aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD32151 | -0.3 | 206.24 | C11H14O2N2 | CC#CC(=O)N1CC2(CCN(C=O)C2)C1 |
|
AD32152 | -0.3 | 206.24 | C11H14O2N2 | CC#CC(=O)N1CCC2CN(C=O)CC21 |
|
AD32153 | -0.3 | 206.24 | C11H14O2N2 | C#CC(=O)N1CCCC2(CN(C=O)C2)C1 |
|
AD32154 | -0.3 | 206.24 | C11H14O2N2 | C#CC(=O)N1CCC2(CC1)CN(C=O)C2 |
|
AD32155 | -1.31 | 208.22 | C10H12O3N2 | C#CC(=O)N1CC2OCCN(C=O)C2C1 |
|
AD32156 | -1.31 | 208.22 | C10H12O3N2 | C#CC(=O)N1CC2COCC(C1)N2C=O |
|
AD32157 | -1.31 | 208.22 | C10H12O3N2 | C#CC(=O)N1CC2CN(C=O)CC(C1)O2 |
|
AD32158 | -0.39 | 214.29 | C9H14O2N2S | O=CN1CC2(C1)CN(C(=O)CCS)C2 |
|
AD32159 | -0.16 | 206.24 | C11H14O2N2 | CCC#CC(=O)N1CC2(CCN2C=O)C1 |
|
AD32160 | -0.25 | 214.29 | C9H14O2N2S | O=CN1CCC12CN(C(=O)CCS)C2 |