aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD24051 | 1.17 | 189.17 | C9H7O2N3 | O=C(O)c1ccc(-c2nnc[nH]2)cc1 |
|
AD24052 | 2.49 | 213.16 | C9H6N3F3 | FC(F)(F)c1ccc(-c2nnc[nH]2)cc1 |
|
AD24053 | 1.27 | 191.17 | C8H7O2N4 | O=[N+](O)c1ccc(-c2nc[nH]n2)cc1 |
|
AD24054 | 1.48 | 175.19 | C9H9ON3 | COc1ccc(-c2ncn[nH]2)cc1 |
|
AD24055 | 1.05 | 160.18 | C8H8N4 | Nc1ccc(-c2nnc[nH]2)cc1 |
|
AD24056 | 0.18 | 240.24 | C9H8O4N2S | COS(=O)(=O)NC(=O)c1cccc(C#N)c1 |
|
AD24057 | 4.08 | 231.45 | C13H29NS | CCCCCCCCCCNCCSC |
|
AD24058 | 1.6 | 246.15 | C9H11O6P | COP(=O)(O)OC(=O)c1c(C)cccc1O |
|
AD24059 | 1.3 | 232.13 | C8H9O6P | COP(=O)(O)OC(=O)c1ccccc1O |
|
AD24060 | 1.6 | 246.15 | C9H11O6P | COP(=O)(O)OC(=O)c1cc(C)ccc1O |