aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD40541 | 1.9 | 251.31 | C11H13O2N3S | CCOC(=O)c1sc2[nH]c(C)nc(=N)c2c1C |
|
AD40542 | 1.54 | 219.29 | C12H17ON3 | CC1CCN(C(=O)c2ccc(N)nc2)CC1 |
|
AD40543 | 1.39 | 217.23 | C11H11O2N3 | CCOC(=O)c1ccc2ncnc(N)c2c1 |
|
AD40544 | 1.54 | 219.29 | C12H17ON3 | CC1CCCN(C(=O)c2ccc(N)nc2)C1 |
|
AD40545 | 0.73 | 221.26 | C11H15O2N3 | CCOC(=O)C1CCc2nnc(N)cc2C1 |
|
AD40546 | 1.24 | 210.23 | C10H14O3N2 | CCOC(=O)c1cnc(N)cc1OCC |
|
AD40547 | 1.76 | 237.28 | C10H11O2N3S | CCOC(=O)c1sc2ncnc(N)c2c1C |
|
AD40548 | 1.96 | 249.3 | C11H11O2N3S | CCOC(=O)c1cnc(-c2cccs2)nc1N |
|
AD40549 | 1.45 | 223.26 | C9H9O2N3S | CCOC(=O)c1cc2ncnc(N)c2s1 |
|
AD40550 | 1.61 | 212.26 | C12H12N4 | Nc1nc(-c2ccncc2)nc2c1CCC2 |