aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD00081 | 2.6 | 350.14 | C12H9N5I | Ic1ccc(CNc2ncnc3c2N=C[N]3)cc1 |
|
AD00082 | -0.17 | 214.19 | C6H10O3N6 | [N-]=[N+]=NC1CC(N=[N+]=[N-])C(O)C(O)C1O |
|
AD00083 | -1.25 | 97.09 | H3O3NS | NS(=O)(=O)O |
|
AD00084 | 0.11 | 152.11 | C5H3N5F | Nc1nc(F)nc2c1N=C[N]2 |
|
AD00085 | 2.11 | 307.3 | C14H11O6S | O=S(=O)([O-])Oc1ccc(C=Cc2cc(O)cc(O)c2)cc1 |
|
AD00086 | 7.23 | 456.71 | C30H48O3 | CC1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1 |
|
AD00087 | 2.22 | 288.26 | C15H12O6 | O=C1CC(c2ccc(O)c(O)c2)Oc2cc(O)cc(O)c21 |
|
AD00088 | 3.63 | 264.36 | C16H24O3 | CCCCCC=CC=CC(O)CC=CC=CC(=O)O |
|
AD00089 | 3.7 | 240.3 | C16H16O2 | CCc1ccc(-c2ccc(C(=O)OC)cc2)cc1 |
|
AD00090 | 0.59 | 140.14 | C7H8O3 | OCc1cc(O)cc(O)c1 |