aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD42231 | -0.35 | 142.22 | C8H16ON | C=CCC1[NH2+]CCCC1O |
|
AD42232 | -0.03 | 143.21 | C7H15ON2 | C[N+](C)(C)CC(O)CC#N |
|
AD42233 | 2.37 | 216.28 | C13H16ON2 | CC(C)(CCC#N)c1ccc(C(N)=O)cc1 |
|
AD42234 | 2.1 | 233.03 | C10H3ON2FCl2 | N#Cc1c(Cl)c(F)cc(C(N)=O)c1Cl |
|
AD42235 | 2.2 | 292.29 | C13H9O3N2FS | N#Cc1ccc(F)c(S(=O)(=O)Nc2ccc(O)cc2)c1 |
|
AD42236 | 1.92 | 212.21 | C12H8O2N2 | N#Cc1ccc(-c2ccc(C(N)=O)o2)cc1 |
|
AD42237 | 1.3 | 343.11 | C9H8ON6I | C=CCNC(=O)Nc1nc(I)nc2c1N=C[N]2 |
|
AD42238 | 1.77 | 342.12 | C10H9ON5I | C=CCNC(=O)Nc1ncnc2c1C(I)=C[N]2 |
|
AD42239 | -0.98 | 197.19 | C8H11O3N3 | C=CC(CO)Nc1c[nH]c(=O)[nH]c1=O |
|
AD42240 | -0.41 | 239.23 | C10H13O4N3 | C=CCC(Nc1c[nH]c(=O)[nH]c1=O)C(=O)OC |