Glycoside
GD068686
Name:
NoneFormula:
C15H19O5N2F3Smiles:
OC[C@H]1O[C@H](O)[C@H](Nc2cc(C3(C(F)(F)F)CC3)ccn2)[C@@H](O)[C@@H]1OAglycone:
Nc1cc(C2(C(F)(F)F)CC2)ccn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.67 |
| AlogP: | -0.11 | Num_rotatable_bonds: | 4 |
| MolWt: | 364.32 | Num_heavy_atoms: | 25 |
| TPSA: | 115.07 | NumAromaticRings: | 1 |
Unique Aglycone
AD32555
Formula: C9H9N2F3
Smiles:
Nc1cc(C2(C(F)(F)F)CC2)ccn1| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.44 |
| AlogP: | 2.26 | Num_rotatable_bonds: | 1 |
| MolWt: | 202.18 | Num_heavy_atoms: | 14 |
| TPSA: | 38.91 | NumAromaticRings: | 1 |
