aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD36041 | 1.35 | 237.27 | C13H16O2NF | O=C(CC1CCc2ccc(F)cc21)NCCO |
|
AD36042 | 1.22 | 243.69 | C12H14O3NCl | O=C(CCOc1ccccc1Cl)NCCO |
|
AD36043 | 2.57 | 217.24 | C9H9ONF2S | O=C(CC(F)F)Nc1ccc(S)cc1 |
|
AD36044 | 1.54 | 251.33 | C14H21O3N | COc1ccc(C(C(=O)NCCO)C(C)C)cc1 |
|
AD36045 | 2.16 | 242.24 | C12H9N5F | Nc1ccc(F)c(Nc2ncnc3c2C=C[N]3)c1 |
|
AD36046 | 2.23 | 242.31 | C13H16N5 | C1=Nc2c(ncnc2NCC2CC2C2CCC2)[N]1 |
|
AD36047 | 1.86 | 249.34 | C13H15O2NS | Cc1c(CC(=O)NCCO)sc2ccccc12 |
|
AD36048 | 1.18 | 241.24 | C12H13O2NF2 | O=C(NCCO)C1CC1c1ccc(F)c(F)c1 |
|
AD36049 | 2.4 | 244.32 | C13H18N5 | CCC1CCC(C)N(c2ncnc3c2N=C[N]3)C1 |
|
AD36050 | 1.64 | 235.33 | C14H21O2N | CCc1ccc(C(C)(C)C(=O)NCCO)cc1 |