aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD39901 | 1.0 | 316.16 | C8H8ON6SBr | COCNC(=S)Nc1ncnc2c1N=C(Br)[N]2 |
|
AD39902 | 0.61 | 280.32 | C14H20O4N2 | O=C(NCCO)c1cnccc1OCC1CCOCC1 |
|
AD39903 | 2.08 | 276.34 | C15H20O3N2 | CC(C)(C)OC(=O)N1CCc2cccc(C(N)=O)c2C1 |
|
AD39904 | 0.61 | 280.32 | C14H20O4N2 | O=C(NCCO)c1ccncc1OCC1CCOCC1 |
|
AD39905 | 2.07 | 277.35 | C13H15O2N3S | COCCn1ccnc1C(=O)Nc1ccc(S)cc1 |
|
AD39906 | 0.61 | 280.32 | C14H20O4N2 | O=C(NCCO)c1cncc(OCC2CCOCC2)c1 |
|
AD39907 | 0.41 | 292.08 | C8H9O2N2I | O=C(NCCO)c1cccnc1I |
|
AD39908 | 2.27 | 270.32 | C13H10ON4S | O=C(Nc1ccc(S)cc1)c1cnn2ccncc12 |
|
AD39909 | 0.93 | 292.34 | C12H14O2N5S | CCOC(=O)C(C)NC(=S)Nc1ncnc2c1C=C[N]2 |
|
AD39910 | 1.23 | 310.33 | C12H13O2N5FS | CCOC(=O)C(C)NC(=S)Nc1ncnc2c1C(F)=C[N]2 |