aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD34351 | -0.41 | 250.29 | C9H15O3N2FS | O=CN1CCC12CN(S(=O)(=O)CCCF)C2 |
|
AD34352 | -0.5 | 244.32 | C10H16O3N2S | O=CN1CC2(C1)CN(S(=O)(=O)CC1CC1)C2 |
|
AD34353 | -0.36 | 244.32 | C10H16O3N2S | O=CN1CCC12CN(S(=O)(=O)CC1CC1)C2 |
|
AD34354 | -0.41 | 250.29 | C9H15O3N2FS | O=CN1CC2CC(C1)N2S(=O)(=O)CCCF |
|
AD34355 | -0.36 | 244.32 | C10H16O3N2S | O=CN1CC2CC(C1)N2S(=O)(=O)CC1CC1 |
|
AD34356 | -0.74 | 227.26 | C10H17O3N3 | CCNC(=O)N1CC2OCCN(C=O)C2C1 |
|
AD34357 | -0.74 | 227.26 | C10H17O3N3 | CCNC(=O)N1CC2CN(C=O)CC(C1)O2 |
|
AD34358 | 0.19 | 227.33 | C10H17ON3S | CCCNC(=S)N1CC2(CCN2C=O)C1 |
|
AD34359 | 0.04 | 227.33 | C10H17ON3S | CCCNC(=S)N1CC2(CN(C=O)C2)C1 |
|
AD34360 | -0.74 | 227.26 | C10H17O3N3 | CCNC(=O)N1CC2COCC(C1)N2C=O |