aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD10751 | 2.76 | 284.37 | C14H14N5S | CSc1nc2c(c(NCCc3ccccc3)n1)N=C[N]2 |
|
AD10752 | 3.93 | 326.45 | C17H20N5S | CCCCSc1nc2c(c(NCCc3ccccc3)n1)N=C[N]2 |
|
AD10753 | 2.77 | 314.39 | C15H16ON5S | COc1cccc(CCNc2nc(SC)nc3c2N=C[N]3)c1 |
|
AD10754 | 3.54 | 312.42 | C16H18N5S | CCCSc1nc2c(c(NCCc3ccccc3)n1)N=C[N]2 |
|
AD10755 | 2.01 | 254.27 | C13H12ON5 | Cc1cccc(CNc2ncnc3c2N=C[N]3)c1O |
|
AD10756 | 1.53 | 203.2 | C11H9O3N | Cc1ccc2[nH]cc(C(=O)O)c(=O)c2c1 |
|
AD10757 | 2.42 | 278.22 | C12H7N5F3 | Fc1cc(F)c(CNc2ncnc3c2N=C[N]3)cc1F |
|
AD10758 | -0.17 | 129.14 | C3H3ON3S | O=c1cn[nH]c(=S)[nH]1 |
|
AD10759 | 2.28 | 158.18 | C9H8N3 | Cc1ccccc1C1=C[N]N=N1 |
|
AD10760 | -1.43 | 114.11 | C3H6ON4 | NC1=NC(=O)NCN1 |