Glycoside
GD078226
Name:
NoneFormula:
C17H15O4N5FClSmiles:
OC[C@H]1O[C@@H](n2cnc3c(Nc4cc(Cl)ccc4F)ncnc32)[C@H](O)[C@@H]1OAglycone:
Fc1ccc(Cl)cc1Nc1ncnc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.31 |
| AlogP: | 0.97 | Num_rotatable_bonds: | 4 |
| MolWt: | 395.78 | Num_heavy_atoms: | 27 |
| TPSA: | 125.55 | NumAromaticRings: | 3 |
Unique Aglycone
AD35882
Formula: C12H6N5FCl
Smiles:
Fc1ccc(Cl)cc1Nc1ncnc2c1N=C[N]2| HBA: | 5 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 2.92 | Num_rotatable_bonds: | 2 |
| MolWt: | 262.66 | Num_heavy_atoms: | 18 |
| TPSA: | 64.27 | NumAromaticRings: | 2 |
