aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD01051 | 2.06 | 329.39 | C12H16O2N3PS2 | CCCOP(=S)(NN1C(=N)SCC1=O)c1ccccc1 |
|
AD01052 | 5.46 | 242.45 | C16H34O | CCCCCCCCCCCCCCCCO |
|
AD01053 | 0.87 | 102.09 | C4H6O3 | C=CCOC(=O)O |
|
AD01054 | 4.62 | 274.36 | C20H18O | COC(c1ccccc1)(c1ccccc1)c1ccccc1 |
|
AD01055 | 2.61 | 670.93 | C36H66O9N2 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)C(NCC2CC=CCC2)C(C)C(O)C1(C)O |
|
AD01056 | 1.84 | 168.17 | C9H9O2F | O=C(O)CCc1ccc(F)cc1 |
|
AD01057 | 5.16 | 298.38 | C18H15OFS | Cc1cccc(O)c1Cc1ccc(-c2ccc(F)cc2)s1 |
|
AD01058 | 0.9 | 163.12 | C6H3O2N4 | O=[N+]([O-])c1ccnc2c1N=C[N]2 |
|
AD01059 | 1.8 | 276.34 | C15H20O3N2 | Cc1c(O)ccc2c(N(C)CCN(C)C)cc(=O)oc12 |
|
AD01060 | 2.34 | 371.39 | C20H21O6N | CCn1cc(C(=O)O)c(=O)c2cc(C#CCOCCCCC(=O)O)ccc21 |