aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD41721 | 0.39 | 310.35 | C14H22O4N4 | Cn1nc2c(c1C(=O)NCCO)CN(C(=O)OC(C)(C)C)C2 |
|
AD41722 | 0.79 | 320.37 | C15H22O3N5 | CC(C)(C)OC(=O)N1CCC(=CNC2=C(C(N)=O)N=C[N]2)CC1 |
|
AD41723 | 2.26 | 302.4 | C15H18ON4S | CN1CCCn2nc(C(=O)Nc3ccc(S)cc3)cc2C1 |
|
AD41724 | 0.57 | 348.41 | C15H18O3N5S | NC(=O)C1=C(Nc2ccccc2S(=O)(=O)N2CCCCC2)[N]C=N1 |
|
AD41725 | 1.02 | 318.33 | C15H17O2N5F | CCN(CC)C(=O)c1ccc(F)c(NC2=C(C(N)=O)N=C[N]2)c1 |
|
AD41726 | 1.82 | 336.17 | C12H12ON6Br | CC(=O)N1CCC(=Nc2ncnc3c2N=C(Br)[N]3)CC1 |
|
AD41727 | 1.87 | 342.12 | C10H9ON5I | Ic1nc2c(c(N=C3CCOCC3)n1)N=C[N]2 |
|
AD41728 | 0.49 | 348.41 | C15H18O3N5S | Cc1ccc(S(=O)(=O)N2CCCC2)cc1NC1=C(C(N)=O)N=C[N]1 |
|
AD41729 | 1.02 | 318.33 | C15H17O2N5F | CCN(CC)C(=O)c1cc(F)cc(NC2=C(C(N)=O)N=C[N]2)c1 |
|
AD41730 | 1.38 | 332.15 | C8H7N5SI | CNC(=S)Nc1ncnc2c1C(I)=C[N]2 |