Glycoside
GD013982
Name:
NoneFormula:
C14H13O4N4FSSmiles:
OC[C@@H]1O[C@H](n2cc(F)c3c(-c4nccs4)ncnc32)[C@H](O)[C@H]1OAglycone:
FC1=C[N]c2ncnc(-c3nccs3)c21Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.36 |
| AlogP: | 0.31 | Num_rotatable_bonds: | 3 |
| MolWt: | 352.35 | Num_heavy_atoms: | 24 |
| TPSA: | 113.52 | NumAromaticRings: | 3 |
Unique Aglycone
AD10361
Formula: C9H4N4FS
Smiles:
FC1=C[N]c2ncnc(-c3nccs3)c21| HBA: | 4 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 2.12 | Num_rotatable_bonds: | 1 |
| MolWt: | 219.22 | Num_heavy_atoms: | 15 |
| TPSA: | 52.77 | NumAromaticRings: | 2 |
