aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD41231 | 2.28 | 209.25 | C14H11ON | NC(=O)C1c2ccccc2-c2ccccc21 |
|
AD41232 | 1.95 | 213.32 | C12H23O2N | CC1CCC(C(C)C)C(OCC(N)=O)C1 |
|
AD41233 | 2.48 | 225.29 | C15H15ON | CC(C(N)=O)(c1ccccc1)c1ccccc1 |
|
AD41234 | 1.01 | 317.15 | C8H7O2N5SBr | O=S(=O)(Nc1ncnc2c1N=C(Br)[N]2)C1CC1 |
|
AD41235 | 2.0 | 233.29 | C12H11O2NS | NS(=O)(=O)c1ccccc1-c1ccccc1 |
|
AD41236 | 1.6 | 359.39 | C16H15O4N4S | COC(=O)CCc1ccc(S(=O)(=O)Nc2ncnc3c2C=C[N]3)cc1 |
|
AD41237 | 2.67 | 256.14 | C11H14ONBr | CC(C)C(C(N)=O)c1ccc(Br)cc1 |
|
AD41238 | 0.93 | 330.31 | C13H8O4N5S | O=c1[nH]c2ccc(S(=O)(=O)Nc3ncnc4c3C=C[N]4)cc2o1 |
|
AD41239 | -0.12 | 322.35 | C11H8O3N5S2 | NC(=O)C1=C(NS(=O)(=O)c2ccc3ncsc3c2)[N]C=N1 |
|
AD41240 | 0.05 | 323.35 | C13H15O4N4S | CC(C)Oc1ccc(S(=O)(=O)NC2=C(C(N)=O)N=C[N]2)cc1 |