aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD05011 | 2.8 | 323.27 | C16H12O3NF3 | NCC(=O)Oc1ccc(C(=O)c2ccc(C(F)(F)F)cc2)cc1 |
|
AD05012 | 0.61 | 717.89 | C35H51O9N5S | CC12C(O)CC3C(CCC4(O)CC(O)CCC34C=NNC(=O)CNC(=O)CCCCC3SCC4NC(=O)NC43)C1(O)CCC2C1=CC(=O)OC1 |
|
AD05013 | 0.4 | 621.81 | C31H59O11N | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)CCCO)C2O)C(C)(O)CC(C)C(O)C(C)C(O)C1(C)O |
|
AD05014 | 1.71 | 357.45 | C21H27O4N | Oc1ccc2c3c1OC1C(O)CCC4(O)C(C2)N(CC2CCC2)CCC314 |
|
AD05015 | 0.91 | 194.19 | C9H10O3N2 | Cc1ccc(C(=O)NNC(=O)O)cc1 |
|
AD05016 | 1.91 | 249.05 | C10H6O3N2Cl2 | O=C(O)NNC(=O)c1ccc(Cl)cc1Cl |
|
AD05017 | 4.29 | 296.2 | C17H15ONCl2 | CNCc1ccccc1OCc1ccc(Cl)cc1Cl |
|
AD05018 | 2.41 | 395.39 | C16H14ON6F3S | Nc1ncnc2c1N=C(SCC(=O)NCCc1cccc(C(F)(F)F)c1)[N]2 |
|
AD05019 | 4.26 | 388.55 | C24H36O4 | COC1CCC2(C)C(CCC3C2CCC2(C)C(C4=CC(=O)OC4)CCC32O)C1 |
|
AD05020 | 1.01 | 168.15 | C8H8O4 | CC(=O)c1c(O)cc(O)cc1O |