aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD43571 | 3.34 | 329.42 | C18H19O3NS | COC(=O)C(CC(=O)Nc1ccc(S)cc1)Cc1ccccc1 |
|
AD43572 | 2.8 | 300.38 | C16H16O2N2S | O=C(Nc1ccc(S)cc1)c1ccc(=O)n(CC2CC2)c1 |
|
AD43573 | 2.29 | 326.36 | C15H12O2N5S | COC(=O)c1ccccc1NC(=S)Nc1ncnc2c1C=C[N]2 |
|
AD43574 | 2.59 | 344.35 | C15H11O2N5FS | COC(=O)c1ccccc1NC(=S)Nc1ncnc2c1C(F)=C[N]2 |
|
AD43575 | 2.51 | 301.37 | C15H15O2N3S | O=C(Nc1ccc(S)cc1)c1cnc(=O)n(C2CCC2)c1 |
|
AD43576 | 3.08 | 310.38 | C17H14O2N2S | Cn1cc(C(=O)Nc2ccc(S)cc2)c(=O)c2ccccc21 |
|
AD43577 | 1.98 | 327.35 | C14H11O2N6S | COC(=O)c1ccccc1NC(=S)Nc1ncnc2c1N=C[N]2 |
|
AD43578 | 2.12 | 345.34 | C14H10O2N6FS | COC(=O)c1ccccc1NC(=S)Nc1nc(F)nc2c1N=C[N]2 |
|
AD43579 | 3.09 | 309.41 | C14H15O3NS2 | COc1ccc(S(=O)(=O)Nc2ccc(S)cc2)c(C)c1 |
|
AD43580 | 2.63 | 361.79 | C15H10O2N6ClS | COC(=O)c1ccccc1NC(=S)Nc1nc(Cl)nc2c1N=C[N]2 |