aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD17411 | 2.56 | 303.69 | C13H8O2N6Cl | O=[N+]([O-])c1ccc(CNc2ncnc3c2N=C[N]3)c(Cl)c1 |
|
AD17412 | 3.21 | 787.44 | C40H67O10N4Cl | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(CCCNC(=O)Nc2ccc(Cl)cc2)C(C)C(O)C1(C)O |
|
AD17413 | 3.17 | 781.05 | C41H72O10N4 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(CCCNC(=O)Nc2ccc(C)cc2C)C(C)C(O)C1(C)O |
|
AD17414 | 2.71 | 286.28 | C16H14O5 | COc1cc(O)c(C(=O)C=Cc2ccc(O)cc2)c(O)c1 |
|
AD17415 | 2.67 | 239.26 | C13H11ON4 | CC(=O)c1cn(CC2=C[N]N=N2)c2ccccc12 |
|
AD17416 | 3.76 | 328.36 | C19H14ON5 | O=C(C=Cc1cn(CC2=C[N]N=N2)c2ccccc12)c1cccnc1 |
|
AD17417 | -4.25 | 496.57 | C22H36O7N6 | Cc1ccccc1C(=O)NCC(=O)NC1C(CN)OC(OC2C(N)CC(N)C(O)C2O)C(N)C1O |
|
AD17418 | 1.32 | 165.17 | C9H8ONF | NC(=O)C=Cc1cccc(F)c1 |
|
AD17419 | 2.82 | 259.29 | C12H8N4FS | Fc1ccc(CSc2ncnc3c2N=C[N]3)cc1 |
|
AD17420 | 1.12 | 167.21 | C9H13O2N | CNCc1ccc(O)c(OC)c1 |