aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD27351 | -0.86 | 201.27 | C8H13O2N2S | [NH3+]C(C(=O)NCCO)c1ccsc1 |
|
AD27352 | 0.08 | 165.22 | C8H13N4 | Nc1nc(N2CCCC2)cc[nH+]1 |
|
AD27353 | 0.39 | 179.25 | C9H15N4 | Cc1nc(N)cc(N2CCCC2)[nH+]1 |
|
AD27354 | 0.47 | 179.25 | C9H15N4 | Nc1cc[nH+]c(N2CCCCC2)n1 |
|
AD27355 | -0.16 | 178.26 | C10H16N3 | C[NH+](Cc1ccc(N)nc1)C1CC1 |
|
AD27356 | 0.47 | 179.25 | C9H15N4 | Nc1nc(N2CCCCC2)cc[nH+]1 |
|
AD27357 | -0.69 | 181.22 | C8H13ON4 | Nc1cc[nH+]c(N2CCOCC2)n1 |
|
AD27358 | -3.26 | 189.23 | C8H17O3N2 | O=C(C[NH+]1CCC(O)C1)NCCO |
|
AD27359 | -2.45 | 187.22 | C8H15O3N2 | COC(=O)C1CC[NH+](CC(N)=O)C1 |
|
AD27360 | -1.98 | 187.26 | C9H19O2N2 | C[NH+]1CCCC(C(=O)NCCO)C1 |