Glycoside
GD016860
Name:
NoneFormula:
C19H18O4N4SSmiles:
Nc1ncnc2c1c1cc(-c3ccsc3)ccc1n2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Nc1ncnc2c1-c1cc(-c3ccsc3)ccc1[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.26 |
| AlogP: | 1.51 | Num_rotatable_bonds: | 3 |
| MolWt: | 398.44 | Num_heavy_atoms: | 28 |
| TPSA: | 126.65 | NumAromaticRings: | 4 |
Unique Aglycone
AD12087
Formula: C14H9N4S
Smiles:
Nc1ncnc2c1-c1cc(-c3ccsc3)ccc1[N]2| HBA: | 4 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 3.34 | Num_rotatable_bonds: | 1 |
| MolWt: | 265.32 | Num_heavy_atoms: | 19 |
| TPSA: | 65.9 | NumAromaticRings: | 3 |
