aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD00221 | 3.79 | 272.43 | C16H32O3 | COC(=O)CC(C)CCCC(CO)CCCC(C)C |
|
AD00222 | 3.12 | 300.31 | C17H16O5 | COc1ccc(C2CC(=O)c3ccc(O)cc3O2)cc1OC |
|
AD00223 | 6.03 | 488.62 | C30H30N7 | C1=Nc2c(nc(NCCC3CNc4ccccc43)nc2NCCC(c2ccccc2)c2ccccc2)[N]1 |
|
AD00224 | 3.75 | 362.46 | C20H24N7 | C1=Nc2c(nc(NCCC3CNc4ccccc43)nc2NC2CCCC2)[N]1 |
|
AD00225 | 4.17 | 296.4 | C17H16ON2S | COc1ccc(-c2c3c([nH]c(=S)c2C#N)CCCC3)cc1 |
|
AD00226 | 3.63 | 293.41 | C16H27O2N3 | CCCCCCCCCCCC(=O)Nc1cc[nH]c(=O)n1 |
|
AD00227 | 4.32 | 415.83 | C22H18O6NCl | CC(C)=CCc1cc(C(=O)Nc2c(O)c3ccc(O)c(Cl)c3oc2=O)ccc1O |
|
AD00228 | 5.21 | 381.5 | C22H29O2N4 | CCCC1C2CCc3cc(OCC4=C[N]N=N4)ccc3C2CCC1(C)C=NO |
|
AD00229 | 1.9 | 404.5 | C23H32O6 | CC12CCC3C(CCC4(O)CC(O)CCC34C=O)C1(O)CCC2C1=CC(=O)OC1 |
|
AD00230 | -0.33 | 245.33 | C8H11O2N3S2 | NC(=S)NCc1ccc(S(N)(=O)=O)cc1 |