aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD31821 | 1.17 | 176.22 | C9H12N4 | Cc1cc(C)c2c(N)nn(C)c2n1 |
|
AD31822 | 0.5 | 179.22 | C9H13ON3 | Nc1ncccc1N1CCOCC1 |
|
AD31823 | 1.68 | 185.25 | C8H11O2NS | CCc1cc(C(=O)OC)c(N)s1 |
|
AD31824 | 0.62 | 176.18 | C8H8ON4 | COc1ccc2nc(N)nnc2c1 |
|
AD31825 | 1.73 | 187.04 | C6H7N2Br | Cc1ccc(Br)nc1N |
|
AD31826 | 0.38 | 186.24 | C7H10O2N2S | Cc1nc(S(C)(=O)=O)ccc1N |
|
AD31827 | 0.95 | 177.25 | C11H15ON | OC1CCNC1Cc1ccccc1 |
|
AD31828 | 1.3 | 187.24 | C9H17O3N | CC(C)(C)OC(=O)OC1CCNC1 |
|
AD31829 | 1.2 | 182.61 | C8H7N4Cl | Cn1nc(N)c2ccc(Cl)nc21 |
|
AD31830 | 1.26 | 176.26 | C11H16N2 | CN1CCNC(c2ccccc2)C1 |