Glycoside
GD103875
Name:
NoneFormula:
C21H19O6NF2SSmiles:
O=C(C#Cc1ccc(F)cc1F)Nc1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1Aglycone:
O=C(C#Cc1ccc(F)cc1F)Nc1ccc(S)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.29 |
| AlogP: | 0.85 | Num_rotatable_bonds: | 4 |
| MolWt: | 451.45 | Num_heavy_atoms: | 31 |
| TPSA: | 119.25 | NumAromaticRings: | 2 |
Unique Aglycone
AD43912
Formula: C15H9ONF2S
Smiles:
O=C(C#Cc1ccc(F)cc1F)Nc1ccc(S)cc1| HBA: | 2 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 3.24 | Num_rotatable_bonds: | 1 |
| MolWt: | 289.31 | Num_heavy_atoms: | 20 |
| TPSA: | 29.1 | NumAromaticRings: | 2 |
