aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD10601 | 1.93 | 246.29 | C12H16ON5 | Nc1nc(OCCC2CCCC2)nc2c1N=C[N]2 |
|
AD10602 | 3.54 | 500.63 | C29H40O7 | Cc1c(O)c(O)cc2c1C=CC1C2(C)C(=O)CC2(C)C(C(C)(O)C(=O)CCC(C)(C)O)C(O)CC12C |
|
AD10603 | 10.4 | 680.11 | C42H81O5N | CCCCCCCCC=CCCCCCCCCCCCCC(O)C(=O)NC(CO)C(O)C(O)CCCC=CCCCCCCCCC |
|
AD10604 | 0.21 | 363.01 | C3H11O12P4 | COP(=O)(O)CP(=O)(O)OP(=O)([O-])OP(=O)(O)OC |
|
AD10605 | 4.41 | 439.55 | C25H27N8 | C1=Nc2c(nc(NCCC3CNc4ccccc43)nc2NCCC2CNc3ccccc32)[N]1 |
|
AD10606 | 5.84 | 544.77 | C33H52O6 | COC(=O)C1(C)CCC2(C)CCC3(C)C(=CCC4C5(C)C(O)CC(O)C(C)(COC(C)=O)C5CCC43C)C2C1 |
|
AD10607 | 6.11 | 1171.47 | C64H98O19 | COC1CC(COCC2C(C)OC(COCC3C(C)OC(COCC4C(C)OC(OC5CCC6(C)C(=CCC7(O)C6CC(OC(=O)C=Cc6ccccc6)C6(C)C(O)(C(C)=O)CCC76O)C5)CC4OC)CC3OC)CC2OC)OC(C)C1O |
|
AD10608 | 1.98 | 140.21 | C7H8OS | COc1ccc(S)cc1 |
|
AD10609 | 4.88 | 753.37 | C40H61O10N2Cl | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(OC)CC(C)C(=O)C(C)C2N(CCc3ccc(Cl)cc3)C(=O)OC12C |
|
AD10610 | 2.04 | 187.23 | C10H11N4 | C1=Nc2c(ncnc2C2CCCC2)[N]1 |