Glycoside
GD018915
Name:
NoneFormula:
C13H16O4N4S2Smiles:
C=CCSSc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
C=CCSSc1ncnc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.46 |
| AlogP: | 0.36 | Num_rotatable_bonds: | 6 |
| MolWt: | 356.43 | Num_heavy_atoms: | 23 |
| TPSA: | 113.52 | NumAromaticRings: | 2 |
Unique Aglycone
AD13259
Formula: C8H7N4S2
Smiles:
C=CCSSc1ncnc2c1N=C[N]2| HBA: | 4 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.12 |
| AlogP: | 2.31 | Num_rotatable_bonds: | 4 |
| MolWt: | 223.31 | Num_heavy_atoms: | 14 |
| TPSA: | 52.24 | NumAromaticRings: | 1 |
