aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD32111 | -0.96 | 208.28 | C11H18ON3 | N#CCC[NH+]1CCC2(CC1)CN(C=O)C2 |
|
AD32112 | -0.96 | 208.28 | C11H18ON3 | N#CCCC[NH+]1CC2(CCN(C=O)C2)C1 |
|
AD32113 | -0.82 | 208.28 | C11H18ON3 | N#CCCC[NH+]1CC2CCC(C1)N2C=O |
|
AD32114 | -0.82 | 208.28 | C11H18ON3 | N#CCCCC[NH+]1CC2(CCN2C=O)C1 |
|
AD32115 | 0.98 | 194.25 | C11H16O2N | CCC([NH3+])Cc1ccc2c(c1)OCO2 |
|
AD32116 | -0.3 | 209.31 | C12H21ON2 | C=CCCC[NH+]1CCC2CN(C=O)CC21 |
|
AD32117 | -0.16 | 209.31 | C12H21ON2 | C=CCCC[NH+]1CCC2C1CCN2C=O |
|
AD32118 | -0.16 | 209.31 | C12H21ON2 | C=CCCC[NH+]1CC2CCC(C1)N2C=O |
|
AD32119 | 0.19 | 191.3 | C12H19N2 | CC1CC(N)C[NH+]1Cc1ccccc1 |
|
AD32120 | -1.61 | 229.24 | C7H9O3N4S | C=CCS(=O)(=O)NC1=C(C(N)=O)N=C[N]1 |