aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD12271 | 0.02 | 108.12 | C2H4O3S | C=CS(=O)(=O)O |
|
AD12272 | 1.85 | 177.2 | C10H11O2N | CCC(=O)c1ccccc1NC=O |
|
AD12273 | 3.61 | 403.44 | C21H15O3N4S | O=C(O)C1CSc2c(C3=C[N]N=N3)c(Cc3cccc4ccccc34)cc(=O)n21 |
|
AD12274 | 8.13 | 587.85 | C38H53O4N | CC(C)C(C)C1(C)CCC2(C)C3CCC4C5(COCC4(C)C(O)C(n4ccc6ccccc64)C5)C3=CCC2(C)C1C(=O)O |
|
AD12275 | 4.76 | 432.65 | C27H44O4 | CC1CCC2(OC1)OC1C(O)C3C4CCC5CC(O)CCC5(C)C4CCC3(C)C1C2C |
|
AD12276 | 2.99 | 259.7 | C14H10ON3Cl | Cn1cnc2cc(-c3ccc(O)c(Cl)c3)cnc21 |
|
AD12277 | 5.57 | 349.82 | C22H16O2NCl | Oc1ccc(-n2ccc3c(OCc4ccccc4)cccc32)cc1Cl |
|
AD12278 | 1.75 | 172.13 | C8H6O2F2 | COC(=O)c1c(F)cccc1F |
|
AD12279 | 3.06 | 320.47 | C20H32O3 | C=CC1(C)C=C2C(O)CC3C(C)(CO)C(O)CCC3(C)C2CC1 |
|
AD12280 | 3.03 | 510.46 | C27H33O4N3Cl2 | CC1C(N)CC(NC(=O)C(CCN)OCc2ccc(Cl)cc2)C(O)C1OCc1ccc(Cl)cc1 |