aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD06771 | -1.34 | 226.28 | C5H10O4N2S2 | COS(=O)(=O)NC(=O)C1CSCN1 |
|
AD06772 | 1.12 | 164.15 | C6H6ON5 | CCOc1ncnc2c1N=N[N]2 |
|
AD06773 | 4.1 | 296.4 | C17H16ON2S | CC(=O)C=Cc1cccc(NC(=S)Nc2ccccc2)c1 |
|
AD06774 | 0.44 | 238.27 | C10H10O3N2S | CNS(=O)(=O)c1c[nH]c2ccccc2c1=O |
|
AD06775 | 3.13 | 434.57 | C25H38O6 | CCC1C=C(C)C(O)CC=CC=C(CO)C(=O)OC(C(C)O)CC=C(C)C=C(C)C1O |
|
AD06776 | 4.1 | 305.36 | C17H11ON3S | O=C(Nc1cccc2cccnc12)c1ccc2scnc2c1 |
|
AD06777 | 1.25 | 176.12 | C4H2N9 | [N-]=[N+]=Nc1nc(N)c2c(n1)[N]N=N2 |
|
AD06778 | 1.69 | 289.72 | C15H12O2N3Cl | O=c1n(Cc2ccccc2Cl)nc2ccc(CO)cn12 |
|
AD06779 | 2.85 | 294.14 | C15H9ON3Cl2 | O=c1n(Cc2ccccc2Cl)nc2ccc(Cl)cn12 |
|
AD06780 | -1.66 | 317.34 | C13H23O6N3 | CC(O)C(=O)NC(C(=O)NC(CCC(=O)O)C(N)=O)C(C)C |