aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD43781 | 0.05 | 136.18 | C7H10N3 | Nc1[nH+]ccc2c1CCN2 |
|
AD43782 | -0.15 | 329.4 | C17H23O2N5 | NC(=O)C1=C(Nc2ccc(OCC[NH+]3CCCCC3)cc2)[N]C=N1 |
|
AD43783 | 1.86 | 298.41 | C18H24ON3 | CC[NH+]1CCN(c2ccc(Nc3ccc(O)cc3)cc2)CC1 |
|
AD43784 | 1.17 | 322.42 | C18H22N6 | CC[NH+]1CCN(c2ccc(Nc3ncnc4c3C=C[N]4)cc2)CC1 |
|
AD43785 | 0.0 | 325.38 | C16H19ON7 | C[NH+](C)CCNC(=O)c1ccc(Nc2ncnc3c2N=C[N]3)cc1 |
|
AD43786 | 0.7 | 338.42 | C18H22ON6 | C[NH+](C)CCCNC(=O)c1ccc(Nc2ncnc3c2C=C[N]3)cc1 |
|
AD43787 | 0.31 | 324.39 | C17H20ON6 | C[NH+](C)CCNC(=O)c1ccc(Nc2ncnc3c2C=C[N]3)cc1 |
|
AD43788 | -0.59 | 124.17 | C6H10N3 | Nc1cc(C[NH3+])ccn1 |
|
AD43789 | -0.03 | 124.17 | C6H10N3 | Cc1c(N)cc[nH+]c1N |
|
AD43790 | 0.87 | 313.34 | C13H24O3N2F3 | CC(C)(C)OC(=O)N1CCC([NH2+]CCO)CC1C(F)(F)F |