aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD02881 | 3.28 | 401.48 | C21H23O5NS | COc1c(O)cc2c(c1OC)-c1ccc(SC)c(=O)cc1C(NC(C)=O)CC2 |
|
AD02882 | 1.04 | 264.32 | C15H20O4 | C=C1CC(O)C2C(C)C(=O)OC2C2C(=C)C(O)CC12 |
|
AD02883 | 0.24 | 585.56 | C29H31O12N | COC(=O)C1c2cc3c(cc2C(O)CC1(C)O)C(=O)c1c(O)cc2c(c1C3=O)OC1OC2(C)C(O)C([N+](C)(C)[O-])C1O |
|
AD02884 | -0.73 | 112.14 | C4H8N4 | Cn1cc(CN)nn1 |
|
AD02885 | 2.78 | 250.71 | C12H13N5Cl | Clc1nc2c(c(NC3CCCCC3)n1)N=C[N]2 |
|
AD02886 | 3.38 | 324.42 | C20H24O2N2 | CCC(=O)NC(Cc1ccccc1)C(=O)Nc1ccc(C)c(C)c1 |
|
AD02887 | 2.86 | 270.28 | C16H14O4 | Cc1ccc(C(=O)CC(=O)c2ccc(O)cc2O)cc1 |
|
AD02888 | 3.99 | 511.7 | C27H43O7S | CC(C)C(O)C(=O)CC(C)C1CCC2C3CC(O)C4CC(OS(=O)(=O)[O-])CCC4(C)C3=CCC12C |
|
AD02889 | 1.97 | 161.25 | C10H9S | C1=[S+]CC(c2ccccc2)=C1 |
|
AD02890 | 0.76 | 115.18 | C6H13ON | CC(C)C(C)C(N)=O |