aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD35041 | 1.33 | 225.24 | C11H15O4N | COc1cc(OC)c(C2OCCO2)cc1N |
|
AD35042 | 0.82 | 217.23 | C11H11O2N3 | COc1ccc(-n2cc(N)ncc2=O)cc1 |
|
AD35043 | 1.01 | 219.22 | C11H10ON3F | Nc1ccnn(Cc2cccc(F)c2)c1=O |
|
AD35044 | 0.84 | 246.29 | C12H16ON5 | CC1CCN(c2ncnc3c2N=C[N]3)CC1CO |
|
AD35045 | 0.74 | 244.28 | C12H14ON5 | OC1CCC2CCN(c3ncnc4c3N=C[N]4)C12 |
|
AD35046 | 0.15 | 138.19 | C7H12N3 | CN(C)c1cccc(N)[nH+]1 |
|
AD35047 | 0.15 | 138.19 | C7H12N3 | CN(C)c1cc[nH+]c(N)c1 |
|
AD35048 | -1.03 | 244.3 | C12H16N6 | C[NH+](C)C1C2CN(c3ncnc4c3N=C[N]4)CC21 |
|
AD35049 | 0.26 | 213.34 | C12H25ON2 | CC(C)(C)NC1COC2(CC[NH2+]CC2)C1 |
|
AD35050 | -0.32 | 213.34 | C12H25ON2 | C1CC[NH+](CCOCC2CCNCC2)C1 |