aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD10891 | 1.73 | 175.22 | C9H11N4 | CCCCc1ncnc2c1N=C[N]2 |
|
AD10892 | 4.07 | 502.69 | C30H46O6 | CC1=C2C3=CCC4C5(C)CC(O)C(O)C(C)(CO)C5C(O)CC4(C)C3(C)CCC2(C(=O)O)CCC1C |
|
AD10893 | -0.83 | 235.33 | C9H19O3N2S | C[S+](C)CCC(NC(=O)CCN)C(=O)O |
|
AD10894 | 5.29 | 494.69 | C27H42O6S | CC(C)=CC(=O)CC(C)C1CCC2C3CC(O)C4CC(OS(=O)(=O)O)CCC4(C)C3=CCC12C |
|
AD10895 | 1.48 | 353.41 | C18H21O2N6 | Cc1ccc(CC(=O)NCCOCCNc2ncnc3c2N=C[N]3)cc1 |
|
AD10896 | 2.67 | 420.46 | C22H28O8 | COc1cc(CC2COC(c3cc(OC)c(O)c(OC)c3)C2CO)cc(OC)c1O |
|
AD10897 | 0.8 | 118.18 | C6H14O2 | COCCCCCO |
|
AD10898 | -0.99 | 132.16 | C5H12O2N2 | CC(N)CNCC(=O)O |
|
AD10899 | 1.82 | 407.38 | C22H17O7N | Cc1cc(O)c2c(c1)C1OC(=O)C(C(C)O)N1C1=C2C(=O)c2cccc(O)c2C1=O |
|
AD10900 | 1.15 | 212.19 | C10H6ON5 | Oc1nc(-c2cccnc2)nc2c1N=C[N]2 |