aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD43121 | 3.06 | 297.33 | C13H13ON3F2S | Cc1cc(C(F)F)n(CC(=O)Nc2ccc(S)cc2)n1 |
|
AD43122 | 1.8 | 315.76 | C14H18O4N3Cl | CC(C)(C)OC(=O)Nc1cnc(Cl)cc1C(=O)NCCO |
|
AD43123 | 2.88 | 326.22 | C12H12ON3SBr | Cc1nn(CC(=O)Nc2ccc(S)cc2)cc1Br |
|
AD43124 | 2.14 | 295.33 | C15H15ON6 | O=C(NCCCc1ccccc1)Nc1ncnc2c1N=C[N]2 |
|
AD43125 | 2.79 | 329.77 | C16H14ON6Cl | O=C(NCCCc1ccccc1)Nc1nc(Cl)nc2c1N=C[N]2 |
|
AD43126 | 2.41 | 288.33 | C14H12O3N2S | COC(=O)c1cncc(C(=O)Nc2ccc(S)cc2)c1 |
|
AD43127 | 2.62 | 314.41 | C16H18ON4S | O=C(Nc1ccc(S)cc1)C1CCN(c2ncccn2)CC1 |
|
AD43128 | 2.95 | 335.45 | C16H17O3NS2 | CCS(=O)(=O)c1ccc(CC(=O)Nc2ccc(S)cc2)cc1 |
|
AD43129 | 3.19 | 362.46 | C15H16O2N5S2 | CCCCc1ccc(S(=O)(=O)Nc2[nH]c(=S)nc3c2N=C[N]3)cc1 |
|
AD43130 | 3.09 | 324.2 | C12H10ON3SBr | Cc1ncc(Br)c(C(=O)Nc2ccc(S)cc2)n1 |