aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD14901 | 2.88 | 273.31 | C16H16O2NF | CC(=O)NCCc1ccc(O)cc1-c1ccc(F)cc1 |
|
AD14902 | 3.76 | 323.31 | C17H16O2NF3 | CC(=O)NCCc1ccc(O)cc1-c1ccc(C(F)(F)F)cc1 |
|
AD14903 | 3.48 | 332.36 | C20H16O3N2 | CCCC(=O)c1ccc2c(c1)C(=C1C(=O)Nc3ccccc31)C(=O)N2 |
|
AD14904 | -4.11 | 718.71 | C29H46O15N6 | CC(=O)NC1C2OCC(O2)C(O)C1OC(C)C(=O)NC(C)C(=O)NC(CCC(=O)NC(CCCC(N)C(=O)O)C(=O)NC(C)C(=O)O)C(=O)O |
|
AD14905 | 0.02 | 154.17 | C7H10O2N2 | CCCc1c[nH]c(=O)[nH]c1=O |
|
AD14906 | 2.74 | 304.33 | C17H14ON5 | Nc1nc(OCCc2ccc3ccccc3c2)nc2c1N=C[N]2 |
|
AD14907 | 3.62 | 359.87 | C17H16N6ClS | Clc1nc2c(c(NN3CCCC(Sc4ccccc4)C3)n1)N=C[N]2 |
|
AD14908 | 0.89 | 270.19 | C10H7ON5F3 | NC(=O)C1=NC(Nc2ccc(C(F)(F)F)cc2)=N[N]1 |
|
AD14909 | 2.83 | 372.21 | C15H12ON6Br | Nc1nc(OCCc2c[nH]c3c(Br)cccc23)nc2c1N=C[N]2 |
|
AD14910 | 1.24 | 602.81 | C31H58O9N2 | CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)C(N(C)C)C(C)C(O)C12CO2 |