aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD30511 | -2.38 | 212.27 | C10H18O2N3 | CNC(=O)C[NH+]1CCC2C1CCN2C=O |
|
AD30512 | -2.52 | 212.27 | C10H18O2N3 | CNC(=O)C[NH+]1CCC2CN(C=O)CC21 |
|
AD30513 | -0.38 | 215.29 | C11H20ON2F | O=CN1CC2CCC(C1)[NH+]2CCCCF |
|
AD30514 | -0.38 | 215.29 | C11H20ON2F | O=CN1CCC2C1CC[NH+]2CCCCF |
|
AD30515 | -0.52 | 215.29 | C11H20ON2F | O=CN1CC2CC[NH+](CCCCF)C2C1 |
|
AD30516 | -0.52 | 215.29 | C11H20ON2F | O=CN1CC2CC(C1)[NH+](CCCCF)C2 |
|
AD30517 | -1.71 | 212.32 | C11H22ON3 | CN(C)CC[NH+]1CC2CCN(C=O)C2C1 |
|
AD30518 | -1.7 | 212.32 | C11H22ON3 | CN(C)CC[NH+]1CCC2(CN(C=O)C2)C1 |
|
AD30519 | -0.18 | 209.31 | C12H21ON2 | O=CN1CC2CCC(C1)[NH+]2C1CCCC1 |
|
AD30520 | -1.56 | 212.32 | C11H22ON3 | CN(C)CC[NH+]1CCC2C1CCN2C=O |