Glycoside
GD090812
Name:
NoneFormula:
C20H25O7N2ClSmiles:
O=C(N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)C1CCN(C(=O)c2ccccc2Cl)CC1Aglycone:
NC(=O)C1CCN(C(=O)c2ccccc2Cl)CC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.58 |
| AlogP: | -0.89 | Num_rotatable_bonds: | 4 |
| MolWt: | 428.87 | Num_heavy_atoms: | 29 |
| TPSA: | 139.56 | NumAromaticRings: | 1 |
Unique Aglycone
AD39533
Formula: C14H15O2N2Cl
Smiles:
NC(=O)C1CCN(C(=O)c2ccccc2Cl)CC1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.38 |
| AlogP: | 1.68 | Num_rotatable_bonds: | 2 |
| MolWt: | 266.73 | Num_heavy_atoms: | 18 |
| TPSA: | 63.4 | NumAromaticRings: | 1 |
