Glycoside
GD102177
Name:
NoneFormula:
C23H26O6N4SSmiles:
O=C(Cc1cn(Cc2ccccc2)nn1)Nc1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)cc1Aglycone:
O=C(Cc1cn(Cc2ccccc2)nn1)Nc1ccc(S)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.35 |
| AlogP: | 0.4 | Num_rotatable_bonds: | 8 |
| MolWt: | 486.55 | Num_heavy_atoms: | 34 |
| TPSA: | 149.96 | NumAromaticRings: | 3 |
Unique Aglycone
AD43239
Formula: C17H16ON4S
Smiles:
O=C(Cc1cn(Cc2ccccc2)nn1)Nc1ccc(S)cc1| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.12 |
| AlogP: | 2.8 | Num_rotatable_bonds: | 5 |
| MolWt: | 324.41 | Num_heavy_atoms: | 23 |
| TPSA: | 59.81 | NumAromaticRings: | 3 |
