aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD42811 | 1.27 | 326.38 | C17H20O2N5 | CC1CCN(C(=O)c2ccc(NC3=C(C(N)=O)N=C[N]3)cc2)CC1 |
|
AD42812 | 2.27 | 295.33 | C15H15ON6 | CC(C)NC(=O)c1ccc(Nc2ncnc3c2N=C[N]3)cc1 |
|
AD42813 | 1.91 | 322.35 | C17H16O2N5 | O=C(c1cccc(Nc2ncnc3c2C=C[N]3)c1)N1CCOCC1 |
|
AD42814 | 2.66 | 309.35 | C16H17ON6 | CCCCNC(=O)c1cccc(Nc2ncnc3c2N=C[N]3)c1 |
|
AD42815 | 3.19 | 314.41 | C17H18O2N2S | O=C(c1cccc(Nc2ccc(S)cc2)c1)N1CCOCC1 |
|
AD42816 | 1.27 | 326.38 | C17H20O2N5 | CC1CCN(C(=O)c2cccc(NC3=C(C(N)=O)N=C[N]3)c2)CC1 |
|
AD42817 | 2.52 | 309.35 | C16H17ON6 | CC(C)CNC(=O)c1cccc(Nc2ncnc3c2N=C[N]3)c1 |
|
AD42818 | 2.27 | 295.33 | C15H15ON6 | CC(C)NC(=O)c1cccc(Nc2ncnc3c2N=C[N]3)c1 |
|
AD42819 | 2.8 | 321.36 | C17H17ON6 | O=C(NC1CCCC1)c1cccc(Nc2ncnc3c2N=C[N]3)c1 |
|
AD42820 | 2.61 | 298.34 | C17H18O3N2 | O=C(c1cccc(Nc2ccc(O)cc2)c1)N1CCOCC1 |