aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD31291 | 1.1 | 193.2 | C10H11O3N | CCC(=O)Oc1cccc(C(N)=O)c1 |
|
AD31292 | -0.13 | 209.25 | C10H15O2N3 | CN(C)c1ccc(C(=O)NCCO)nc1 |
|
AD31293 | 0.28 | 209.23 | C8H7O2N3S | NS(=O)(=O)c1ccc2nccnc2c1 |
|
AD31294 | -0.13 | 209.25 | C10H15O2N3 | CN(C)c1cnccc1C(=O)NCCO |
|
AD31295 | 0.37 | 188.19 | C9H8ON4 | NC(=O)c1cncn1-c1ccccn1 |
|
AD31296 | -0.13 | 209.25 | C10H15O2N3 | CN(C)c1cccnc1C(=O)NCCO |
|
AD31297 | 0.38 | 192.63 | C6H5O2N2ClS | NS(=O)(=O)c1cccc(Cl)n1 |
|
AD31298 | -0.34 | 216.26 | C8H12O3N2S | Cc1ccc(S(=O)(=O)NCCO)cn1 |
|
AD31299 | 0.33 | 195.22 | C9H13O2N3 | NC(=O)c1cn(C2CCOCC2)cn1 |
|
AD31300 | -1.0 | 219.27 | C7H13O3N3S | Cc1ncc(S(=O)(=O)NCCO)n1C |