aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD43991 | 2.82 | 285.44 | C17H21N2S | CC(CN1c2ccccc2Sc2ccccc21)[NH+](C)C |
|
AD43992 | 2.5 | 358.38 | C19H16ON7 | Nc1ncnc2c1N=C(NN=Cc1ccc(OCc3ccccc3)cc1)[N]2 |
|
AD43993 | 2.5 | 358.39 | C19H16ON7 | Nc1ncnc2c1N=C(NN=Cc1ccccc1OCc1ccccc1)[N]2 |
|
AD43994 | 3.7 | 330.47 | C21H30O3 | CC12CCC(=O)C=C1CCC1C2CCC2(C)C(C(=O)CO)CCC12 |
|
AD43995 | 1.84 | 141.21 | C8H15ON | COC1CCC(C=N)CC1 |
|
AD43996 | 3.52 | 365.2 | C16H12ON7Cl2 | CC(COc1ccc(Cl)cc1Cl)N=NC1=Nc2c(N)ncnc2[N]1 |
|
AD43997 | 4.0 | 294.35 | C19H18O3 | COc1cc(C=C2CCCc3ccccc3C2=O)ccc1O |
|
AD43998 | 3.21 | 300.51 | C18H38O2N | CCCCCCCCCCCCCC=CC(O)C([NH3+])CO |
|
AD43999 | 2.94 | 353.37 | C20H13ON6 | O=c1[nH]cnc2c1N=C(NN=Cc1c3ccccc3cc3ccccc13)[N]2 |
|
AD44000 | 3.72 | 316.38 | C16H16O3N2S | Cc1nc(-c2ccc(OCC(C)C)c(C#N)c2)sc1C(=O)O |