aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD34761 | 0.42 | 255.26 | C8H8ON6FS | COCNC(=S)Nc1nc(F)nc2c1N=C[N]2 |
|
AD34762 | 0.99 | 236.27 | C12H16O3N2 | NC(=O)c1cnccc1OCC1CCOCC1 |
|
AD34763 | -0.02 | 236.27 | C12H16O3N2 | O=C(NCCO)c1cccc(=O)n1CC1CC1 |
|
AD34764 | -0.02 | 236.27 | C12H16O3N2 | O=C(NCCO)c1ccc(=O)n(CC2CC2)c1 |
|
AD34765 | 0.38 | 237.26 | C11H15O3N3 | NC(=O)c1cnc(OCC2CCOCC2)nc1 |
|
AD34766 | -0.31 | 237.26 | C11H15O3N3 | O=C(NCCO)c1cnc(=O)n(C2CCC2)c1 |
|
AD34767 | -0.31 | 223.23 | C10H13O3N3 | NC(=O)c1cnc(=O)n(C2CCOCC2)c1 |
|
AD34768 | -0.78 | 240.26 | C11H16O4N2 | COCCn1cc(C(=O)NCCO)ccc1=O |
|
AD34769 | -0.17 | 240.26 | C11H16O4N2 | COCCOc1cncc(C(=O)NCCO)c1 |
|
AD34770 | -0.01 | 232.24 | C11H12O2N4 | O=C(NCCO)c1cn(-c2ccccn2)cn1 |