aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD36901 | 1.36 | 254.33 | C13H22O3N2 | CC(C)(C)OC(=O)N1CC2C(C1C(N)=O)C2(C)C |
|
AD36902 | -0.58 | 272.33 | C11H16O4N2S | CN(CC(=O)NCCO)S(=O)(=O)c1ccccc1 |
|
AD36903 | 0.69 | 252.01 | C5H5O2N2I | Cc1nc(I)oc1C(N)=O |
|
AD36904 | 0.09 | 275.37 | C12H21O4NS | O=C(NCCO)C1(CC2CC2)CCS(=O)(=O)CC1 |
|
AD36905 | 0.44 | 242.27 | C11H18O4N2 | CC(C)(C)OC(=O)N1CC(=O)CCC1C(N)=O |
|
AD36906 | 0.96 | 261.07 | C8H9O3N2Br | COc1nc(OC)c(C(N)=O)cc1Br |
|
AD36907 | -0.87 | 278.31 | C13H18O3N4 | O=C1CN(c2cccc(C(=O)NCCO)n2)CCCN1 |
|
AD36908 | 1.51 | 242.32 | C12H22O3N2 | CC1CCN(C(=O)OC(C)(C)C)C(C(N)=O)C1 |
|
AD36909 | -0.04 | 259.31 | C8H9O3N3S2 | O=S(=O)(NCCO)c1ccc2nsnc2c1 |
|
AD36910 | 0.81 | 269.67 | C10H10O2N6Cl | COCCNC(=O)Nc1nc(Cl)nc2c1N=C[N]2 |