aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD31121 | -0.13 | 209.25 | C10H15O2N3 | CN(C)c1cncc(C(=O)NCCO)c1 |
|
AD31122 | 1.23 | 224.22 | C7H6O2N5S | COC(=O)Nc1[nH]c(=S)nc2c1N=C[N]2 |
|
AD31123 | 1.25 | 195.27 | C10H17ON3 | Cc1nn(CC(C)C)c(C)c1C(N)=O |
|
AD31124 | 0.37 | 188.19 | C9H8ON4 | NC(=O)c1cccc(-n2cncn2)c1 |
|
AD31125 | -0.46 | 216.26 | C8H12O3N2S | Nc1ccccc1S(=O)(=O)NCCO |
|
AD31126 | -0.89 | 211.22 | C9H13O3N3 | Cc1nc(C(=O)NCCO)c(=O)[nH]c1C |
|
AD31127 | 0.71 | 197.16 | C9H8O3NF | COC(=O)c1cc(F)cc(C(N)=O)c1 |
|
AD31128 | -0.42 | 200.22 | C7H8O3N2S | CS(=O)(=O)c1cncc(C(N)=O)c1 |
|
AD31129 | -1.08 | 213.19 | C8H11O4N3 | COC(=O)c1cc(C(=O)NCCO)[nH]n1 |
|
AD31130 | 0.94 | 199.18 | C9H10O3NF | COc1cc(C(N)=O)cc(OC)c1F |