aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD32001 | -0.52 | 215.29 | C11H20ON2F | O=CN1CCC2(C1)C[NH+](CCCCF)C2 |
|
AD32002 | -0.67 | 220.28 | C10H16N6 | CC(C[NH+](C)C)Nc1ncnc2c1N=C[N]2 |
|
AD32003 | -1.71 | 212.32 | C11H22ON3 | C[NH+](C)CCN1CC2CC(C1)N(C=O)C2 |
|
AD32004 | -1.56 | 212.32 | C11H22ON3 | C[NH+](C)CCN1CC2CCC(C1)N2C=O |
|
AD32005 | -0.64 | 234.31 | C11H18N6 | CN(CCC[NH+](C)C)c1ncnc2c1N=C[N]2 |
|
AD32006 | -1.35 | 218.27 | C10H20O4N | CCOC(=O)C1CCC([NH2+]CCO)CO1 |
|
AD32007 | -1.1 | 222.33 | C9H20O3NS | CS(=O)(=O)C1CCC([NH2+]CCO)CC1 |
|
AD32008 | -0.52 | 232.29 | C11H16N6 | C1=Nc2c(ncnc2NCC[NH+]2CCCC2)[N]1 |
|
AD32009 | -0.09 | 232.29 | C11H16N6 | C[NH2+]C1(CNc2ncnc3c2N=C[N]3)CCC1 |
|
AD32010 | -0.45 | 232.29 | C11H16N6 | CC1CN(c2ncnc3c2N=C[N]3)CC(C)[NH2+]1 |