Glycoside

GD096997
Name:
NoneFormula:
C13H15O7N4S2BrSmiles:
NC(=O)c1ncn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1NS(=O)(=O)c1ccc(Br)s1Aglycone:
NC(=O)C1=C(NS(=O)(=O)c2ccc(Br)s2)[N]C=N1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
HBA: | 11 | RingCount: | 3 |
HBD: | 6 | FractionCSP3: | 0.38 |
AlogP: | -0.78 | Num_rotatable_bonds: | 6 |
MolWt: | 483.32 | Num_heavy_atoms: | 27 |
TPSA: | 177.0 | NumAromaticRings: | 2 |
Unique Aglycone
AD41230
Formula: C8H6O3N4S2Br
Smiles:
NC(=O)C1=C(NS(=O)(=O)c2ccc(Br)s2)[N]C=N1HBA: | 7 | RingCount: | 2 |
HBD: | 3 | FractionCSP3: | 0.0 |
AlogP: | 0.09 | Num_rotatable_bonds: | 4 |
MolWt: | 350.2 | Num_heavy_atoms: | 18 |
TPSA: | 115.72 | NumAromaticRings: | 1 |