aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD36981 | -0.47 | 274.3 | C10H14O5N2S | CCOC(=O)c1ccncc1S(=O)(=O)NCCO |
|
AD36982 | 1.22 | 242.08 | C8H8ON3Br | NC(=O)c1nc(C2CC2)ncc1Br |
|
AD36983 | 1.32 | 245.23 | C13H11O4N | NC(=O)c1occc(=O)c1OCc1ccccc1 |
|
AD36984 | 0.7 | 259.28 | C10H13O5NS | CCOC(=O)CS(=O)(=O)Nc1ccc(O)cc1 |
|
AD36985 | -0.65 | 258.3 | C10H14O4N2S | CS(=O)(=O)Cc1ncccc1C(=O)NCCO |
|
AD36986 | 1.35 | 251.28 | C13H17O4N | COc1cc(C(N)=O)ccc1OC1CCOCC1 |
|
AD36987 | 0.53 | 247.23 | C12H10O2N3F | NC(=O)c1nccn(Cc2ccc(F)cc2)c1=O |
|
AD36988 | -0.23 | 264.28 | C13H16O4N2 | O=C(NCCO)c1ccc(N2CCOCC2=O)cc1 |
|
AD36989 | 1.4 | 250.12 | C7H8O2NSBr | Cc1c(Br)cccc1S(N)(=O)=O |
|
AD36990 | 0.58 | 244.25 | C13H12O3N2 | NC(=O)c1cccc(=O)n1OCc1ccccc1 |