Glycoside
GD068589
Name:
NoneFormula:
C15H17O5N4ClSmiles:
OC[C@H]1O[C@@H](O)[C@H](Nc2nc(Cl)cc(-n3cccc3)n2)[C@@H](O)[C@@H]1OAglycone:
Nc1nc(Cl)cc(-n2cccc2)n1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.43 |
| AlogP: | -0.87 | Num_rotatable_bonds: | 4 |
| MolWt: | 356.77 | Num_heavy_atoms: | 24 |
| TPSA: | 132.89 | NumAromaticRings: | 2 |
Unique Aglycone
AD32504
Formula: C9H7N4Cl
Smiles:
Nc1nc(Cl)cc(-n2cccc2)n1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.5 | Num_rotatable_bonds: | 1 |
| MolWt: | 194.62 | Num_heavy_atoms: | 13 |
| TPSA: | 56.73 | NumAromaticRings: | 2 |
