Glycoside
GD069189
Name:
NoneFormula:
C16H18O6N2SSmiles:
O=C(N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)c1nc(-c2ccccc2)cs1Aglycone:
NC(=O)c1nc(-c2ccccc2)cs1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | -0.66 | Num_rotatable_bonds: | 4 |
| MolWt: | 366.4 | Num_heavy_atoms: | 25 |
| TPSA: | 132.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD32822
Formula: C10H8ON2S
Smiles:
NC(=O)c1nc(-c2ccccc2)cs1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.91 | Num_rotatable_bonds: | 2 |
| MolWt: | 204.25 | Num_heavy_atoms: | 14 |
| TPSA: | 55.98 | NumAromaticRings: | 2 |
