Glycoside
GD074709
Name:
NoneFormula:
C15H16O7N2Cl2Smiles:
O=C(Cn1cc(Cl)c(=O)c(Cl)c1)N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
NC(=O)Cn1cc(Cl)c(=O)c(Cl)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.54 |
| AlogP: | -1.93 | Num_rotatable_bonds: | 4 |
| MolWt: | 383.18 | Num_heavy_atoms: | 24 |
| TPSA: | 141.25 | NumAromaticRings: | 1 |
Unique Aglycone
AD34538
Formula: C9H6O2N2Cl2
Smiles:
NC(=O)Cn1cc(Cl)c(=O)c(Cl)c1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 0.64 | Num_rotatable_bonds: | 2 |
| MolWt: | 221.04 | Num_heavy_atoms: | 13 |
| TPSA: | 65.09 | NumAromaticRings: | 1 |
