Glycoside
GD022658
Name:
NoneFormula:
C12H14O4N2SSmiles:
OC[C@@H]1O[C@H](Sc2nc3ccccc3[nH]2)[C@H](O)[C@H]1OAglycone:
Sc1nc2ccccc2[nH]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.42 |
| AlogP: | 0.09 | Num_rotatable_bonds: | 3 |
| MolWt: | 282.32 | Num_heavy_atoms: | 19 |
| TPSA: | 98.6 | NumAromaticRings: | 2 |
Unique Aglycone
AD15335
Formula: C7H6N2S
Smiles:
Sc1nc2ccccc2[nH]1| HBA: | 2 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 1.85 | Num_rotatable_bonds: | 0 |
| MolWt: | 150.21 | Num_heavy_atoms: | 10 |
| TPSA: | 28.68 | NumAromaticRings: | 2 |
