aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD44331 | 2.2 | 383.47 | C22H27O4N2 | C=CC1C(OC)OC=C(C(=O)OC)C1CC1[NH2+]CCc2c1[nH]c1ccccc21 |
|
AD44332 | 2.05 | 374.16 | C10H7O3N2F9 | O=c1[nH]cc(COCC(F)(F)C(F)(F)C(F)(F)C(F)(F)F)c(=O)[nH]1 |
|
AD44333 | 3.87 | 185.35 | C12H27N | CCCCCCCCCCCCN |
|
AD44334 | 2.88 | 430.38 | C18H14O4N2F4S | CC(O)(CS(=O)(=O)c1ccc(F)cc1)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 |
|
AD44335 | 2.68 | 410.42 | C23H22O7 | C=C(CO)C1Cc2c(ccc3c2OC2COc4cc(OC)c(OC)cc4C2C3=O)O1 |
|
AD44336 | 2.81 | 376.49 | C22H32O5 | CC(=O)OC12CC(C)C(O)C1C=C(CO)CCC1C(C=C(C)C2=O)C1(C)C |
|
AD44337 | 3.0 | 381.43 | C22H23O5N | C=CCOC(=O)C(NC(=O)OCC1c2ccccc2-c2ccccc21)C(C)O |
|
AD44338 | -0.05 | 162.13 | C6H4ON5 | O=CNc1ncnc2c1N=C[N]2 |
|
AD44339 | 0.82 | 406.39 | C20H22O9 | CC(=O)OCC12OC1C(OC(=O)c1ccc(OC(C)=O)cc1)C1CCOC(O)C12 |
|
AD44340 | 0.1 | 431.83 | C2H11O9P3Br2 | CO[PH](O)(O)O[PH](O)(O)C(Br)(Br)P(=O)(O)O |