c1ccc(F)cc1Aglycone:
NC(=O)C1=C(NS(=O)(=O)c2ccc(F)cc2)[N]C=N1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.33 |
| AlogP: | -1.47 | Num_rotatable_bonds: | 6 |
| MolWt: | 416.39 | Num_heavy_atoms: | 28 |
| TPSA: | 177.0 | NumAromaticRings: | 2 |
Unique Aglycone
AD36413
Formula: C10H8O3N4FS
Smiles:
NC(=O)C1=C(NS(=O)(=O)c2ccc(F)cc2)[N]C=N1| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | -0.6 | Num_rotatable_bonds: | 4 |
| MolWt: | 283.26 | Num_heavy_atoms: | 19 |
| TPSA: | 115.72 | NumAromaticRings: | 1 |
