Glycoside
GD076771
Name:
N-[(5-{[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl}-3,4-dihydroxyoxolan-2-yl)methyl]methanesulfonamideFormula:
C15H18O6N3FSSmiles:
CS(=O)(=O)NC[C@H]1O[C@@H](Cc2nc(-c3ccc(F)cc3)no2)[C@H](O)[C@@H]1OAglycone:
CNS(C)(=O)=O.Cc1nc(-c2ccc(F)cc2)no1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.47 |
| AlogP: | -0.54 | Num_rotatable_bonds: | 6 |
| MolWt: | 387.39 | Num_heavy_atoms: | 26 |
| TPSA: | 134.78 | NumAromaticRings: | 2 |
Unique Aglycone
AD05521
Formula: C2H7O2NS
Smiles:
CNS(C)(=O)=O| HBA: | 3 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 1.0 |
| AlogP: | -0.83 | Num_rotatable_bonds: | 1 |
| MolWt: | 109.15 | Num_heavy_atoms: | 6 |
| TPSA: | 46.17 | NumAromaticRings: | 0 |
AD21841
Formula: C9H7ON2F
Smiles:
Cc1nc(-c2ccc(F)cc2)no1| HBA: | 3 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.11 |
| AlogP: | 2.18 | Num_rotatable_bonds: | 1 |
| MolWt: | 178.17 | Num_heavy_atoms: | 13 |
| TPSA: | 38.92 | NumAromaticRings: | 2 |
