aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD40361 | 1.98 | 314.27 | C11H4O3N7S | O=[N+]([O-])c1ccc(Sc2ncnc3c2N=C[N]3)c2nonc12 |
|
AD40362 | -0.83 | 169.12 | C5H5O3N4 | CC(=O)NC1=C([N+](=O)[O-])N=C[N]1 |
|
AD40363 | 1.51 | 271.38 | C17H23ON2 | C[NH+](C)CCOC(C)(c1ccccc1)c1ccccn1 |
|
AD40364 | 2.9 | 285.26 | C15H11O5N | O=C(C=Cc1ccc([N+](=O)[O-])cc1)c1c(O)cccc1O |
|
AD40365 | 1.47 | 303.31 | C15H11N8 | Nc1ncnc2c1N=C(NN=Cc1ccc3ccccc3n1)[N]2 |
|
AD40366 | 1.71 | 310.34 | C15H16ON7 | CCCOc1ccccc1C=NNC1=Nc2c(N)ncnc2[N]1 |
|
AD40367 | 2.57 | 246.31 | C14H18O2N2 | Cc1ccc2c(c1)C(=NO)C(=O)N2CCC(C)C |
|
AD40368 | 1.71 | 310.34 | C15H16ON7 | CCCOc1cccc(C=NNC2=Nc3c(N)ncnc3[N]2)c1 |
|
AD40369 | 1.47 | 303.31 | C15H11N8 | Nc1ncnc2c1N=C(NN=Cc1ccnc3ccccc13)[N]2 |
|
AD40370 | 1.48 | 308.32 | C15H14ON7 | C=CCOc1ccc(C=NNC2=Nc3c(N)ncnc3[N]2)cc1 |