aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD00741 | -0.85 | 374.44 | C16H30O6N4 | COC(=O)NC(C)C(=O)NC(CCC(N)=O)C(=O)NCCCCCCO |
|
AD00742 | 2.59 | 286.3 | C12H8O2N5S | O=[N+]([O-])c1cccc(CSc2ncnc3c2N=C[N]3)c1 |
|
AD00743 | 6.5 | 468.68 | C30H44O4 | CC(=CCCC(C)C1CCC2(C)C3=CCC4C(C)(C)C(=O)CCC4(C)C3=CC(O)C12C)C(=O)O |
|
AD00744 | 5.4 | 356.46 | C22H28O4 | CCCCCCCOc1ccc(C(=O)OC)c(OCc2ccccc2)c1 |
|
AD00745 | 4.63 | 348.4 | C22H20O4 | COC(=O)c1ccc(OCc2ccccc2)cc1OCc1ccccc1 |
|
AD00746 | 2.29 | 254.32 | C14H16N5 | Nc1nc(C#CCC2CCCCC2)nc2c1N=C[N]2 |
|
AD00747 | -0.41 | 313.38 | C11H13O3N4S2 | Nc1nc(=O)n(C2CCCS2)cc1C#CCN[S](=O)=O |
|
AD00748 | 2.01 | 104.22 | C5H12S | CSCC(C)C |
|
AD00749 | 1.74 | 273.71 | C13H10N6Cl | Nc1ncnc2c1N=C(NCc1ccccc1Cl)[N]2 |
|
AD00750 | 4.68 | 521.7 | C32H43O5N | CN(C)c1ccc(C=C2OC(=O)C=C2C2CCC3(O)C4CCC5CC(O)CCC5(C)C4CC(O)C23C)cc1 |