Glycoside
GD078088
Name:
NoneFormula:
C18H25O5N3SSmiles:
Cc1nn(C)c(C)c1Nc1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)cc1Aglycone:
Cc1nn(C)c(C)c1Nc1ccc(S)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | 0.67 | Num_rotatable_bonds: | 5 |
| MolWt: | 395.48 | Num_heavy_atoms: | 27 |
| TPSA: | 120.0 | NumAromaticRings: | 2 |
Unique Aglycone
AD35784
Formula: C12H15N3S
Smiles:
Cc1nn(C)c(C)c1Nc1ccc(S)cc1| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.25 |
| AlogP: | 3.07 | Num_rotatable_bonds: | 2 |
| MolWt: | 233.34 | Num_heavy_atoms: | 16 |
| TPSA: | 29.85 | NumAromaticRings: | 2 |
