aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD33811 | 0.81 | 259.29 | C12H15ON6 | CC(C)N1CC(Nc2ncnc3c2N=C[N]3)CC1=O |
|
AD33812 | 0.0 | 244.23 | C11H10O2N5 | CC(=O)c1ccc(NC2=C(C(N)=O)N=C[N]2)cn1 |
|
AD33813 | 0.0 | 244.23 | C11H10O2N5 | CC(=O)c1cc(NC2=C(C(N)=O)N=C[N]2)ccn1 |
|
AD33814 | -0.14 | 245.27 | C11H13ON6 | CN(C)c1cncc(NC2=C(C(N)=O)N=C[N]2)c1 |
|
AD33815 | -0.06 | 246.25 | C11H12O2N5 | COCc1cncc(NC2=C(C(N)=O)N=C[N]2)c1 |
|
AD33816 | -0.42 | 260.23 | C11H10O3N5 | COC(=O)c1cncc(NC2=C(C(N)=O)N=C[N]2)c1 |
|
AD33817 | -1.42 | 255.28 | C9H11O3N4S | NC(=O)C1=C(NC2=CCS(=O)(=O)CC2)[N]C=N1 |
|
AD33818 | 0.67 | 247.28 | C11H15ON6 | CCN(CC)C(=O)CNc1ncnc2c1N=C[N]2 |
|
AD33819 | 0.25 | 247.24 | C10H11O2N6 | COC(=O)N1CC(Nc2ncnc3c2N=C[N]3)C1 |
|
AD33820 | 0.64 | 261.27 | C11H13O2N6 | COC(=O)N1CC(C)(Nc2ncnc3c2N=C[N]3)C1 |