aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD32061 | 1.27 | 208.99 | C6H2O2N4Cl2 | Nc1nc(Cl)nc(Cl)c1[N+](=O)[O-] |
|
AD32062 | 0.36 | 197.15 | C7H7O4N3 | COC(=O)c1ccnc(N)c1[N+](=O)[O-] |
|
AD32063 | 0.36 | 197.15 | C7H7O4N3 | COC(=O)c1cnc(N)c([N+](=O)[O-])c1 |
|
AD32064 | 1.12 | 190.16 | C8H6O2N4 | Nc1cnc2ccc([N+](=O)[O-])cc2n1 |
|
AD32065 | 1.12 | 190.16 | C8H6O2N4 | Nc1ncnc2ccc([N+](=O)[O-])cc12 |
|
AD32066 | 1.12 | 190.16 | C8H6O2N4 | Nc1ncnc2cc([N+](=O)[O-])ccc12 |
|
AD32067 | 1.12 | 190.16 | C8H6O2N4 | Nc1cnc2cc([N+](=O)[O-])ccc2n1 |
|
AD32068 | -0.38 | 195.61 | C6H10O3N3Cl | NC1C(Cl)N(O)CCC1[N+](=O)[O-] |
|
AD32069 | 0.36 | 197.15 | C7H7O4N3 | COC(=O)c1cc([N+](=O)[O-])cnc1N |
|
AD32070 | 1.36 | 197.19 | C8H11O3N3 | CC(C)Oc1nc(N)ccc1[N+](=O)[O-] |