aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD41871 | 0.2 | 312.39 | C14H20O4N2S | O=C(NCCO)C1CCN(S(=O)(=O)c2ccccc2)CC1 |
|
AD41872 | 1.41 | 229.34 | C12H25O2N2 | CCC1CC([NH3+])CCN1C(=O)OC(C)(C)C |
|
AD41873 | 2.21 | 309.34 | C14H15O5NS | COc1ccc(S(=O)(=O)Nc2ccc(O)cc2)cc1OC |
|
AD41874 | 1.65 | 243.37 | C13H27O2N2 | CC(C)C1CC([NH3+])CCN1C(=O)OC(C)(C)C |
|
AD41875 | 1.72 | 240.37 | C14H26O2N | [NH3+]C1CCC(C2CCC3(CC2)OCCO3)CC1 |
|
AD41876 | -0.22 | 225.25 | C10H15O3N3 | O=c1[nH]cc(NC2(CO)CCCC2)c(=O)[nH]1 |
|
AD41877 | 1.62 | 215.11 | C9H13NBr | CC([NH3+])Cc1ccc(Br)cc1 |
|
AD41878 | 1.8 | 255.38 | C14H27O2N2 | CC(C)(C)OC(=O)N1CCC2(CCCC([NH3+])C2)C1 |
|
AD41879 | 1.41 | 241.35 | C13H25O2N2 | CC(C)(C)OC(=O)N1CC2(CCC([NH3+])CC2)C1 |
|
AD41880 | 0.28 | 330.38 | C15H26O6N2 | COC(=O)C1CC(C(=O)NCCO)CCN1C(=O)OC(C)(C)C |