aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD41211 | 0.57 | 334.16 | C12H7O3N4Cl2S | NC(=O)C1=C(NS(=O)(=O)c2cccc(Cl)c2Cl)[N]C=N1 |
|
AD41212 | 0.63 | 340.19 | C10H5O3N4Cl2S2 | NC(=O)C1=C(NS(=O)(=O)c2cc(Cl)c(Cl)s2)[N]C=N1 |
|
AD41213 | 0.03 | 344.17 | C10H8O3N4SBr | NC(=O)C1=C(NS(=O)(=O)c2ccccc2Br)[N]C=N1 |
|
AD41214 | 2.38 | 211.26 | C14H13ON | NC(=O)Cc1cccc(-c2ccccc2)c1 |
|
AD41215 | 0.57 | 334.16 | C12H7O3N4Cl2S | NC(=O)C1=C(NS(=O)(=O)c2c(Cl)cccc2Cl)[N]C=N1 |
|
AD41216 | 2.61 | 243.23 | C12H12ONF3 | NC(=O)C1(c2ccc(C(F)(F)F)cc2)CCC1 |
|
AD41217 | 1.88 | 215.25 | C13H13O2N | COc1ccc2cccc(CC(N)=O)c2c1 |
|
AD41218 | 0.03 | 344.17 | C10H8O3N4SBr | NC(=O)C1=C(NS(=O)(=O)c2cccc(Br)c2)[N]C=N1 |
|
AD41219 | 1.89 | 301.76 | C12H12O3N3ClS | Cc1nn(C)c(Cl)c1S(=O)(=O)Nc1ccc(O)cc1 |
|
AD41220 | 2.53 | 229.73 | C11H12ONClS | Cc1cc(SCC(N)=O)c(C)cc1Cl |