aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD39671 | 1.54 | 295.33 | C15H15ON6 | Cc1ccc(C(=O)NCCNc2ncnc3c2N=C[N]3)cc1 |
|
AD39672 | 1.55 | 312.31 | C15H14O3N5 | COC(=O)COc1cccc(CNc2ncnc3c2N=C[N]3)c1 |
|
AD39673 | 1.61 | 301.37 | C15H21ON6 | CCC1CN(c2ncnc3c2N=C[N]3)C(CC)CN1C(C)=O |
|
AD39674 | 1.19 | 293.31 | C15H13ON6 | O=C1CN(c2ncnc3c2N=C[N]3)CN1Cc1ccccc1 |
|
AD39675 | 1.83 | 295.33 | C15H15ON6 | C1=Nc2c(ncnc2N2CCC(Oc3ccccn3)CC2)[N]1 |
|
AD39676 | 1.38 | 311.3 | C15H12ON6F | O=C1CN(c2ncnc3c2N=C[N]3)CCN1c1cccc(F)c1 |
|
AD39677 | 1.93 | 298.33 | C15H16O2N5 | COc1ccc(C(CCO)Nc2ncnc3c2N=C[N]3)cc1 |
|
AD39678 | 1.62 | 314.33 | C14H16O2N7 | CCOC(=O)C(C)(C)n1cc(Nc2ncnc3c2N=C[N]3)cn1 |
|
AD39679 | 1.72 | 312.36 | C15H18ON7 | COCCn1cc2c(n1)C(Nc1ncnc3c1N=C[N]3)CCC2 |
|
AD39680 | 1.79 | 316.37 | C14H14O2N5S | CCS(=O)(=O)c1cccc(CNc2ncnc3c2N=C[N]3)c1 |