aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD43071 | 1.9 | 356.34 | C17H15O3N5F | COC(=O)C(Cc1ccccc1)NC(=O)Nc1ncnc2c1C(F)=C[N]2 |
|
AD43072 | 0.62 | 123.16 | C6H9N3 | CCc1ncncc1N |
|
AD43073 | 1.22 | 328.43 | C15H24O4N2S | CCCN(CCC)S(=O)(=O)c1ccc(C(=O)NCCO)cc1 |
|
AD43074 | 0.39 | 149.15 | C7H7ON3 | Nc1ccc2[nH]c(=O)cc-2[nH]1 |
|
AD43075 | 2.75 | 316.33 | C17H17O3N2F | O=C(c1ccc(F)c(Nc2ccc(O)cc2)c1)N1CCOCC1 |
|
AD43076 | 3.33 | 332.4 | C17H17O2N2FS | O=C(c1ccc(F)c(Nc2ccc(S)cc2)c1)N1CCOCC1 |
|
AD43077 | 2.61 | 299.3 | C13H11O3NF2S | O=S(=O)(Cc1ccc(F)cc1F)Nc1ccc(O)cc1 |
|
AD43078 | 3.2 | 315.37 | C13H11O2NF2S2 | O=S(=O)(Cc1ccc(F)cc1F)Nc1ccc(S)cc1 |
|
AD43079 | 2.41 | 325.17 | C10H7ON5SBr | OCc1cc(Nc2ncnc3c2N=C(Br)[N]3)cs1 |
|
AD43080 | 2.35 | 344.15 | C13H8ON6Br | O=C1Cc2cc(Nc3ncnc4c3N=C(Br)[N]4)ccc2N1 |