aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD21811 | -0.11 | 165.15 | C7H7O2N3 | NC(=O)NC(=O)c1ccccn1 |
|
AD21812 | -1.09 | 314.33 | C15H22O7 | CC1CCC23OC4(O)CC12C(O)C(=O)OCC3(CO)C4(C)O |
|
AD21813 | 0.25 | 233.23 | C10H11O2N5 | NC(=O)Nc1cccc(-n2cc(CO)nn2)c1 |
|
AD21814 | 0.31 | 255.24 | C12H9O2N5 | O=c1[nH]cc(-n2cc(-c3ccccc3)nn2)c(=O)[nH]1 |
|
AD21815 | 3.07 | 360.14 | C13H7N5I | N#Cc1ccc(Nc2ncnc3c2C(I)=C[N]3)cc1 |
|
AD21816 | -2.74 | 318.37 | C13H26O5N4 | CONCC1=CCC(N)C(OC2C(N)CC(N)C(O)C2O)O1 |
|
AD21817 | 2.33 | 576.61 | C29H32O7N6 | COc1cc(C=CC(=O)C=Cc2ccc(OCc3cn(CCO)nn3)c(OC)c2)ccc1OCc1cn(CCO)nn1 |
|
AD21818 | 2.07 | 229.29 | C11H9N4S | Cc1nc(N)c2c(n1)[N]C=C2c1ccsc1 |
|
AD21819 | 3.56 | 365.61 | C17H35O3NS2 | CCCCCCCCSSCCNC1(C)CC(O)OC(C)C1O |
|
AD21820 | 0.76 | 307.39 | C16H25O3N3 | Cc1ccc(CCCN(C)CCC(N)C(=O)O)cc1C(N)=O |