aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD40091 | 1.89 | 307.34 | C16H15ON6 | O=C(NC1CC1)c1cccc(CNc2ncnc3c2N=C[N]3)c1 |
|
AD40092 | 1.24 | 311.32 | C15H15O2N6 | COc1ccc(C(=O)NCCNc2ncnc3c2N=C[N]3)cc1 |
|
AD40093 | 1.09 | 307.29 | C15H11O2N6 | O=C1c2ccccc2C(=O)N1CCNc1ncnc2c1N=C[N]2 |
|
AD40094 | 1.88 | 315.74 | C15H12ON6Cl | O=C(NCCNc1ncnc2c1N=C[N]2)c1ccccc1Cl |
|
AD40095 | 1.78 | 307.34 | C16H15ON6 | O=C(CNc1ncnc2c1N=C[N]2)N1CCCc2ccccc21 |
|
AD40096 | 1.55 | 298.33 | C15H16O2N5 | Cc1cccc(OCC(O)CNc2ncnc3c2N=C[N]3)c1 |
|
AD40097 | 1.94 | 302.36 | C15H20O2N5 | CC(C)(C)OC(=O)C1CCN(c2ncnc3c2N=C[N]3)CC1 |
|
AD40098 | 1.76 | 313.32 | C15H14ON6F | O=C(NCCCNc1ncnc2c1N=C[N]2)c1cccc(F)c1 |
|
AD40099 | 1.38 | 307.34 | C16H15ON6 | O=C(CNc1ncnc2c1N=C[N]2)N1CCc2ccccc2C1 |
|
AD40100 | 1.73 | 299.36 | C15H19ON6 | O=C1CC(Nc2ncnc3c2N=C[N]3)CN1C1CCCCC1 |