aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD42571 | 2.76 | 339.76 | C14H9O2N4FClS | Cc1cccc(Cl)c1S(=O)(=O)Nc1ncnc2c1C(F)=C[N]2 |
|
AD42572 | 3.35 | 256.09 | C13H7O2NCl2 | NC(=O)c1ccc(-c2ccc(Cl)c(Cl)c2)o1 |
|
AD42573 | 3.35 | 256.09 | C13H7O2NCl2 | NC(=O)c1ccc(-c2ccc(Cl)cc2Cl)o1 |
|
AD42574 | 3.41 | 239.32 | C16H17ON | CCCc1ccc(-c2ccc(C(N)=O)cc2)cc1 |
|
AD42575 | 3.07 | 225.29 | C15H15ON | Cc1ccc(-c2ccc(C)cc2C(N)=O)cc1 |
|
AD42576 | 0.89 | 290.28 | C11H8O3N5S | O=S(=O)(Nc1ncnc2c1N=C[N]2)c1ccc(O)cc1 |
|
AD42577 | 1.66 | 353.18 | C11H7O2N5SBr | O=S(=O)(Nc1ncnc2c1C=C[N]2)c1ccc(Br)cn1 |
|
AD42578 | 1.32 | 321.35 | C15H15O5NS | O=C(O)c1cccc(-c2ccc(S(=O)(=O)NCCO)cc2)c1 |
|
AD42579 | 1.24 | 309.72 | C11H6O2N6ClS | O=S(=O)(Nc1ncnc2c1N=C[N]2)c1ccc(Cl)cn1 |
|
AD42580 | 2.82 | 300.79 | C12H9O2N2ClS2 | O=S(=O)(Nc1ccc(S)cc1)c1ccc(Cl)cn1 |