aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD41021 | 0.32 | 144.17 | C7H12O3 | COC(=O)C1CCC(O)C1 |
|
AD41022 | 0.32 | 132.16 | C6H12O3 | CCOC(=O)C(O)CC |
|
AD41023 | 0.32 | 144.17 | C7H12O3 | COC(=O)C1(C)CC(O)C1 |
|
AD41024 | 1.72 | 279.28 | C14H11ON6 | CN1Cc2c(Nc3ncnc4c3N=C[N]4)cccc2C1=O |
|
AD41025 | 1.72 | 279.28 | C14H11ON6 | CN1Cc2ccc(Nc3ncnc4c3N=C[N]4)cc2C1=O |
|
AD41026 | 1.2 | 317.31 | C13H9O4N4S | O=C(O)c1ccc(S(=O)(=O)Nc2ncnc3c2C=C[N]3)cc1 |
|
AD41027 | 1.2 | 317.31 | C13H9O4N4S | O=C(O)c1cccc(S(=O)(=O)Nc2ncnc3c2C=C[N]3)c1 |
|
AD41028 | 1.5 | 331.33 | C14H11O4N4S | Cc1ccc(S(=O)(=O)Nc2ncnc3c2C=C[N]3)cc1C(=O)O |
|
AD41029 | 1.5 | 331.33 | C14H11O4N4S | Cc1ccc(C(=O)O)cc1S(=O)(=O)Nc1ncnc2c1C=C[N]2 |
|
AD41030 | 1.51 | 345.36 | C15H13O4N4S | O=C(O)CCc1ccc(S(=O)(=O)Nc2ncnc3c2C=C[N]3)cc1 |