aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD34731 | 1.37 | 215.21 | C11H9O2N3 | NC(=O)c1cc(Oc2cccnc2)ccn1 |
|
AD34732 | 0.99 | 236.27 | C12H16O3N2 | NC(=O)c1ncccc1OCC1CCOCC1 |
|
AD34733 | 0.32 | 251.3 | C9H11ON6S | COCCNC(=S)Nc1ncnc2c1N=C[N]2 |
|
AD34734 | 0.63 | 250.31 | C10H12ON5S | COCCNC(=S)Nc1ncnc2c1C=C[N]2 |
|
AD34735 | -0.62 | 233.23 | C10H11O2N5 | O=C(NCCO)c1cnn(-c2ncccn2)c1 |
|
AD34736 | -0.62 | 237.26 | C11H15O3N3 | O=C(NCCO)c1cnc(=O)n(CC2CC2)c1 |
|
AD34737 | 0.05 | 246.27 | C12H14O2N4 | O=C(NCCO)c1cncn1Cc1ccncc1 |
|
AD34738 | -0.01 | 237.26 | C11H15O3N3 | O=C(NCCO)c1nccnc1OCC1CC1 |
|
AD34739 | 1.48 | 233.25 | C12H12ON3F | Cc1cc(C(N)=O)n(Cc2ccccc2F)n1 |
|
AD34740 | 0.01 | 236.68 | C8H9O3N2ClS | O=S(=O)(NCCO)c1cccc(Cl)n1 |