Glycoside
GD052271
Name:
NoneFormula:
C14H17O5N2FSmiles:
N#CCc1cc(F)cc(N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)c1Aglycone:
N#CCc1cc(N)cc(F)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -0.9 | Num_rotatable_bonds: | 4 |
| MolWt: | 312.3 | Num_heavy_atoms: | 22 |
| TPSA: | 125.97 | NumAromaticRings: | 1 |
Unique Aglycone
AD27130
Formula: C8H7N2F
Smiles:
N#CCc1cc(N)cc(F)c1| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | 1.47 | Num_rotatable_bonds: | 1 |
| MolWt: | 150.16 | Num_heavy_atoms: | 11 |
| TPSA: | 49.81 | NumAromaticRings: | 1 |
