aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD22291 | 1.51 | 202.22 | C8H4N5S | C1=Nc2c(ncnc2-c2ccns2)[N]1 |
|
AD22292 | -3.07 | 641.82 | C28H55O6N11 | CN(CCCCNCC(=O)N1CCCC1C(=O)NC(CCCCN)C(=O)NC(CCCNC(=N)N)C(N)=O)CCC(N)C(=O)O |
|
AD22293 | 2.6 | 233.3 | C12H17ON4 | CCCCCCCc1nc(O)c2c(n1)[N]C=N2 |
|
AD22294 | 2.18 | 146.19 | C9H10N2 | Cc1cc2nc[nH]c2cc1C |
|
AD22295 | 3.52 | 370.38 | C19H19O3N4F | Cc1cc2c(F)c(Oc3ncnn4cc(OCC(C)O)c(C)c34)ccc2[nH]1 |
|
AD22296 | -1.61 | 408.41 | C18H24O7N4 | CNC(=O)CCC(=O)NC(Cc1ccc(O)cc1)C(=O)NC(CC(=O)O)C(N)=O |
|
AD22297 | 3.28 | 784.07 | C40H69O10N3S | CC(C)(O)C(CCC(C)(O)C1CCC2(C)C1C(O)CC1C3(C)CCC(O)C(C)(C)C3CCC12C)SCC(NC(=O)CCC(N)C(=O)O)C(=O)NCC(=O)O |
|
AD22298 | 2.48 | 260.34 | C14H14O2NS | O=[S](=O)N(Cc1ccccc1)Cc1ccccc1 |
|
AD22299 | 0.14 | 209.28 | C8H11N5S | CC(=NNC(=S)NN)c1ccccn1 |
|
AD22300 | 2.68 | 272.72 | C14H11N5Cl | CN(Cc1ccccc1)c1nc(Cl)nc2c1N=C[N]2 |