Glycoside
GD027673
Name:
NoneFormula:
C15H15O5N4F3SSmiles:
O=C(Nc1nnc([C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)s1)Nc1ccccc1C(F)(F)FAglycone:
O=C(Nc1nncs1)Nc1ccccc1C(F)(F)FSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.4 |
| AlogP: | 1.35 | Num_rotatable_bonds: | 4 |
| MolWt: | 420.37 | Num_heavy_atoms: | 28 |
| TPSA: | 136.83 | NumAromaticRings: | 2 |
Unique Aglycone
AD18156
Formula: C10H7ON4F3S
Smiles:
O=C(Nc1nncs1)Nc1ccccc1C(F)(F)F| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.1 |
| AlogP: | 3.2 | Num_rotatable_bonds: | 2 |
| MolWt: | 288.25 | Num_heavy_atoms: | 19 |
| TPSA: | 66.91 | NumAromaticRings: | 2 |
