aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD24001 | 0.5 | 274.28 | C13H14O3N4 | Cc1cc2c(cc1C)N(C)C1=NC(=O)NC(=O)C1(O)N2 |
|
AD24002 | 1.0 | 290.28 | C13H14O4N4 | Cc1cc2c(cc1C)N(C)C1=NC(=O)NC(=O)C1(OO)N2 |
|
AD24003 | 0.37 | 254.3 | C13H14N6 | NCc1ccc(C[n+]2cnc3c(c2N)N=C[N]3)cc1 |
|
AD24004 | 0.27 | 377.34 | C14H14O4N3F3S | OCC1OC(S)C(O)C(n2cc(-c3cc(F)c(F)c(F)c3)nn2)C1O |
|
AD24005 | 1.31 | 249.13 | C8H9O5NFP | COP(=O)(O)OC(=O)c1c(N)cccc1F |
|
AD24006 | 0.91 | 225.26 | C12H11N5 | Nc1c2c(nc[n+]1Cc1ccccc1)[N]C=N2 |
|
AD24007 | 2.68 | 452.49 | C23H20O6N2S | O=C1C=CC2=C(C1)Oc1cc(O)ccc1C2c1ccc(NC(=S)NCCO)cc1C(=O)O |
|
AD24008 | 0.37 | 136.15 | C7H8ON2 | NC(=O)c1cccc(N)c1 |
|
AD24009 | -0.12 | 197.13 | C5H12O5NP | COC(=O)C(C)NP(=O)(O)OC |
|
AD24010 | -2.59 | 177.2 | C7H15O4N | NC1CC(CO)C(O)C(O)C1O |