aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD43841 | 2.89 | 334.17 | C15H12O3NBr | Nc1c(CC(=O)O)cccc1C(=O)c1ccc(Br)cc1 |
|
AD43842 | 2.71 | 311.37 | C16H13O2N3S | O=C(Nc1ccc(S)cc1)c1cc(=O)n(-c2ccccc2)[nH]1 |
|
AD43843 | 2.68 | 347.4 | C19H19ON6 | CC=CC=CC(=O)N(CCc1ccc(N)cc1)c1ncnc2c1N=C[N]2 |
|
AD43844 | 2.3 | 355.45 | C17H19ON6S | CSCCC(=O)N(CCc1ccc(N)cc1)c1ncnc2c1N=C[N]2 |
|
AD43845 | 2.2 | 335.39 | C18H19ON6 | CC1CC1C(=O)N(CCc1ccc(N)cc1)c1ncnc2c1N=C[N]2 |
|
AD43846 | 2.51 | 347.4 | C19H19ON6 | Nc1ccc(CCN(C(=O)C2CC=CC2)c2ncnc3c2N=C[N]3)cc1 |
|
AD43847 | 2.82 | 304.38 | C14H16O2N4S | CN(C)c1ccc(N=Nc2ccc(S(N)(=O)=O)cc2)cc1 |
|
AD43848 | 2.59 | 349.42 | C19H21ON6 | CC1(C)CC1C(=O)N(CCc1ccc(N)cc1)c1ncnc2c1N=C[N]2 |
|
AD43849 | 2.84 | 351.43 | C19H23ON6 | CC(C)C(C)C(=O)N(CCc1ccc(N)cc1)c1ncnc2c1N=C[N]2 |
|
AD43850 | 2.43 | 345.39 | C19H17ON6 | Nc1ccc(CCN(C(=O)C2=CC=CC2)c2ncnc3c2N=C[N]3)cc1 |