aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD29111 | -0.02 | 170.13 | C5H6O3N4 | COc1nc(N)ncc1[N+](=O)[O-] |
|
AD29112 | 1.23 | 173.56 | C6H4O2N3Cl | Nc1cc([N+](=O)[O-])cc(Cl)n1 |
|
AD29113 | 1.23 | 173.56 | C6H4O2N3Cl | Nc1nccc(Cl)c1[N+](=O)[O-] |
|
AD29114 | 1.23 | 173.56 | C6H4O2N3Cl | Nc1ncc(Cl)cc1[N+](=O)[O-] |
|
AD29115 | 0.62 | 174.55 | C5H3O2N4Cl | Nc1nc(Cl)ncc1[N+](=O)[O-] |
|
AD29116 | 0.28 | 184.16 | C6H8O3N4 | COc1nc(C)c([N+](=O)[O-])c(N)n1 |
|
AD29117 | 1.23 | 173.56 | C6H4O2N3Cl | Nc1cc(Cl)cc([N+](=O)[O-])n1 |
|
AD29118 | -0.02 | 170.13 | C5H6O3N4 | COc1ncnc(N)c1[N+](=O)[O-] |
|
AD29119 | 0.89 | 183.17 | C7H9O3N3 | COc1cc(C)nc(N)c1[N+](=O)[O-] |
|
AD29120 | 0.58 | 169.14 | C6H7O3N3 | COc1nc(N)ccc1[N+](=O)[O-] |