aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD40101 | 1.76 | 313.39 | C16H21ON6 | CC(=O)N1CCN(c2ncnc3c2N=C[N]3)CC12CCCCC2 |
|
AD40102 | 1.46 | 299.28 | C12H14N6F3 | CC1CN(c2ncnc3c2N=C[N]3)CCN1CC(F)(F)F |
|
AD40103 | 1.55 | 295.32 | C13H17N6F2 | CCC1CN(c2ncnc3c2N=C[N]3)CCN1CC(F)F |
|
AD40104 | 1.39 | 308.32 | C15H14ON7 | O=C1C(Nc2ncnc3c2N=C[N]3)CCCN1c1cccnc1 |
|
AD40105 | 1.82 | 297.34 | C15H17ON6 | COCCCN(Cc1ccncc1)c1ncnc2c1N=C[N]2 |
|
AD40106 | 1.35 | 297.27 | C14H10ON6F | O=C1C(Nc2ncnc3c2N=C[N]3)CN1c1ccc(F)cc1 |
|
AD40107 | 1.48 | 295.28 | C14H11O2N6 | CN1C(=O)COc2cc(Nc3ncnc4c3N=C[N]4)ccc21 |
|
AD40108 | 1.74 | 308.32 | C16H14O2N5 | COC(=O)c1ccc2c(c1)CN(c1ncnc3c1N=C[N]3)CC2 |
|
AD40109 | 1.18 | 308.39 | C13H18O2N5S | CCC1(CC)CN(c2ncnc3c2N=C[N]3)CCS1(=O)=O |
|
AD40110 | 1.68 | 295.33 | C15H15ON6 | CNC(=O)CC(Nc1ncnc2c1N=C[N]2)c1ccccc1 |