aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD01531 | 1.56 | 238.07 | C8H6N4Br | Nc1ncnc2c1C(C=CBr)=C[N]2 |
|
AD01532 | 2.74 | 363.4 | C19H19O2N6 | O=C(OCc1ccccc1)N1C2CCC1C(Nc1ncnc3c1N=C[N]3)C2 |
|
AD01533 | 2.67 | 585.74 | C32H47O7N3 | CCC(=O)OC1CC(=O)NCCCN(CCCc2ccnc3ccccc23)CC(O)C(C)CC(CC=O)C(O)C1OC |
|
AD01534 | 2.55 | 144.17 | C10H8O | Oc1cccc2ccccc12 |
|
AD01535 | 0.62 | 223.24 | C8H7O2N4S | NS(=O)(=O)c1ccc(C2=CN=N[N]2)cc1 |
|
AD01536 | 0.02 | 228.24 | C11H16O5 | COC(=O)C1=COC(O)C2C(C)CC(O)C12 |
|
AD01537 | 2.7 | 893.07 | C44H76O18 | CCCCCC1CCCCCCCCCC(=O)OC2C(O)C(C)OC(OC3C(OC(COC(=O)C(C)CC)C(O)C3O)OC3C(O1)OC(C)C(O)C3O)C2OC(=O)C(C)C(C)O |
|
AD01538 | 4.26 | 284.3 | C18H10ON3 | C1=Cc2c(ncnc2-c2cccc3c2oc2ccccc23)[N]1 |
|
AD01539 | 5.19 | 600.79 | C35H52O8 | CCC(C)C1OC2(CCC1C)CC1CC(CC=C(C)C(O)C(C)C=CC=C3COC4C(OC)C(C)=CC(C(=O)O1)C34O)O2 |
|
AD01540 | 0.91 | 134.2 | C5H10O2S | CSCCOC(C)=O |