aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD16161 | 2.14 | 240.25 | C12H10ON5 | COc1ccccc1Nc1ncnc2c1N=C[N]2 |
|
AD16162 | 5.05 | 319.81 | C17H14O2NClS | CCOc1ccc(Cc2ncc(-c3ccco3)s2)c(Cl)c1 |
|
AD16163 | 4.97 | 428.54 | C20H20O3N4S2 | CSc1nc2c(c(=S)[nH]1)C(c1ccc([N+](=O)[O-])cc1)C1=C(CC(C)(C)CC1=O)N2 |
|
AD16164 | 1.38 | 181.15 | C8H7O4N | COC(=O)c1ccc([N+](=O)[O-])cc1 |
|
AD16165 | 3.88 | 288.43 | C19H28O2 | CC12CCC3C(CC=C4CC(O)CCC43C)C1CCC2=O |
|
AD16166 | 0.81 | 234.28 | C10H10ON4S | Nc1ncnc(N)c1[S+]([O-])c1ccccc1 |
|
AD16167 | 1.18 | 196.59 | C9H5O2N2Cl | Cc1cc(Cl)nc2c1C(=O)C(=O)N2 |
|
AD16168 | 1.12 | 245.26 | C12H13O2N4 | CCc1ccc(NC2=N[N]C(C(=O)OC)=N2)cc1 |
|
AD16169 | 3.6 | 283.38 | C15H15N4S | Cc1cc(C)c(CSc2ncnc3c2N=C[N]3)c(C)c1 |
|
AD16170 | -2.01 | 318.33 | C13H22O7N2 | CCOCCCNC(=O)C1=CC(O)C(O)C(OCC(N)=O)O1 |