Glycoside
GD018032
Name:
NoneFormula:
C17H18O4N5FSSmiles:
Nc1nc(SCc2ccccc2F)c2ncn([C@@H]3O[C@H](CO)[C@H](O)[C@H]3O)c2n1Aglycone:
Nc1nc2c(c(SCc3ccccc3F)n1)N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.35 |
| AlogP: | 0.45 | Num_rotatable_bonds: | 5 |
| MolWt: | 407.43 | Num_heavy_atoms: | 28 |
| TPSA: | 139.54 | NumAromaticRings: | 3 |
Unique Aglycone
AD12791
Formula: C12H9N5FS
Smiles:
Nc1nc2c(c(SCc3ccccc3F)n1)N=C[N]2| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.08 |
| AlogP: | 2.4 | Num_rotatable_bonds: | 3 |
| MolWt: | 274.3 | Num_heavy_atoms: | 19 |
| TPSA: | 78.26 | NumAromaticRings: | 2 |
