aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD41341 | 2.11 | 228.09 | C9H10ONBr | CCc1c(Br)cccc1C(N)=O |
|
AD41342 | 1.86 | 228.25 | C13H12O2N2 | COc1cccc(-c2ccc(C(N)=O)cn2)c1 |
|
AD41343 | 0.96 | 314.15 | C11H9O5NCl2S | O=C(O)c1cc(S(=O)(=O)NCCO)c(Cl)cc1Cl |
|
AD41344 | 1.74 | 221.26 | C12H15O3N | CCCCOC(=O)c1ccccc1C(N)=O |
|
AD41345 | 2.46 | 224.33 | C11H16ON2S | CCCCCSc1ncccc1C(N)=O |
|
AD41346 | 1.97 | 214.22 | C12H10O2N2 | NC(=O)c1cccnc1Oc1ccccc1 |
|
AD41347 | 0.47 | 312.33 | C11H14O4N5S | CCOC(=O)C(C)(C)S(=O)(=O)Nc1ncnc2c1N=C[N]2 |
|
AD41348 | 1.59 | 345.36 | C15H13O4N4S | COC(=O)c1ccc(C)c(S(=O)(=O)Nc2ncnc3c2C=C[N]3)c1 |
|
AD41349 | 1.65 | 345.2 | C10H11O2N5SBr | O=S(=O)(CC1CCC1)Nc1ncnc2c1N=C(Br)[N]2 |
|
AD41350 | 0.17 | 362.16 | C10H7O3N4FSBr | NC(=O)C1=C(NS(=O)(=O)c2cc(F)cc(Br)c2)[N]C=N1 |