aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD18901 | -1.47 | 189.17 | C7H11O5N | CC(=O)NCC(O)CC(=O)C(=O)O |
|
AD18902 | 3.83 | 193.25 | C14H11N | c1ccc2cc(-c3cc[nH]c3)ccc2c1 |
|
AD18903 | 3.75 | 452.38 | C24H27O3N3Cl2 | O=C(CC(=O)Nc1ccc(O)cc1)NCCCc1ccc(N(CCCl)CCCl)cc1 |
|
AD18904 | 2.87 | 509.43 | C26H30O4N4Cl2 | O=C(CCCc1ccc(N(CCCl)CCCl)cc1)NCC(=O)NCC(=O)Nc1ccc(O)cc1 |
|
AD18905 | -0.12 | 124.15 | C5H8N4 | N=C(N)c1cc[nH]c1N |
|
AD18906 | 2.4 | 253.28 | C14H13ON4 | C1=Nc2c(ncnc2OCCCc2ccccc2)[N]1 |
|
AD18907 | 1.35 | 233.27 | C13H15O3N | O=CN1CCCC1C(=O)OCc1ccccc1 |
|
AD18908 | 1.23 | 257.32 | C13H17N6 | NC1CC2CCCC(C1)N2c1ncnc2c1N=C[N]2 |
|
AD18909 | 1.92 | 724.98 | C38H68O9N4 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(CCCNCc2ccncc2)C(C)C(O)C1(C)O |
|
AD18910 | 0.69 | 157.21 | C8H15O2N | CCC(=O)NCC1CCCO1 |