aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD42551 | 2.07 | 331.38 | C15H15O3N4S | CCc1ccc(OC)c(S(=O)(=O)Nc2ncnc3c2C=C[N]3)c1 |
|
AD42552 | 1.24 | 309.72 | C11H6O2N6ClS | O=S(=O)(Nc1ncnc2c1N=C[N]2)c1cnccc1Cl |
|
AD42553 | 2.82 | 300.79 | C12H9O2N2ClS2 | O=S(=O)(Nc1ccc(S)cc1)c1cnccc1Cl |
|
AD42554 | 2.89 | 227.26 | C14H13O2N | Cc1ccc(Oc2ccccc2C(N)=O)cc1 |
|
AD42555 | 2.11 | 364.79 | C15H11O3N5ClS | CC(=O)Nc1ccc(S(=O)(=O)Nc2ncnc3c2C=C[N]3)c(Cl)c1 |
|
AD42556 | 3.11 | 231.68 | C14H10ONCl | NC(=O)c1ccccc1-c1cccc(Cl)c1 |
|
AD42557 | 2.65 | 338.37 | C16H12O2N5S | Cc1ccc(S(=O)(=O)Nc2ncnc3c2N=C[N]3)c2ccccc12 |
|
AD42558 | 0.77 | 289.3 | C11H9O2N6S | Nc1ccccc1S(=O)(=O)Nc1ncnc2c1N=C[N]2 |
|
AD42559 | 0.99 | 347.4 | C14H11O3N4S2 | NC(=O)C1=C(NS(=O)(=O)c2ccc(-c3cccs3)cc2)[N]C=N1 |
|
AD42560 | 2.92 | 356.41 | C15H10O2N5S2 | O=S(=O)(Nc1ncnc2c1N=C[N]2)c1ccc(-c2cccs2)cc1 |