aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD08611 | 5.82 | 536.77 | C32H53O5F | CC(=O)OC1CCC2(C)C(CC(O)C3(C)C2CCC24CC23CCC4C(C)CC(O)C(O)C(C)(C)F)C1(C)C |
|
AD08612 | 2.55 | 449.6 | C21H27O4N3S2 | CNC(=S)NCCN(C(C(=O)O)C(C)C)S(=O)(=O)c1ccc(-c2ccccc2)cc1 |
|
AD08613 | 1.45 | 257.25 | C13H11O3N3 | Cc1c(O)ccc2c(Cn3cncn3)cc(=O)oc12 |
|
AD08614 | 0.2 | 139.16 | C6H9ON3 | CCNc1ncc[nH]c1=O |
|
AD08615 | 5.06 | 954.03 | C52H59O16N | COC(=O)CCC(=O)OC1C(OC(C)=O)C2=C(C)C(OC(=O)C(O)C(NC(=O)c3ccccc3)c3ccccc3)CC(O)(C(OC(=O)c3ccccc3)C3C1(C)CCC1OCC13OC(C)=O)C2(C)C |
|
AD08616 | 3.53 | 504.71 | C30H48O6 | CC1CC(C(O)C(C)(C)O)OC2(O)C1C1(C)CCC34CC35CCC(O)C(C)(C)C5CC=C4C1(C)C2O |
|
AD08617 | 3.67 | 280.35 | C16H12ON2S | N#CC1=C(S)NC(c2ccccc2)=CC1c1ccco1 |
|
AD08618 | 5.54 | 302.83 | C18H15OClS | CCOc1ccc(Cc2ccc3sccc3c2Cl)cc1 |
|
AD08619 | 4.99 | 286.8 | C19H19OCl | CCc1ccc(Cc2ccc3c(c2Cl)OCC3C)cc1 |
|
AD08620 | 1.45 | 321.38 | C16H23O4N3 | CC(C)C=CC(=O)Nc1ccn(C2CCC(O)C(C)O2)c(=O)n1 |