Glycoside
GD074719
Name:
NoneFormula:
C18H23O7N2FSmiles:
O=C(N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)[C@@H]1CCCN1C(=O)c1ccc(F)cc1Aglycone:
NC(=O)C1CCCN1C(=O)c1ccc(F)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | -1.65 | Num_rotatable_bonds: | 4 |
| MolWt: | 398.39 | Num_heavy_atoms: | 28 |
| TPSA: | 139.56 | NumAromaticRings: | 1 |
Unique Aglycone
AD34544
Formula: C12H13O2N2F
Smiles:
NC(=O)C1CCCN1C(=O)c1ccc(F)cc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 0.92 | Num_rotatable_bonds: | 2 |
| MolWt: | 236.25 | Num_heavy_atoms: | 17 |
| TPSA: | 63.4 | NumAromaticRings: | 1 |
