Glycoside
GD084085
Name:
NoneFormula:
C18H24O6N4SSmiles:
Cn1cnnc1CCC(=O)Nc1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)cc1Aglycone:
Cn1cnnc1CCC(=O)Nc1ccc(S)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -0.72 | Num_rotatable_bonds: | 7 |
| MolWt: | 424.48 | Num_heavy_atoms: | 29 |
| TPSA: | 149.96 | NumAromaticRings: | 2 |
Unique Aglycone
AD37526
Formula: C12H14ON4S
Smiles:
Cn1cnnc1CCC(=O)Nc1ccc(S)cc1| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.25 |
| AlogP: | 1.68 | Num_rotatable_bonds: | 4 |
| MolWt: | 262.34 | Num_heavy_atoms: | 18 |
| TPSA: | 59.81 | NumAromaticRings: | 2 |
