Glycoside
GD100682
Name:
NoneFormula:
C20H20O6N4FClSSmiles:
O=S(=O)(CCc1ccc(Cl)cc1)Nc1ncnc2c1c(F)cn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
O=S(=O)(CCc1ccc(Cl)cc1)Nc1ncnc2c1C(F)=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.37 |
| AlogP: | 0.82 | Num_rotatable_bonds: | 7 |
| MolWt: | 486.91 | Num_heavy_atoms: | 32 |
| TPSA: | 146.8 | NumAromaticRings: | 3 |
Unique Aglycone
AD42508
Formula: C15H11O2N4FClS
Smiles:
O=S(=O)(CCc1ccc(Cl)cc1)Nc1ncnc2c1C(F)=C[N]2| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 2.63 | Num_rotatable_bonds: | 5 |
| MolWt: | 353.79 | Num_heavy_atoms: | 23 |
| TPSA: | 86.05 | NumAromaticRings: | 2 |
