aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD34701 | 1.34 | 215.26 | C12H13ON3 | Cc1cc(C(N)=O)nn1Cc1ccccc1 |
|
AD34702 | 1.2 | 221.26 | C12H15O3N | CC1(COc2ccc(C(N)=O)cc2)COC1 |
|
AD34703 | -0.27 | 214.25 | C8H10O3N2S | CS(=O)(=O)Cc1ncccc1C(N)=O |
|
AD34704 | 0.49 | 237.08 | C5H5O2N2SBr | NS(=O)(=O)c1ccc(Br)cn1 |
|
AD34705 | 0.01 | 236.68 | C8H9O3N2ClS | O=S(=O)(NCCO)c1ccc(Cl)cn1 |
|
AD34706 | 0.49 | 237.08 | C5H5O2N2SBr | NS(=O)(=O)c1cccc(Br)n1 |
|
AD34707 | 1.25 | 215.05 | C7H7ON2Br | Cc1c(Br)ccnc1C(N)=O |
|
AD34708 | 0.15 | 220.23 | C11H12O3N2 | NC(=O)c1ccc(N2CCOCC2=O)cc1 |
|
AD34709 | -0.79 | 244.27 | C9H12O4N2S | CS(=O)(=O)c1cccc(C(=O)NCCO)n1 |
|
AD34710 | 0.1 | 249.26 | C9H12O4NFS | COc1ccc(F)c(S(=O)(=O)NCCO)c1 |