aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD15051 | 4.25 | 305.38 | C20H19O2N | Cc1cc(N)c(C(=O)CCc2ccc3ccccc3c2)c(O)c1 |
|
AD15052 | 1.51 | 239.26 | C13H11ON4 | CC1=N[N]c2c1ncn(-c1ccc(C)cc1)c2=O |
|
AD15053 | 3.71 | 280.62 | C11H11O4FPCl | COP1(=O)OCCC(c2ccc(Cl)c(F)c2)O1 |
|
AD15054 | 5.84 | 424.5 | C28H24O4 | O=C(O)Cc1cccc(-c2cc(CCc3cccc(-c4ccccc4O)c3)ccc2O)c1 |
|
AD15055 | 3.37 | 318.28 | C15H11N5F3 | FC(F)(F)c1cccc(C2CC2Nc2ncnc3c2N=C[N]3)c1 |
|
AD15056 | 1.31 | 452.54 | C24H36O8 | CC(C=CC1(O)C(C)(C)CCC(O)C1(C)O)=CC(=O)OC1CC(C)(O)C2C(O)OC=CC12 |
|
AD15057 | 2.77 | 164.25 | C11H16O | CC(C)(C)C(O)c1ccccc1 |
|
AD15058 | -0.43 | 694.63 | C23H44O14N4P2S | COC(=O)C(CCCCNC(=O)CSCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OC)NC(C)=O |
|
AD15059 | 2.55 | 268.35 | C14H12N4S | NC(=S)NNc1c2ccccc2nc2ccccc12 |
|
AD15060 | 2.66 | 410.22 | C17H16O6NBr | O=C(CBr)Nc1cc(CCC(=O)c2c(O)cc(O)cc2O)ccc1O |