Glycoside
GD023593
Name:
NoneFormula:
C11H14O4N5FSSmiles:
C[S+]([O-])C[C@@H]1O[C@H](n2cnc3c(N)nc(F)nc32)[C@H](O)[C@H]1OAglycone:
Nc1nc(F)nc2c1N=C[N]2Sugarmoiety:
C[S+](O)CC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.55 |
| AlogP: | -1.45 | Num_rotatable_bonds: | 3 |
| MolWt: | 331.33 | Num_heavy_atoms: | 22 |
| TPSA: | 142.37 | NumAromaticRings: | 2 |
Unique Aglycone
AD00084
Formula: C5H3N5F
Smiles:
Nc1nc(F)nc2c1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.11 | Num_rotatable_bonds: | 0 |
| MolWt: | 152.11 | Num_heavy_atoms: | 11 |
| TPSA: | 78.26 | NumAromaticRings: | 1 |
