Glycoside
GD100300
Name:
NoneFormula:
C19H21O7N2ClS2Smiles:
Cc1cc(Cl)ncc1S(=O)(=O)Nc1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1Aglycone:
Cc1cc(Cl)ncc1S(=O)(=O)Nc1ccc(S)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.39 |
| AlogP: | 0.74 | Num_rotatable_bonds: | 6 |
| MolWt: | 476.96 | Num_heavy_atoms: | 30 |
| TPSA: | 149.21 | NumAromaticRings: | 2 |
Unique Aglycone
AD42382
Formula: C13H11O2N2ClS2
Smiles:
Cc1cc(Cl)ncc1S(=O)(=O)Nc1ccc(S)cc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.08 |
| AlogP: | 3.13 | Num_rotatable_bonds: | 3 |
| MolWt: | 314.82 | Num_heavy_atoms: | 19 |
| TPSA: | 59.06 | NumAromaticRings: | 2 |
