aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD39721 | 1.54 | 292.29 | C13H15O2N5F | O=C(NCC1CCOCC1)Nc1ncnc2c1C(F)=C[N]2 |
|
AD39722 | 1.71 | 284.36 | C17H20O2N2 | NC(=O)C1CC=CC2CCN(Cc3ccccc3)C(=O)C21 |
|
AD39723 | 2.33 | 268.31 | C14H18ON2F2 | CC(c1ccccc1)N1CCC(F)(F)CC1C(N)=O |
|
AD39724 | 0.86 | 298.13 | C8H9O3NFSBr | O=S(=O)(NCCO)c1ccc(F)c(Br)c1 |
|
AD39725 | 1.11 | 311.71 | C12H12O3N6Cl | CCOC(=O)CCNC(=O)Nc1nc(Cl)nc2c1N=C[N]2 |
|
AD39726 | 1.07 | 294.27 | C12H13O3N5F | CCOC(=O)CCNC(=O)Nc1ncnc2c1C(F)=C[N]2 |
|
AD39727 | 0.99 | 286.37 | C14H26O4N2 | CC(C)(C)OC(=O)N1CC(C(=O)NCCO)C(C)(C)C1 |
|
AD39728 | 1.63 | 266.37 | C13H18O2N2S | CC(C(=O)Nc1ccc(S)cc1)N1CCOCC1 |
|
AD39729 | 0.32 | 281.75 | C8H8O3N3ClS2 | O=S(=O)(NCCO)c1c(Cl)nc2sccn12 |
|
AD39730 | 0.51 | 302.37 | C14H26O5N2 | COC1CCN(C(=O)OC(C)(C)C)C(C(=O)NCCO)C1 |