Glycoside
GD103308
Name:
NoneFormula:
C20H19O5N5FClSmiles:
C[C@@H](C(=O)Nc1nc(F)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)c1ccccc1ClAglycone:
CC(C(=O)Nc1nc(F)nc2c1N=C[N]2)c1ccccc1ClSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.37 |
| AlogP: | 0.97 | Num_rotatable_bonds: | 5 |
| MolWt: | 451.84 | Num_heavy_atoms: | 31 |
| TPSA: | 142.62 | NumAromaticRings: | 3 |
Unique Aglycone
AD43725
Formula: C15H10ON5FCl
Smiles:
CC(C(=O)Nc1nc(F)nc2c1N=C[N]2)c1ccccc1Cl| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 2.92 | Num_rotatable_bonds: | 3 |
| MolWt: | 318.72 | Num_heavy_atoms: | 22 |
| TPSA: | 81.34 | NumAromaticRings: | 2 |
