aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD29151 | 1.23 | 173.56 | C6H4O2N3Cl | Nc1c(Cl)cncc1[N+](=O)[O-] |
|
AD29152 | 1.32 | 186.14 | C7H7O3N2F | COc1c(F)cc(N)cc1[N+](=O)[O-] |
|
AD29153 | 0.82 | 178.15 | C7H6O2N4 | Nc1ccc2ncc([N+](=O)[O-])n2c1 |
|
AD29154 | 0.22 | 179.14 | C6H5O2N5 | Nc1cc([N+](=O)[O-])c2nncn2c1 |
|
AD29155 | -1.01 | 189.23 | C8H17O3N2 | O=[N+]([O-])CC1CCC([NH2+]CCO)C1 |
|
AD29156 | -1.46 | 169.14 | C6H7O3N3 | CN1C(=O)NC(=O)C(=CN)C1=O |
|
AD29157 | -1.12 | 183.17 | C7H9O3N3 | CN1C(=O)C(=CN)C(=O)N(C)C1=O |
|
AD29158 | -0.08 | 194.23 | C10H14O2N2 | Nc1ccc(CC(=O)NCCO)cc1 |
|
AD29159 | 1.04 | 149.19 | C9H11ON | Oc1cccc2c1CNCC2 |
|
AD29160 | 1.16 | 204.22 | C8H10N7 | CC(C)N=NC1=Nc2c(N)ncnc2[N]1 |