Glycoside
...
GD078083

Name:
None

Formula:
C17H19O5N2FS

Smiles:
OC[C@@H]1O[C@@H](Sc2ccc(Nc3cncc(F)c3)cc2)[C@@H](O)[C@H](O)[C@H]1O

Aglycone:
Fc1cncc(Nc2ccc(S)cc2)c1

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 7 RingCount: 3
HBD: 5 FractionCSP3: 0.35
AlogP: 0.86 Num_rotatable_bonds: 5
MolWt: 382.41 Num_heavy_atoms: 26
TPSA: 115.07 NumAromaticRings: 2

Unique Aglycone
AD35795
Formula: C11H9N2FS

Smiles:
Fc1cncc(Nc2ccc(S)cc2)c1
HBA: 2 RingCount: 2
HBD: 1 FractionCSP3: 0.0
AlogP: 3.25 Num_rotatable_bonds: 2
MolWt: 220.27 Num_heavy_atoms: 15
TPSA: 24.92 NumAromaticRings: 2

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O