aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD32331 | 0.18 | 216.26 | C8H12O3N2S | COc1nc(C)c(C(=O)NCCO)s1 |
|
AD32332 | 1.48 | 226.21 | C9H10N5F2 | CCN(CC(F)F)c1ncnc2c1N=C[N]2 |
|
AD32333 | 0.99 | 214.29 | C9H14O2N2S | CC(C)c1csc(C(=O)NCCO)n1 |
|
AD32334 | 1.7 | 239.26 | C12H11N6 | Cc1cncc(CNc2ncnc3c2N=C[N]3)c1 |
|
AD32335 | 1.93 | 228.26 | C10H6N5S | C1=Nc2c(ncnc2Sc2ccncc2)[N]1 |
|
AD32336 | 1.25 | 234.28 | C11H16ON5 | COC(C)(C)CN(C)c1ncnc2c1N=C[N]2 |
|
AD32337 | 1.83 | 232.25 | C9H6ON5S | Cc1coc(Sc2ncnc3c2N=C[N]3)n1 |
|
AD32338 | 1.06 | 234.28 | C11H16ON5 | CC(C)C(CO)CNc1ncnc2c1N=C[N]2 |
|
AD32339 | 0.74 | 216.19 | C9H10O2N2F2 | O=C(NCCO)c1ccnc(C(F)F)c1 |
|
AD32340 | 1.6 | 224.19 | C9H8N5F2 | FC1(F)CC(Nc2ncnc3c2N=C[N]3)C1 |