aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD42881 | 2.44 | 352.12 | C11H7ON5I | Oc1ccc(Nc2nc(I)nc3c2N=C[N]3)cc1 |
|
AD42882 | 1.37 | 314.59 | C9H9O3NClSBr | O=S(=O)(NCCO)c1ccc(Br)c(Cl)c1 |
|
AD42883 | 2.35 | 297.3 | C14H13O2N6 | COc1ccc(C)cc1NC(=O)Nc1ncnc2c1N=C[N]2 |
|
AD42884 | 1.47 | 349.43 | C18H27O4N3 | CC(C)(C)OC(=O)N1CCN(c2cccc(C(=O)NCCO)c2)CC1 |
|
AD42885 | 2.74 | 354.11 | C11H6N5FI | Fc1cnccc1Nc1ncnc2c1C(I)=C[N]2 |
|
AD42886 | 2.59 | 281.3 | C14H13ON6 | CCc1cccc(NC(=O)Nc2ncnc3c2N=C[N]3)c1 |
|
AD42887 | 3.2 | 315.37 | C13H11O2NF2S2 | O=S(=O)(Cc1ccc(F)c(F)c1)Nc1ccc(S)cc1 |
|
AD42888 | 2.61 | 299.3 | C13H11O3NF2S | O=S(=O)(Cc1ccc(F)c(F)c1)Nc1ccc(O)cc1 |
|
AD42889 | 3.51 | 300.33 | C17H17O2N2F | O=C(c1cc(Nc2ccc(O)cc2)ccc1F)N1CCCC1 |
|
AD42890 | 2.21 | 339.16 | C9H5ON7SBr | O=C(Nc1nccs1)Nc1ncnc2c1N=C(Br)[N]2 |