aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD20011 | 5.15 | 528.73 | C32H48O6 | CC(=O)OC(C)(C)C1OC23OC1CC(C)C2C1(C)CCC24CC25CCC(O)C(C)(C)C5CC=C4C1(C)C3O |
|
AD20012 | 3.03 | 502.65 | C29H42O7 | Cc1c(O)c(O)cc2c1CCC1C2(C)C(=O)CC2(C)C(C(C)(O)C(O)C=CC(C)(C)O)C(O)CC12C |
|
AD20013 | 3.69 | 200.32 | C12H24O2 | CCCCCCCCCCC(=O)OC |
|
AD20014 | 3.69 | 526.81 | C28H58O3N6 | CCCCCCCCCCCCCCCCC(=O)NCCCNC(CO)C(=O)NCCCCNC(=N)N |
|
AD20015 | 1.51 | 204.28 | C3H9O2PS3 | COP(O)(=S)SCCS |
|
AD20016 | 1.25 | 295.3 | C15H12N6F | Nc1nc(C#CNCCc2ccc(F)cc2)nc2c1N=C[N]2 |
|
AD20017 | 0.79 | 407.53 | C18H33O7NS | COC(=O)CCCCCCCCOC1OC(CO)C(S)C(O)C1NC(C)=O |
|
AD20018 | 2.29 | 435.57 | C20H25O4N3S2 | CC(C)C(C(=O)O)N(CCNC(N)=S)S(=O)(=O)c1ccc(-c2ccccc2)cc1 |
|
AD20019 | 3.23 | 329.44 | C20H27O3N | CC(C)C1=CC2CC3(C#N)C4CCC(C)C4CC2(CO)C13C(=O)O |
|
AD20020 | 2.26 | 345.44 | C19H27O3N3 | CC(C)c1[nH]nc(O)c1Cc1ccc(CCCC(=O)NCCO)cc1 |