aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD32711 | 1.57 | 240.25 | C11H10N7 | CNc1ccc(Nc2ncnc3c2N=C[N]3)cn1 |
|
AD32712 | 1.62 | 228.28 | C12H14N5 | C1=Nc2c(ncnc2N2CC3CCCC3C2)[N]1 |
|
AD32713 | 1.69 | 234.31 | C10H12N5S | C1=Nc2c(ncnc2NCC2CCCS2)[N]1 |
|
AD32714 | 0.98 | 234.28 | C11H16ON5 | CCN(CC(C)(C)O)c1ncnc2c1N=C[N]2 |
|
AD32715 | 1.22 | 232.27 | C11H14ON5 | C1=Nc2c(ncnc2NCCC2CCOC2)[N]1 |
|
AD32716 | 1.61 | 234.28 | C11H16ON5 | COCCC(C)(C)Nc1ncnc2c1N=C[N]2 |
|
AD32717 | 1.02 | 216.35 | C10H20ON2S | OCCNC(=S)NCC1CCCCC1 |
|
AD32718 | 1.37 | 232.27 | C11H14ON5 | COC1CCC(Nc2ncnc3c2N=C[N]3)C1 |
|
AD32719 | 1.55 | 234.31 | C10H12N5S | C1=Nc2c(ncnc2NCC2CCSC2)[N]1 |
|
AD32720 | 0.82 | 227.28 | C10H13O3NS | O=C(CCC(=O)c1cccs1)NCCO |