aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD21681 | 2.69 | 274.3 | C14H16O3N3 | CCOC(=O)CCCOc1ccc(C2=C[N]N=N2)cc1 |
|
AD21682 | 3.47 | 316.44 | C20H28O3 | CC1=CC2=C(C(=O)C(C)C2)C(=O)C(C)CC2C(CC1)C2(C)CO |
|
AD21683 | 3.42 | 1028.74 | C54H87O13N3FCl | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(CCCNC(=O)C2(O)C(C)CC3C4CC(F)C5=CC(=O)C=CC5(C)C4(Cl)C(O)CC32C)C(C)C(O)C1(C)O |
|
AD21684 | 2.79 | 273.34 | C15H19O2N3 | CC(=O)Nc1ccc(Cc2c(O)n[nH]c2C(C)C)cc1 |
|
AD21685 | -0.29 | 163.14 | C6H5ON5 | Nc1ncnc2c(O)ncnc12 |
|
AD21686 | 4.07 | 248.37 | C16H24O2 | COC(=O)c1cc(C(C)(C)C)cc(C(C)(C)C)c1 |
|
AD21687 | 1.39 | 733.03 | C36H68O9N4S | C=CCNC(=S)NCCCN1CC(C)CC(C)(O)C(OC2OC(C)CC(N(C)C)C2O)C(C)C(O)C(C)C(=O)OC(CC)C(C)(O)C(O)C1C |
|
AD21688 | 0.46 | 219.2 | C10H9O3N3 | O=C(O)c1ccccc1-n1cc(CO)nn1 |
|
AD21689 | 0.19 | 152.15 | C7H8O2N2 | COc1cnccc1C(N)=O |
|
AD21690 | 0.16 | 146.15 | C8H6ON2 | C#Cc1cccnc1C(N)=O |