aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD09791 | 0.95 | 348.36 | C19H16O3N4 | N#Cc1ccc(C(=O)NCC(O)CNC(=O)c2ccc(C#N)cc2)cc1 |
|
AD09792 | 0.12 | 270.24 | C10H14O5N4 | CNc1nc(O)nc(O)c1NC(=O)CCCC(=O)O |
|
AD09793 | 1.21 | 313.83 | C16H24O2N3Cl | CN(CCNCCc1ccc(Cl)cc1)CCC(N)C(=O)O |
|
AD09794 | -3.16 | 389.45 | C16H31O6N5 | CC(=O)NC(C(=O)NC(CCCCN)C(=O)NC(C(N)=O)C(C)O)C(C)O |
|
AD09795 | 1.95 | 254.29 | C15H14O2N2 | Cc1cc2cc3c(=O)[nH]c(=O)cc-3n(C)c2cc1C |
|
AD09796 | -5.66 | 1665.02 | C78H129O19N21 | CC(C)CC(NC(=O)C(CO)NC(=O)C(CCCCN)NC(=O)C(CC(C)C)NC(=O)C(C)NC(=O)C(CCCCN)NC(=O)C(CCCCN)NC(=O)C(C)(C)NC(=O)C(CC(C)C)NC(=O)C(CC(N)=O)NC(=O)CNC(=O)CNC(=O)C(Cc1ccccc1)N(C)C(=O)CNC(=O)C(C)NC(=O)C(N)Cc1ccc(O)cc1)C(N)=O |
|
AD09797 | 3.36 | 338.36 | C20H18O5 | O=C(O)c1ccc(OCC(O)COc2cccc3ccccc23)cc1 |
|
AD09798 | 6.36 | 670.93 | C40H62O8 | CC(=CCO)CCC=C(CO)C(=O)OC1CC2(C(=O)O)C(O)CC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2CC1(C)C |
|
AD09799 | 6.45 | 486.74 | C31H50O4 | CC1CC2(C)C(=CCC3C4(C)CCC(O)C(C)(C)C4CCC32C)C2CC(C)(C)C(O)CC12C(=O)O |
|
AD09800 | 0.75 | 151.16 | C8H9O2N | CNC(=O)c1ccc(O)cc1 |