aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD39871 | 0.15 | 291.28 | C14H14O3N3F | O=C(NCCO)c1nccn(Cc2ccc(F)cc2)c1=O |
|
AD39872 | 2.0 | 278.11 | C11H8ON3Br | NC(=O)c1nc(-c2ccccc2)ncc1Br |
|
AD39873 | 0.98 | 295.34 | C15H21O5N | COc1cc(C(=O)NCCO)ccc1OC1CCOCC1 |
|
AD39874 | 1.96 | 269.02 | C7H4ON2F3Br | NC(=O)c1cnc(Br)c(C(F)(F)F)c1 |
|
AD39875 | 0.2 | 288.3 | C15H16O4N2 | O=C(NCCO)c1cccc(=O)n1OCc1ccccc1 |
|
AD39876 | 2.3 | 276.3 | C16H12ON4 | NC(=O)c1cc(-c2ccccn2)nc(-c2ccccn2)c1 |
|
AD39877 | 1.03 | 294.17 | C9H12O3NSBr | Cc1c(Br)cccc1S(=O)(=O)NCCO |
|
AD39878 | 1.87 | 271.26 | C13H15O3NF2 | NC(=O)c1cc(F)c(OCC2CCOCC2)c(F)c1 |
|
AD39879 | 0.83 | 295.34 | C14H21O4N3 | CC(C)(C)OC(=O)NCc1ccnc(C(=O)NCCO)c1 |
|
AD39880 | 0.95 | 286.35 | C12H18O4N2S | CC(C)(C)C(=O)OCc1nc(C(=O)NCCO)cs1 |