aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD38881 | 2.57 | 289.39 | C14H23N7 | CN=Nc1nc(N2CCCCC2)nc(N2CCCCC2)n1 |
|
AD38882 | 0.26 | 293.33 | C12H19O2N7 | CN=Nc1nc(N2CCOCC2)nc(N2CCOCC2)n1 |
|
AD38883 | -0.07 | 314.29 | C13H12O3N7 | COc1cc(C=NNC2=Nc3c(nc(N)[nH]c3=O)[N]2)ccc1O |
|
AD38884 | 0.74 | 303.22 | C10H7O4N8 | Nc1nc2c(c(=O)[nH]1)N=C(N=NCc1ccc([N+](=O)[O-])o1)[N]2 |
|
AD38885 | 1.37 | 299.27 | C13H11O3N6 | COc1ccc(CN=NC2=Nc3c(nc[nH]c3=O)[N]2)c(O)c1 |
|
AD38886 | 1.21 | 279.36 | C5H13O6NS3 | CS(=O)(=O)CCCC(S)=NOS(O)(O)O |
|
AD38887 | 2.51 | 279.34 | C9H13O5NS2 | OC(CC(S)=NOS(O)(O)O)c1ccccc1 |
|
AD38888 | 2.06 | 275.37 | C6H13O5NS3 | CS(=O)C=CCCC(S)=NOS(O)(O)O |
|
AD38889 | 0.36 | 278.3 | C15H18O5 | CC1=C2C(=O)C=C(CO)C2C2OC(=O)C(C)C2C(O)C1 |
|
AD38890 | -0.05 | 294.25 | C13H8O2N7 | O=C1Nc2ccccc2C1=NNC1=Nc2c(nc[nH]c2=O)[N]1 |