Glycoside
...
GD000407

Name:
None

Formula:
C17H15O3N5FCl

Smiles:
O[C@@H]1[C@@H](n2cnc3c(NCc4cccc(F)c4)nc(Cl)nc32)OC[C@H]1O

Aglycone:
Fc1cccc(CNc2nc(Cl)nc3c2N=C[N]3)c1

Sugarmoiety:
OC1COC(O)C1O

Other Identifiers

Properties
HBA: 8 RingCount: 4
HBD: 3 FractionCSP3: 0.31
AlogP: 1.48 Num_rotatable_bonds: 4
MolWt: 379.78 Num_heavy_atoms: 26
TPSA: 105.32 NumAromaticRings: 3

Unique Aglycone
AD00457
Formula: C13H8N5FCl

Smiles:
Fc1cccc(CNc2nc(Cl)nc3c2N=C[N]3)c1
HBA: 5 RingCount: 3
HBD: 1 FractionCSP3: 0.08
AlogP: 2.79 Num_rotatable_bonds: 3
MolWt: 276.68 Num_heavy_atoms: 19
TPSA: 64.27 NumAromaticRings: 2

Sugarmoiety
SD00161

OC1COC(O)C1O