Glycoside
GD034844
Name:
NoneFormula:
C17H16O5N5F3Smiles:
Nc1ncnc2c1c(-c1ccc(OC(F)(F)F)cc1)nn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Nc1ncnc2c1C(c1ccc(OC(F)(F)F)cc1)=N[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.35 |
| AlogP: | 0.59 | Num_rotatable_bonds: | 4 |
| MolWt: | 427.34 | Num_heavy_atoms: | 30 |
| TPSA: | 148.77 | NumAromaticRings: | 3 |
Unique Aglycone
AD22101
Formula: C12H7ON5F3
Smiles:
Nc1ncnc2c1C(c1ccc(OC(F)(F)F)cc1)=N[N]2| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.08 |
| AlogP: | 1.96 | Num_rotatable_bonds: | 2 |
| MolWt: | 294.22 | Num_heavy_atoms: | 21 |
| TPSA: | 87.49 | NumAromaticRings: | 2 |
