aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD38861 | -2.36 | 117.17 | C5H13ON2 | NCC1(O)CC[NH2+]C1 |
|
AD38862 | -0.53 | 299.79 | C11H14N7ClS | C[NH+](C)CCNC(=S)Nc1nc(Cl)nc2c1N=C[N]2 |
|
AD38863 | -0.91 | 289.35 | C13H25O5N2 | COC(=O)C1CC([NH2+]CCO)CN1C(=O)OC(C)(C)C |
|
AD38864 | -0.63 | 317.4 | C15H23ON7 | O=C(CNc1ncnc2c1N=C[N]2)NCC[NH+]1CCCCCC1 |
|
AD38865 | -1.04 | 317.4 | C15H23ON7 | CC[NH+](CC)CC(=O)N1CCN(c2ncnc3c2N=C[N]3)CC1 |
|
AD38866 | -0.7 | 185.14 | C5H7O3N5 | CNc1nc(N)[nH]c(=O)c1[N+](=O)[O-] |
|
AD38867 | 1.43 | 297.1 | C13H6O2N4Cl2 | Cn1c2nc(=O)[nH]c(=O)c-2nc2cc(Cl)c(Cl)cc21 |
|
AD38868 | 0.93 | 188.57 | C6H5O2N4Cl | Cc1nc(N)c([N+](=O)[O-])c(Cl)n1 |
|
AD38869 | 0.61 | 268.23 | C11H12O6N2 | COC(=O)C(C(=O)OC)c1cc(N)ccc1[N+](=O)[O-] |
|
AD38870 | 0.0 | 269.21 | C10H11O6N3 | COC(=O)C(C(=O)OC)c1ncc(N)cc1[N+](=O)[O-] |