Glycoside
GD086622
Name:
NoneFormula:
C10H13O6N6SBrSmiles:
NS(=O)(=O)Nc1ncnc2c1nc(Br)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
NS(=O)(=O)Nc1ncnc2c1N=C(Br)[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | -2.18 | Num_rotatable_bonds: | 4 |
| MolWt: | 425.22 | Num_heavy_atoms: | 24 |
| TPSA: | 185.71 | NumAromaticRings: | 2 |
Unique Aglycone
AD38328
Formula: C5H4O2N6SBr
Smiles:
NS(=O)(=O)Nc1ncnc2c1N=C(Br)[N]2| HBA: | 8 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | -0.28 | Num_rotatable_bonds: | 2 |
| MolWt: | 292.1 | Num_heavy_atoms: | 15 |
| TPSA: | 124.43 | NumAromaticRings: | 1 |
