aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD17011 | 0.79 | 163.16 | C6H7N6 | CN(C)c1ncnc2c1N=N[N]2 |
|
AD17012 | 3.7 | 376.32 | C20H10O2N4F2 | NN1C(=O)c2c(c3c4cc(F)ccc4[nH]c3c3[nH]c4ccc(F)cc4c23)C1=O |
|
AD17013 | -0.07 | 181.2 | C5H5N6S | NSc1nc(N)nc2c1N=C[N]2 |
|
AD17014 | 1.13 | 114.14 | C6H10O2 | COC(=O)C=C(C)C |
|
AD17015 | 3.27 | 509.48 | C27H19O6N5 | O=C1c2c(c3c4ccc(O)cc4n(O)c3c3[nH]c4cc(O)ccc4c23)C(=O)N1NCc1ccnc(CO)c1 |
|
AD17016 | 2.82 | 266.33 | C15H16N5 | C1=Nc2c(ncnc2NCCCCc2ccccc2)[N]1 |
|
AD17017 | 4.44 | 234.51 | C12H6NCl3 | Cc1c(Cl)[nH]c2cc(Cl)c(Cl)cc12 |
|
AD17018 | -0.9 | 296.32 | C14H20O5N2 | NC1CC(NC(=O)OCc2ccccc2)C(O)C(O)C1O |
|
AD17019 | -2.5 | 438.48 | C20H30O7N4 | NCC1OC(OC2C(NC(=O)OCc3ccccc3)CC(N)C(O)C2O)C2NC2C1O |
|
AD17020 | 4.07 | 247.39 | C13H13NS2 | CSc1ccc(-c2ccc(S)c(C)c2)cn1 |