aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD05361 | 2.82 | 259.29 | C12H8N4FS | Fc1cccc(CSc2ncnc3c2N=C[N]3)c1 |
|
AD05362 | 0.54 | 254.23 | C11H8ON7 | O=C(NNc1ncnc2c1N=C[N]2)c1cccnc1 |
|
AD05363 | 5.03 | 488.71 | C30H48O5 | C=C(C)C1CCC2(C(=O)O)CCC3(CO)C(CCC4C5(C)CC(O)C(O)C(C)(C)C5CCC43C)C12 |
|
AD05364 | 3.82 | 559.7 | C31H45O8N | CCC1OC(=O)CC(O)C(C)C(O)C(CCNc2ccc(OC(C)=O)cc2)CC(C)C(=O)C=CC(C)=CC1CO |
|
AD05365 | 4.55 | 675.83 | C37H49O7N5 | CCC1OC(=O)CC(O)C(C)C(O)C(CC=O)CC(C)C(=NOCCCc2cn(-c3cnc4ccccc4c3)nn2)C=CC(C)=CC1CO |
|
AD05366 | 5.3 | 326.2 | C16H8N2FCl2S | Fc1ccc(CSC2=Nc3cc(Cl)c(Cl)cc3[N]2)cc1 |
|
AD05367 | 2.82 | 255.33 | C13H11N4S | C1=Nc2c(CSCc3ccccc3)ncnc2[N]1 |
|
AD05368 | 0.51 | 216.22 | C10H10ON5 | O=C1CCCN1Cc1ncnc2c1N=C[N]2 |
|
AD05369 | 0.78 | 115.18 | C6H13ON | CC(C)CCNC=O |
|
AD05370 | -0.53 | 115.13 | C5H9O2N | O=CN1CCOCC1 |