aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD31981 | -0.25 | 223.32 | C11H15ON2S | O=CN1CC2CC(C1)[NH+]2Cc1cccs1 |
|
AD31982 | -0.61 | 209.31 | C12H21ON2 | CC1CC1C[NH+]1CC2(CCN(C=O)C2)C1 |
|
AD31983 | -1.7 | 212.32 | C11H22ON3 | C[NH+](C)CCN1CC2(CCN(C=O)C2)C1 |
|
AD31984 | -0.22 | 211.33 | C12H23ON2 | CC(C)CCC[NH+]1CC2(CN(C=O)C2)C1 |
|
AD31985 | -0.47 | 209.31 | C12H21ON2 | O=CN1CCC2(C1)C[NH+](CCC1CC1)C2 |
|
AD31986 | -0.3 | 209.31 | C12H21ON2 | CCC=CCC[NH+]1CC2(CN(C=O)C2)C1 |
|
AD31987 | -1.23 | 213.3 | C11H21O2N2 | COC(C)(C)C[NH+]1CC2(CN(C=O)C2)C1 |
|
AD31988 | -0.22 | 204.25 | C11H14ON3 | O=CN1CC2(C1)CN(c1cc[nH+]cc1)C2 |
|
AD31989 | -0.08 | 204.25 | C11H14ON3 | O=CN1CCC12CN(c1cc[nH+]cc1)C2 |
|
AD31990 | -0.08 | 211.33 | C12H23ON2 | CCC(C)[NH+]1CCC2(CC1)CN(C=O)C2 |