aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD42441 | 1.85 | 351.75 | C14H8O4N4ClS | O=C(O)c1ccc(Cl)c(S(=O)(=O)Nc2ncnc3c2C=C[N]3)c1 |
|
AD42442 | 1.85 | 351.75 | C14H8O4N4ClS | O=C(O)c1cc(S(=O)(=O)Nc2ncnc3c2C=C[N]3)ccc1Cl |
|
AD42443 | 2.79 | 274.69 | C13H9ON5Cl | COc1ccc(Nc2ncnc3c2N=C[N]3)cc1Cl |
|
AD42444 | 2.74 | 267.3 | C12H7N6S | C1=Nc2c(ncnc2Nc2ccc3ncsc3c2)[N]1 |
|
AD42445 | 2.73 | 279.33 | C15H15N6 | C1=Nc2c(ncnc2Nc2cccc(N3CCCC3)c2)[N]1 |
|
AD42446 | 2.73 | 279.33 | C15H15N6 | C1=Nc2c(ncnc2Nc2ccc(N3CCCC3)cc2)[N]1 |
|
AD42447 | 2.75 | 268.3 | C14H14ON5 | COc1c(C)cc(Nc2ncnc3c2N=C[N]3)cc1C |
|
AD42448 | 2.75 | 268.3 | C14H14ON5 | COc1cc(C)c(Nc2ncnc3c2N=C[N]3)cc1C |
|
AD42449 | 2.79 | 274.69 | C13H9ON5Cl | COc1cc(Nc2ncnc3c2N=C[N]3)ccc1Cl |
|
AD42450 | 2.79 | 274.69 | C13H9ON5Cl | COc1cccc(Nc2ncnc3c2N=C[N]3)c1Cl |