aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD32701 | 0.22 | 220.15 | C8H7O2N2F3 | O=C(NCCO)c1cc(F)nc(F)c1F |
|
AD32702 | 2.52 | 191.27 | C12H17ON | CCCCCc1ccc(C(N)=O)cc1 |
|
AD32703 | 0.43 | 211.26 | C10H17O2N3 | CC(C)(C)c1cc(C(=O)NCCO)[nH]n1 |
|
AD32704 | 2.51 | 203.27 | C11H9ONS | NC(=O)c1cccc(-c2ccsc2)c1 |
|
AD32705 | 1.22 | 232.27 | C11H14ON5 | CC1(CNc2ncnc3c2N=C[N]3)CCOC1 |
|
AD32706 | 0.36 | 204.61 | C8H9O3N2Cl | Cc1c(C(=O)NCCO)noc1Cl |
|
AD32707 | 1.96 | 198.65 | C10H11ON2Cl | CC(C)c1ccc(C(N)=O)c(Cl)n1 |
|
AD32708 | 1.0 | 232.27 | C11H14ON5 | CC1CN(c2ncnc3c2N=C[N]3)C(C)CO1 |
|
AD32709 | 1.61 | 234.28 | C11H16ON5 | CC(C)(C)OCCNc1ncnc2c1N=C[N]2 |
|
AD32710 | 1.75 | 230.17 | C8H7N5F3 | FC(F)(F)CCNc1ncnc2c1N=C[N]2 |