Glycoside
GD082255
Name:
NoneFormula:
C18H24O7N2F2Smiles:
CCN(CC)C(=O)c1c(F)ccc(F)c1C(=O)N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
CCN(CC)C(=O)c1c(F)ccc(F)c1C(N)=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | -1.02 | Num_rotatable_bonds: | 6 |
| MolWt: | 418.39 | Num_heavy_atoms: | 29 |
| TPSA: | 139.56 | NumAromaticRings: | 1 |
Unique Aglycone
AD36939
Formula: C12H14O2N2F2
Smiles:
CCN(CC)C(=O)c1c(F)ccc(F)c1C(N)=O| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 1.55 | Num_rotatable_bonds: | 4 |
| MolWt: | 256.25 | Num_heavy_atoms: | 18 |
| TPSA: | 63.4 | NumAromaticRings: | 1 |
