Glycoside
GD031654
Name:
NoneFormula:
C13H16O4N4SSmiles:
C=CCSc1ncnc2c1cnn2C1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
C=CCSc1ncnc2c1C=N[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.46 |
| AlogP: | -0.28 | Num_rotatable_bonds: | 5 |
| MolWt: | 324.36 | Num_heavy_atoms: | 22 |
| TPSA: | 113.52 | NumAromaticRings: | 2 |
Unique Aglycone
AD20371
Formula: C8H7N4S
Smiles:
C=CCSc1ncnc2c1C=N[N]2| HBA: | 4 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.12 |
| AlogP: | 1.34 | Num_rotatable_bonds: | 3 |
| MolWt: | 191.24 | Num_heavy_atoms: | 13 |
| TPSA: | 52.24 | NumAromaticRings: | 1 |
