aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD35211 | 0.0 | 228.32 | C10H16O2N2S | O=CN1CC2CC(C1)N(C(=O)CCS)C2 |
|
AD35212 | 0.14 | 228.32 | C10H16O2N2S | O=CN1CC2CCC(C1)N2C(=O)CCS |
|
AD35213 | -0.52 | 200.19 | C9H10ON2F2 | C#CCN1CC2(F)CNCC2(F)C1=O |
|
AD35214 | 0.03 | 202.2 | C9H12ON2F2 | C=CCN1CC2(F)CNCC2(F)C1=O |
|
AD35215 | -0.65 | 228.2 | C10H10O2N2F2 | C#CCN1CC2(F)CN(C=O)CC2(F)C1=O |
|
AD35216 | -0.1 | 230.21 | C10H12O2N2F2 | C=CCN1CC2(F)CN(C=O)CC2(F)C1=O |
|
AD35217 | 1.63 | 228.22 | C10H13O3N2F | COc1ccc([N+](=O)[O-])c(CC(C)N)c1F |
|
AD35218 | 1.64 | 226.08 | C8H5O2NCl2S | NS(=O)(=O)c1cc(Cl)ccc1Cl |
|
AD35219 | 1.63 | 213.3 | C10H15O2NS | CC(C)(C)c1ccc(S(N)(=O)=O)cc1 |
|
AD35220 | 1.9 | 228.23 | C12H10O2N3 | C#CCOc1cccc(OCC2=C[N]N=N2)c1 |