aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD36231 | 3.15 | 228.23 | C13H9ON2F | N#Cc1cc(Nc2ccc(O)cc2)ccc1F |
|
AD36232 | 2.45 | 252.23 | C13H7N5F | N#Cc1cc(Nc2ncnc3c2C=C[N]3)ccc1F |
|
AD36233 | 3.08 | 231.29 | C14H17O2N | CC1(C)CC(=O)C=C(Nc2ccc(O)cc2)C1 |
|
AD36234 | 2.02 | 249.26 | C13H9N6 | Cc1cc(Nc2ncnc3c2C=C[N]3)cnc1C#N |
|
AD36235 | 2.71 | 225.25 | C13H11ON3 | Cc1cc(Nc2ccc(O)cc2)cnc1C#N |
|
AD36236 | 2.57 | 219.31 | C12H13ONS | C#CC(C)(C)C(=O)Nc1ccc(S)cc1 |
|
AD36237 | 2.72 | 266.31 | C13H8N5S | Cc1cc(Sc2ncnc3c2N=C[N]3)ccc1C#N |
|
AD36238 | 2.72 | 219.31 | C12H13ONS | CCCC#CC(=O)Nc1ccc(S)cc1 |
|
AD36239 | 3.27 | 233.34 | C13H15ONS | C=C1CC(C)(C(=O)Nc2ccc(S)cc2)C1 |
|
AD36240 | 3.32 | 224.26 | C14H12ON2 | Cc1ccc(C#N)cc1Nc1ccc(O)cc1 |