Glycoside
GD006558
Name:
NoneFormula:
C17H15O5N4F3Smiles:
NC(=O)c1nc(C#Cc2ccc(C(F)(F)F)cc2)n([C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)n1Aglycone:
NC(=O)C1=N[N]C(C#Cc2ccc(C(F)(F)F)cc2)=N1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.35 |
| AlogP: | -0.59 | Num_rotatable_bonds: | 3 |
| MolWt: | 412.32 | Num_heavy_atoms: | 29 |
| TPSA: | 143.72 | NumAromaticRings: | 2 |
Unique Aglycone
AD05418
Formula: C12H6ON4F3
Smiles:
NC(=O)C1=N[N]C(C#Cc2ccc(C(F)(F)F)cc2)=N1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.08 |
| AlogP: | 0.87 | Num_rotatable_bonds: | 1 |
| MolWt: | 279.2 | Num_heavy_atoms: | 20 |
| TPSA: | 81.91 | NumAromaticRings: | 1 |
