Glycoside
GD007938
Name:
NoneFormula:
C18H21O7N2ClS2Smiles:
Cc1nc(NS(=O)(=O)c2ccccc2Cl)sc1C[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
Cc1nc(NS(=O)(=O)c2ccccc2Cl)sc1CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.47 |
| AlogP: | 0.29 | Num_rotatable_bonds: | 6 |
| MolWt: | 464.95 | Num_heavy_atoms: | 29 |
| TPSA: | 149.21 | NumAromaticRings: | 2 |
Unique Aglycone
AD06402
Formula: C12H11O2N2ClS2
Smiles:
Cc1nc(NS(=O)(=O)c2ccccc2Cl)sc1C| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.18 |
| AlogP: | 3.21 | Num_rotatable_bonds: | 3 |
| MolWt: | 302.81 | Num_heavy_atoms: | 18 |
| TPSA: | 59.06 | NumAromaticRings: | 2 |
