aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD33691 | -0.61 | 238.34 | C11H16ON3S | O=CN1CC2CC[NH+](Cc3cnsc3)C2C1 |
|
AD33692 | -0.61 | 238.34 | C11H16ON3S | O=CN1CC2CC(C1)[NH+](Cc1ccns1)C2 |
|
AD33693 | -1.65 | 229.3 | C11H21O3N2 | COC(C[NH+]1CC2(CCN(C=O)C2)C1)OC |
|
AD33694 | -1.51 | 229.3 | C11H21O3N2 | COC(C[NH+]1CC2CCC(C1)N2C=O)OC |
|
AD33695 | -0.09 | 237.35 | C12H17ON2S | Cc1csc(C[NH+]2CC3(CN(C=O)C3)C2)c1 |
|
AD33696 | -0.09 | 237.35 | C12H17ON2S | Cc1cc(C[NH+]2CC3(CN(C=O)C3)C2)cs1 |
|
AD33697 | -0.37 | 233.28 | C11H19ON2F2 | O=CN1CCC2C[NH+](CC(F)F)CC2CC1 |
|
AD33698 | -1.85 | 229.3 | C11H21O3N2 | CCOCC[NH+]1CC2COCC(C1)N2C=O |
|
AD33699 | -1.85 | 229.3 | C11H21O3N2 | CCOCC[NH+]1CC2OCCN(C=O)C2C1 |
|
AD33700 | -1.85 | 229.3 | C11H21O3N2 | CCOCC[NH+]1CC2CN(C=O)CC(C1)O2 |