Glycoside
GD061031
Name:
NoneFormula:
C14H15O5N3F2Smiles:
OC[C@H]1O[C@H](O)[C@H](n2cc(-c3ccc(F)cc3F)nn2)[C@@H](O)[C@@H]1OAglycone:
Fc1ccc(C2=C[N]N=N2)c(F)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.43 |
| AlogP: | -0.8 | Num_rotatable_bonds: | 3 |
| MolWt: | 343.29 | Num_heavy_atoms: | 24 |
| TPSA: | 120.86 | NumAromaticRings: | 2 |
Unique Aglycone
AD29977
Formula: C8H4N3F2
Smiles:
Fc1ccc(C2=C[N]N=N2)c(F)c1| HBA: | 3 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 2.25 | Num_rotatable_bonds: | 1 |
| MolWt: | 180.14 | Num_heavy_atoms: | 13 |
| TPSA: | 38.82 | NumAromaticRings: | 1 |
