aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD22801 | 3.25 | 219.29 | C16H13N | N#Cc1ccccc1Cc1ccc2c(c1)CC2 |
|
AD22802 | 1.09 | 192.15 | C8H6O3N3 | Oc1cc(C2=C[N]N=N2)cc(O)c1O |
|
AD22803 | 7.24 | 483.78 | C32H53O2N | CN(C)C(=O)C12CCC(C)(C)CC1C1=CCC3C4(C)CCC(O)C(C)(C)C4CCC3(C)C1(C)CC2 |
|
AD22804 | 2.27 | 176.2 | C8H4ON2S | N#Cc1coc(-c2cscn2)c1 |
|
AD22805 | 3.64 | 526.54 | C28H30O10 | CC(=O)OCC1OC(OCCCCCOc2cc(O)c3c(=O)c(-c4ccc(O)cc4)coc3c2)C=CC1O |
|
AD22806 | 4.74 | 284.79 | C19H17OCl | Clc1c(Cc2ccc(C3CC3)cc2)ccc2c1OCC2 |
|
AD22807 | 1.1 | 245.23 | C13H11O4N | CC(=O)NC1=CC(=O)c2cc(O)c(C)cc2C1=O |
|
AD22808 | 7.15 | 454.7 | C30H46O3 | CC1(C(=O)O)CCC2(C)CCC3(C)C(=C2C1)C=CC1C2(C)CCC(O)C(C)(C)C2CCC13C |
|
AD22809 | -0.99 | 138.19 | C3H10O2N2S | CNS(=O)(=O)N(C)C |
|
AD22810 | 5.92 | 594.83 | C37H54O6 | CC1(C)CC(OC(=O)c2ccccc2)C2(CO)C(O)CC3(C)C(=CCC4C5(C)CCC(O)C(C)(CO)C5CCC43C)C2C1 |