Glycoside
GD055315
Name:
NoneFormula:
C13H16O6N2F2Smiles:
O=C(NCC(F)(F)c1ccccn1)C(=O)[C@H](O)[C@H](O)[C@H](O)COAglycone:
NCC(F)(F)c1ccccn1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.46 |
| AlogP: | -2.07 | Num_rotatable_bonds: | 8 |
| MolWt: | 334.28 | Num_heavy_atoms: | 23 |
| TPSA: | 139.98 | NumAromaticRings: | 1 |
Unique Aglycone
AD28019
Formula: C7H8N2F2
Smiles:
NCC(F)(F)c1ccccn1| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.29 |
| AlogP: | 1.13 | Num_rotatable_bonds: | 2 |
| MolWt: | 158.15 | Num_heavy_atoms: | 11 |
| TPSA: | 38.91 | NumAromaticRings: | 1 |
