aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD39181 | 1.8 | 302.34 | C13H12O2N5S | Cc1cccc(C)c1S(=O)(=O)Nc1ncnc2c1N=C[N]2 |
|
AD39182 | 1.6 | 280.31 | C12H12O4N2S | COc1ncccc1S(=O)(=O)Nc1ccc(O)cc1 |
|
AD39183 | 0.39 | 307.35 | C13H15O3N4S | CC(C)c1cccc(S(=O)(=O)NC2=C(C(N)=O)N=C[N]2)c1 |
|
AD39184 | 0.23 | 313.75 | C12H10O3N4ClS | Cc1cccc(Cl)c1S(=O)(=O)NC1=C(C(N)=O)N=C[N]1 |
|
AD39185 | 2.09 | 207.27 | C12H17O2N | COc1ccc(C(C)(C)C)cc1C(N)=O |
|
AD39186 | -0.31 | 284.28 | C9H10O4N5S | CCOC(=O)CS(=O)(=O)Nc1ncnc2c1N=C[N]2 |
|
AD39187 | 1.55 | 308.73 | C12H7O2N5ClS | O=S(=O)(Nc1ncnc2c1C=C[N]2)c1ccc(Cl)cn1 |
|
AD39188 | 2.24 | 284.72 | C12H9O3N2ClS | O=S(=O)(Nc1ccc(O)cc1)c1ccc(Cl)cn1 |
|
AD39189 | 1.85 | 198.22 | C12H10ON2 | NC(=O)c1cnccc1-c1ccccc1 |
|
AD39190 | 2.19 | 207.27 | C12H17O2N | Cc1cc(C(N)=O)cc(C)c1OC(C)C |