aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD17661 | 2.67 | 239.34 | C12H17O2NS | CSCCCNC(=O)OCc1ccccc1 |
|
AD17662 | 3.72 | 303.36 | C17H21O4N | CCCCCCC(=O)Nc1cc2ccc(O)c(C)c2oc1=O |
|
AD17663 | 2.94 | 275.3 | C15H17O4N | CCCCC(=O)Nc1cc2ccc(O)c(C)c2oc1=O |
|
AD17664 | 3.33 | 301.34 | C17H19O4N | Cc1c(O)ccc2cc(NC(=O)C3CCCCC3)c(=O)oc12 |
|
AD17665 | 1.57 | 219.27 | C10H15N6 | CCCCCNc1nc(N)c2c(n1)[N]C=N2 |
|
AD17666 | 2.16 | 259.26 | C14H13O4N | Cc1c(O)ccc2cc(NC(=O)C3CC3)c(=O)oc12 |
|
AD17667 | 1.14 | 195.22 | C10H13O3N | CNCc1cc2c(cc1OC)OCO2 |
|
AD17668 | -0.19 | 164.12 | C6H4O2N4 | [N-]=[N+]=Nc1c[nH+]cc(C(=O)[O-])c1 |
|
AD17669 | 1.73 | 206.22 | C11H11ON2F | CN(C)c1cc2cc[nH]c(=O)c2cc1F |
|
AD17670 | 0.73 | 200.19 | C8H6N7 | c1ccc2c(c1)nnn2CC1=NN=N[N]1 |