aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD12701 | 1.55 | 406.52 | C23H34O6 | CC12CCC(O)CC1CCC1C2CC(O)C2(C)C(C3=CC(=O)OC3)C(O)CC12O |
|
AD12702 | 3.47 | 253.3 | C16H15O2N | COc1ccc(Cc2c[nH]c3cccc(O)c23)cc1 |
|
AD12703 | 0.82 | 284.29 | C12H12O6S | CSC(=O)OCC1=CC2OC(=O)C3=COC(O)C1C32 |
|
AD12704 | 1.62 | 312.31 | C14H14O2N7 | O=C(O)c1cnn(-c2nc3c(c(NC4CCCC4)n2)N=C[N]3)c1 |
|
AD12705 | 4.62 | 414.54 | C22H38O7 | CCCCCCCCCCCCCCCC(=O)OCC(O)C1OC(=O)C(O)=C1O |
|
AD12706 | 5.24 | 240.43 | C16H32O | CCCCCCCCC=CCCCCCCO |
|
AD12707 | 3.78 | 294.17 | C15H11N4Cl2 | CC(C)NC1=Nc2nc3cc(Cl)c(Cl)cc3cc2[N]1 |
|
AD12708 | 1.65 | 346.29 | C17H14O8 | O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(OCCO)cc(O)c12 |
|
AD12709 | -1.67 | 602.52 | C20H40O11N6P2 | COP(=O)(O)OC1C(COP(=O)(O)O)OC(n2ccc(=O)[nH]c2=O)C1NCCCNCCCCNCCCN |
|
AD12710 | -2.44 | 508.51 | C19H37O8N6P | NCCCNCCCCNCCCNC1C(O)C(COP(=O)(O)O)OC1n1ccc(=O)[nH]c1=O |