Glycoside
GD021537
Name:
NoneFormula:
C9H12O4N2S2Smiles:
NC(=S)c1csc([C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)n1Aglycone:
NC(=S)c1cscn1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | -1.07 | Num_rotatable_bonds: | 3 |
| MolWt: | 276.34 | Num_heavy_atoms: | 17 |
| TPSA: | 108.83 | NumAromaticRings: | 1 |
Unique Aglycone
AD14716
Formula: C4H4N2S2
Smiles:
NC(=S)c1cscn1| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.78 | Num_rotatable_bonds: | 1 |
| MolWt: | 144.22 | Num_heavy_atoms: | 8 |
| TPSA: | 38.91 | NumAromaticRings: | 1 |
