aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD40791 | 0.24 | 358.34 | C15H16O4N7 | COc1cc(C=NNC2=Nc3c(nc(N)[nH]c3=O)[N]2)cc(OC)c1OC |
|
AD40792 | -0.07 | 333.35 | C12H23O6N5 | COC(=O)C(CCCNC(N)=N[N+](=O)[O-])NC(=O)OC(C)(C)C |
|
AD40793 | -0.55 | 296.32 | C15H20O6 | CC1CC2OC3C(O)CC(C)(C34CO4)C2(CO)C(=O)C1=O |
|
AD40794 | 1.31 | 339.34 | C15H15O2N8 | CC(COc1ccccc1C(N)=O)N=NC1=Nc2c(N)ncnc2[N]1 |
|
AD40795 | -1.35 | 225.29 | C7H17O4N2S | COS(=O)(=O)NC(=O)C([NH3+])CC(C)C |
|
AD40796 | -1.35 | 225.29 | C7H17O4N2S | CCC(C)C([NH3+])C(=O)NS(=O)(=O)OC |
|
AD40797 | 0.27 | 328.31 | C14H14O3N7 | COc1ccc(C=NN(C)C2=Nc3c(nc(N)[nH]c3=O)[N]2)c(O)c1 |
|
AD40798 | 0.34 | 336.34 | C17H20O7 | COc1ccc(C(=O)OC2C3CCOC(O)C3C3(CO)OC23)cc1 |
|
AD40799 | 0.4 | 197.18 | C10H5ON4 | C#CC(C#C)Oc1ncnc2c1N=C[N]2 |
|
AD40800 | 2.11 | 278.31 | C14H18O4N2 | COC(=O)c1ccc(C(N)=NC(=O)OC(C)(C)C)cc1 |