aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD33711 | -1.04 | 221.28 | C12H17O2N2 | NC(=O)C1C[NH+](Cc2ccccc2)CCO1 |
|
AD33712 | 0.11 | 231.32 | C14H19ON2 | NC(=O)C12CC(CC[NH+]1Cc1ccccc1)C2 |
|
AD33713 | -1.83 | 253.32 | C13H21O3N2 | C[NH+](Cc1ccccc1)C(CO)C(=O)NCCO |
|
AD33714 | -2.83 | 231.27 | C10H19O4N2 | COC(=O)C1CC[NH+](CC(=O)NCCO)C1 |
|
AD33715 | -0.5 | 246.32 | C12H18N6 | CC1C[NH+](C)C(C)CN1c1ncnc2c1N=C[N]2 |
|
AD33716 | -1.48 | 221.28 | C11H17ON4 | C[NH+]1CCN(c2cnccc2C(N)=O)CC1 |
|
AD33717 | -2.25 | 248.37 | C10H22O2N3S | OCCNC(=S)NCCC[NH+]1CCOCC1 |
|
AD33718 | -0.5 | 246.32 | C12H18N6 | CC[NH+]1CCN(c2ncnc3c2N=C[N]3)C(C)C1 |
|
AD33719 | -0.65 | 264.33 | C12H20ON6 | COCC[NH+](C)CCCNc1ncnc2c1N=C[N]2 |
|
AD33720 | -0.5 | 246.32 | C12H18N6 | CN(CC[NH+](C)C1CC1)c1ncnc2c1N=C[N]2 |