aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD33411 | 2.49 | 225.23 | C12H9ON4 | Cc1ccccc1Oc1ncnc2c1N=C[N]2 |
|
AD33412 | 1.95 | 227.35 | C13H25O2N | CC(C)(C)C1CCC(C(=O)NCCO)CC1 |
|
AD33413 | 1.52 | 226.3 | C10H14O2N2S | CSc1ccccc1NC(=O)NCCO |
|
AD33414 | 2.38 | 230.29 | C12H16N5 | CC1CCC(Nc2ncnc3c2N=C[N]3)CC1 |
|
AD33415 | 2.62 | 232.31 | C12H18N5 | CC(CC(C)(C)C)Nc1ncnc2c1N=C[N]2 |
|
AD33416 | 1.17 | 216.35 | C10H20ON2S | OCCNC(=S)NC1CCCCCC1 |
|
AD33417 | 0.66 | 212.23 | C9H17ONF3 | OCC[NH2+]C1CCC(C(F)(F)F)CC1 |
|
AD33418 | 1.15 | 205.32 | C13H21N2 | Cc1ccc(C[NH+]2CCCCC2)cc1N |
|
AD33419 | 0.66 | 212.23 | C9H17ONF3 | OCC[NH2+]C1CCCC(C(F)(F)F)C1 |
|
AD33420 | 1.03 | 226.36 | C12H20ONS | Cc1ccc(SCC(C)[NH2+]CCO)cc1 |