aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD31901 | 1.14 | 224.24 | C9H8O3N2S | CS(=O)(=O)c1ccc(-c2ncon2)cc1 |
|
AD31902 | -0.94 | 212.25 | C10H16O3N2 | O=CN1CC2(CCCN(C(=O)CO)C2)C1 |
|
AD31903 | -1.95 | 214.22 | C9H14O4N2 | O=CN1CC2COCC(C1)N2C(=O)CO |
|
AD31904 | -1.95 | 214.22 | C9H14O4N2 | O=CN1CCOC2CN(C(=O)CO)CC21 |
|
AD31905 | -0.75 | 212.25 | C10H16O3N2 | O=CNC1CC2CCC(C1)N2C(=O)CO |
|
AD31906 | -1.95 | 214.22 | C9H14O4N2 | O=CN1CC2CN(C(=O)CO)CC(C1)O2 |
|
AD31907 | 0.55 | 206.25 | C11H14O2N2 | O=CN1CC2(C1)CN(Cc1ccco1)C2 |
|
AD31908 | 0.69 | 206.25 | C11H14O2N2 | O=CN1CC2CC(C1)N2Cc1ccco1 |
|
AD31909 | 0.7 | 206.25 | C11H14O2N2 | O=CN1CCC12CN(Cc1ccco1)C2 |
|
AD31910 | 1.5 | 194.21 | C8H6O2N2S | NC(=O)c1cc(-c2cccs2)on1 |