Glycoside
GD083842
Name:
NoneFormula:
C19H21O7N2FSmiles:
COC(=O)c1ccc(N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)nc1-c1ccc(F)cc1Aglycone:
COC(=O)c1ccc(N)nc1-c1ccc(F)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.37 |
| AlogP: | -0.11 | Num_rotatable_bonds: | 5 |
| MolWt: | 408.38 | Num_heavy_atoms: | 29 |
| TPSA: | 141.37 | NumAromaticRings: | 2 |
Unique Aglycone
AD37375
Formula: C13H11O2N2F
Smiles:
COC(=O)c1ccc(N)nc1-c1ccc(F)cc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.08 |
| AlogP: | 2.26 | Num_rotatable_bonds: | 2 |
| MolWt: | 246.24 | Num_heavy_atoms: | 18 |
| TPSA: | 65.21 | NumAromaticRings: | 2 |
