Glycoside
GD071358
Name:
NoneFormula:
C13H14O7N2Cl2SSmiles:
O=S(=O)(N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)c1ccc(Cl)nc1ClAglycone:
NS(=O)(=O)c1ccc(Cl)nc1ClSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.55 |
| AlogP: | -1.53 | Num_rotatable_bonds: | 4 |
| MolWt: | 389.21 | Num_heavy_atoms: | 23 |
| TPSA: | 149.21 | NumAromaticRings: | 1 |
Unique Aglycone
AD33568
Formula: C7H4O2N2Cl2S
Smiles:
NS(=O)(=O)c1ccc(Cl)nc1Cl| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.04 | Num_rotatable_bonds: | 1 |
| MolWt: | 227.07 | Num_heavy_atoms: | 12 |
| TPSA: | 73.05 | NumAromaticRings: | 1 |
