aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD42011 | 1.95 | 290.36 | C16H22O3N2 | CC1CCCC(C)N1C(=O)COc1ccc(C(N)=O)cc1 |
|
AD42012 | 1.86 | 314.99 | C6H5O2NSBr2 | NS(=O)(=O)c1cc(Br)cc(Br)c1 |
|
AD42013 | 2.2 | 297.34 | C14H11ON5S | O=C(Nc1ccc(S)cc1)c1ccc(-n2cncn2)nc1 |
|
AD42014 | 1.64 | 317.07 | C8H6O2N4I | COC(=O)Nc1ncnc2c1C(I)=C[N]2 |
|
AD42015 | 1.17 | 318.05 | C7H5O2N5I | COC(=O)Nc1nc(I)nc2c1N=C[N]2 |
|
AD42016 | 2.03 | 308.38 | C13H12O3N2S2 | CS(=O)(=O)c1cncc(C(=O)Nc2ccc(S)cc2)c1 |
|
AD42017 | 2.48 | 304.33 | C14H12O4N2S | O=S(=O)(Cc1noc2ccccc12)Nc1ccc(O)cc1 |
|
AD42018 | 1.01 | 329.19 | C13H17O3N2Br | O=C(NCCO)c1ccc(N2CCOCC2)c(Br)c1 |
|
AD42019 | 2.04 | 304.37 | C15H16O3N2S | COCCn1cccc(C(=O)Nc2ccc(S)cc2)c1=O |
|
AD42020 | 0.84 | 324.11 | C11H8O3N4Br | NC(=O)C1=C(NC(=O)Oc2ccc(Br)cc2)[N]C=N1 |