Glycoside
GD061101
Name:
NoneFormula:
C13H14O5N2Cl2Smiles:
OC[C@H]1O[C@@H](O)[C@H](Nc2cc(Cl)cc(Cl)n2)[C@@H](O)[C@@H]1OAglycone:
Nc1cc(Cl)cc(Cl)n1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.55 |
| AlogP: | -0.4 | Num_rotatable_bonds: | 3 |
| MolWt: | 325.15 | Num_heavy_atoms: | 20 |
| TPSA: | 115.07 | NumAromaticRings: | 1 |
Unique Aglycone
AD28148
Formula: C7H4N2Cl2
Smiles:
Nc1cc(Cl)cc(Cl)n1| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.97 | Num_rotatable_bonds: | 0 |
| MolWt: | 163.01 | Num_heavy_atoms: | 9 |
| TPSA: | 38.91 | NumAromaticRings: | 1 |
