aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD42251 | 2.5 | 279.37 | C13H17O2N3S | CC(C)(C)OC(=O)N1CCc2c(sc(N)c2C#N)C1 |
|
AD42252 | 1.1 | 333.39 | C17H23O4N3 | CC(C)(C)OC(=O)NC(Cc1cccc(C#N)c1)C(=O)NCCO |
|
AD42253 | 1.46 | 359.18 | C9H8N6SI | C=CCNC(=S)Nc1nc(I)nc2c1N=C[N]2 |
|
AD42254 | -0.41 | 125.18 | C6H11N3 | N#CC1CC(N)CCN1 |
|
AD42255 | 1.34 | 344.14 | C10H11ON5I | C=CC(C)(O)CNc1nc(I)nc2c1N=C[N]2 |
|
AD42256 | 1.73 | 358.16 | C11H13ON5I | C=CCCC(O)CNc1nc(I)nc2c1N=C[N]2 |
|
AD42257 | 1.81 | 343.15 | C11H12ON4I | C=CC(C)(O)CNc1ncnc2c1C(I)=C[N]2 |
|
AD42258 | 0.95 | 330.11 | C9H9ON5I | C=CC(O)CNc1nc(I)nc2c1N=C[N]2 |
|
AD42259 | 1.42 | 329.12 | C10H10ON4I | C=CC(O)CNc1ncnc2c1C(I)=C[N]2 |
|
AD42260 | 2.24 | 237.28 | C11H17O2N4 | C=CCN(CC1=C[N]N=N1)C(=O)OC(C)(C)C |