aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD01811 | 1.1 | 131.24 | C6H13NS | CSC1CCNCC1 |
|
AD01812 | 1.04 | 124.14 | C7H8O2 | C=CC1CC=CC(=O)O1 |
|
AD01813 | 0.06 | 236.98 | C3H2ON4I | NC(=O)C1=C(I)[N]N=N1 |
|
AD01814 | -0.29 | 336.34 | C16H20O6N2 | Cc1ccc(NC(=O)C2=CC(O)C(O)C(OCC(N)=O)O2)c(C)c1 |
|
AD01815 | 5.24 | 536.79 | C32H56O6 | CC(=O)OC1C(O)CC2(C)C(CCC3(C)C2C(O)CC2C(C(C)(O)CCCC(C)(C)O)CCC23C)C1(C)C |
|
AD01816 | 2.24 | 346.38 | C19H22O6 | COc1cc(C2Oc3c(O)cc(CCCO)cc3C2CO)ccc1O |
|
AD01817 | 0.52 | 732.98 | C35H64O10N4S | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(NCCNCCNCc3nccs3)C2O)C(C)(O)CC(C)C(O)C(C)C(O)C1(C)O |
|
AD01818 | 0.96 | 174.19 | C8H8N5 | C1=Nc2c(ncnc2NC2CC2)[N]1 |
|
AD01819 | 3.98 | 270.72 | C16H11ON2Cl | Clc1ccccc1Cc1cnc(-c2ccoc2)nc1 |
|
AD01820 | 7.06 | 536.78 | C30H48O6S | CC1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(OS(=O)(=O)O)C(C)(C)C5CCC43C)C2C1 |