aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD23111 | 1.25 | 156.23 | C8H16ON2 | CNC(=O)NC1CCCCC1 |
|
AD23112 | 2.68 | 279.34 | C17H17ON3 | OCc1cn(CCc2ccc(-c3ccccc3)cc2)nn1 |
|
AD23113 | 6.45 | 473.78 | C22H14O2N2ClSBr | O=CNc1ncc(C(Oc2ccc3cc(Br)ccc3c2)c2ccc(Cl)cc2)s1 |
|
AD23114 | 6.15 | 1390.18 | C69H61O16N10F3Cl2 | CNC(CC(C)C)C(=O)NC1C(=O)NC(CC(N)=O)C(=O)NC2C(=O)NC3C(=O)NC(C(=O)NC(C(=O)NN=Cc4ccc(-c5ccc(C(F)(F)F)cc5)cc4)c4cc(O)cc(O)c4-c4cc3ccc4O)C(O)c3ccc(c(Cl)c3)Oc3cc2cc(c3O)Oc2ccc(cc2Cl)C1O |
|
AD23115 | 2.81 | 260.34 | C15H20O2N2 | Cc1nn(C)c(O)c1Cc1ccc(OC(C)C)cc1 |
|
AD23116 | 8.51 | 559.88 | C38H57O2N | CC1(C)CCC2(C(=O)NCCc3ccccc3)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1 |
|
AD23117 | 5.02 | 316.4 | C22H20O2 | Cc1c(Cc2ccc3c(c2)OCCO3)cccc1-c1ccccc1 |
|
AD23118 | 4.07 | 286.76 | C18H15O2Cl | CC(=O)c1ccc(Cc2ccc3c(c2Cl)OCC3)cc1 |
|
AD23119 | 4.49 | 294.39 | C20H22O2 | CCOc1ccc(Cc2ccc3c(c2C2CC2)OCC3)cc1 |
|
AD23120 | 9.8 | 626.88 | C38H58O7 | CCCCC1CCCCC(C)C(O)c2cc(O)c(c(O)c2)C(CCCC)CCCCC(C)C(OC(C)=O)c2cc(O)c1c(O)c2 |