Glycoside
GD010520
Name:
NoneFormula:
C17H13O5N2Cl3Smiles:
NC(=O)c1c(Cl)n(C2O[C@H](CO)[C@H](O)[C@H]2O)c2cc(Cl)c(Cl)cc12Aglycone:
NC(=O)c1c(Cl)[nH]c2cc(Cl)c(Cl)cc12Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.36 |
| AlogP: | 1.31 | Num_rotatable_bonds: | 3 |
| MolWt: | 395.63 | Num_heavy_atoms: | 24 |
| TPSA: | 117.94 | NumAromaticRings: | 2 |
Unique Aglycone
AD08114
Formula: C12H5ON2Cl3
Smiles:
NC(=O)c1c(Cl)[nH]c2cc(Cl)c(Cl)cc12| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 3.23 | Num_rotatable_bonds: | 1 |
| MolWt: | 263.51 | Num_heavy_atoms: | 15 |
| TPSA: | 58.88 | NumAromaticRings: | 2 |
