aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD18401 | -0.28 | 203.02 | C5H5ON3Br | NC(=O)C1=N[N]C(CBr)=C1 |
|
AD18402 | -0.42 | 271.26 | C11H11ON8 | CNC(=O)Cn1cc(-c2nc(N)c3c(n2)[N]C=N3)cn1 |
|
AD18403 | 1.71 | 135.21 | C9H13N | CNCc1ccccc1C |
|
AD18404 | 0.68 | 194.23 | C10H14O2N2 | CNc1c(NC2CCCC2)c(=O)c1=O |
|
AD18405 | 2.83 | 369.42 | C21H23O5N | CCC(C)C(N=C1c2c(O)cccc2Cc2cc(CO)cc(O)c21)C(=O)O |
|
AD18406 | -0.74 | 336.24 | C11H17O8N2P | COP(=O)(O)OCC1OC(n2cc(C)c(=O)[nH]c2=O)CC1O |
|
AD18407 | 1.79 | 160.18 | C9H8ON2 | On1cnc(-c2ccccc2)c1 |
|
AD18408 | 0.52 | 280.28 | C14H16O6 | C#CCOC(=O)CC1C(C(=O)OC)=COC(O)C1=CC |
|
AD18409 | 3.7 | 224.71 | C12H9OClS | Oc1ccc(Cc2ccsc2Cl)cc1 |
|
AD18410 | 4.76 | 446.58 | C26H38O6 | CC=CCC(C)=CC1OC(=O)CC(O)C=CCC(OC)C(C)=CC(C)CC2C=CC1OO2 |