Glycoside
GD100771
Name:
NoneFormula:
C19H21O6N4FSSmiles:
Cc1cccc(C)c1S(=O)(=O)Nc1ncnc2c1c(F)cn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
Cc1cccc(C)c1S(=O)(=O)Nc1ncnc2c1C(F)=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.37 |
| AlogP: | 0.6 | Num_rotatable_bonds: | 5 |
| MolWt: | 452.46 | Num_heavy_atoms: | 31 |
| TPSA: | 146.8 | NumAromaticRings: | 3 |
Unique Aglycone
AD42564
Formula: C14H12O2N4FS
Smiles:
Cc1cccc(C)c1S(=O)(=O)Nc1ncnc2c1C(F)=C[N]2| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 2.41 | Num_rotatable_bonds: | 3 |
| MolWt: | 319.34 | Num_heavy_atoms: | 22 |
| TPSA: | 86.05 | NumAromaticRings: | 2 |
