aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD00031 | 2.63 | 163.18 | C9H9O2N | C=C(C)c1cccc([N+](=O)[O-])c1 |
|
AD00032 | -1.89 | 260.24 | C11H16O7 | COC(=O)C1=COC(O)C2C1C(O)C(O)C2(C)O |
|
AD00033 | 5.51 | 281.48 | C18H35ON | CCCCCCCCC=CCCCCCCCC(N)=O |
|
AD00034 | -0.65 | 98.08 | H2O4S | O=S(=O)(O)O |
|
AD00035 | 2.77 | 232.31 | C12H18N5 | CCCCCCCNc1ncnc2c1N=C[N]2 |
|
AD00036 | -1.16 | 111.12 | CH5O3NS | COS(N)(=O)=O |
|
AD00037 | 1.9 | 240.11 | C9H7O2NCl2S | CNS(=O)(=O)c1cccc(Cl)c1Cl |
|
AD00038 | 1.5 | 161.61 | C6H4ONClS | NC(=O)c1ccc(Cl)s1 |
|
AD00039 | 3.42 | 211.31 | C15H17N | CCc1ccc(Cc2ccccc2N)cc1 |
|
AD00040 | 3.94 | 393.38 | C19H24O6NP | COc1ccc(OP(=O)(NC(C)(C)C(=O)OCc2ccccc2)OC)cc1 |