aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD03731 | -2.63 | 159.12 | C6H7O5 | O=C([O-])C1=CC(O)C(O)CO1 |
|
AD03732 | 8.32 | 468.75 | C30H50ON3 | CC(C)CCCC(C)C1CCC2C3CCC4CC(OCC5=C[N]N=N5)CCC4(C)C3CCC12C |
|
AD03733 | 5.22 | 496.71 | C27H44O6S | CC(C)=CCCC(C)(O)C1CCC2C3CC(O)C4CC(OS(=O)(=O)O)CCC4(C)C3=CCC21C |
|
AD03734 | -0.03 | 229.22 | C10H9ON6 | CC(=O)NC1=NN(C)c2ncnc3c2C1=C[N]3 |
|
AD03735 | 7.13 | 720.01 | C43H65O6N3 | CCC1OC(=O)CC(O)C(C)C(O)C(CCN2CC(C)CC(C)C2)CC(C)C(=NOCCCCc2ccc3ncccc3c2)C=CC(C)=CC1CO |
|
AD03736 | 3.67 | 318.31 | C18H12O3N3 | O=c1cc(-c2ccccc2)c2ccc(OCC3=C[N]N=N3)cc2o1 |
|
AD03737 | 0.46 | 136.11 | C5H4ON4 | c1c[nH]c(-c2ncon2)n1 |
|
AD03738 | 2.28 | 186.21 | C11H10ON2 | CC(=O)c1ncc(-c2ccccc2)[nH]1 |
|
AD03739 | -1.49 | 425.53 | C20H35O5N5 | CCN(CC)CCN1CCN(CC(O)C2CC(O)C(n3ccc(=O)[nH]c3=O)O2)CC1 |
|
AD03740 | 2.95 | 350.42 | C21H22O3N2 | Cc1c(O)ccc2c(CN3CCNC(c4ccccc4)C3)cc(=O)oc12 |