aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD29251 | -1.08 | 178.19 | C9H10O2N2 | C#CC(=O)N1CC2(CN(C=O)C2)C1 |
|
AD29252 | 1.75 | 160.22 | C10H12N2 | CC(C)(N)c1ccc(C#N)cc1 |
|
AD29253 | 1.16 | 150.16 | C8H7N2F | N#Cc1ccc(CN)cc1F |
|
AD29254 | 1.01 | 158.2 | C10H10N2 | N#CC1(N)Cc2ccccc2C1 |
|
AD29255 | -0.55 | 192.22 | C10H12O2N2 | C#CC(=O)N1CCC2C1CCN2C=O |
|
AD29256 | 0.05 | 168.2 | C8H12O2N2 | COC(=O)C1(C#N)CCNCC1 |
|
AD29257 | 1.42 | 154.12 | C7H4N2F2 | N#Cc1ccc(F)c(F)c1N |
|
AD29258 | -0.05 | 166.14 | C6H6O2N4 | COC(=O)n1ncc(C#N)c1N |
|
AD29259 | 1.69 | 169.19 | C10H7N3 | N#Cc1ccc(N)c2cccnc12 |
|
AD29260 | 0.45 | 155.2 | C8H13O2N | C=CC1CC1(N)C(=O)OCC |