aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD42061 | -0.58 | 120.18 | C3H8ON2S | COCNC(N)=S |
|
AD42062 | 2.51 | 293.34 | C14H15O4NS | COc1ccc(S(=O)(=O)Nc2ccc(O)cc2)c(C)c1 |
|
AD42063 | 1.1 | 307.35 | C15H21O4N3 | CC(C)(C)OC(=O)N1CCc2cc(C(=O)NCCO)cnc21 |
|
AD42064 | -1.11 | 227.22 | C9H13O4N3 | O=c1[nH]cc(NCC2COCCO2)c(=O)[nH]1 |
|
AD42065 | 2.04 | 305.36 | C14H15O3N3S | COCCOc1cnc(C(=O)Nc2ccc(S)cc2)cn1 |
|
AD42066 | 0.84 | 348.39 | C12H10O2N7S2 | NS(=O)(=O)c1ccc(NC(=S)Nc2ncnc3c2N=C[N]3)cc1 |
|
AD42067 | 2.04 | 305.36 | C14H15O3N3S | COCCOc1ccnc(C(=O)Nc2ccc(S)cc2)n1 |
|
AD42068 | 2.37 | 289.36 | C14H15O2N3S | CC(C)n1cc(C(=O)Nc2ccc(S)cc2)cnc1=O |
|
AD42069 | 2.04 | 305.36 | C14H15O3N3S | COCCOc1ncc(C(=O)Nc2ccc(S)cc2)cn1 |
|
AD42070 | 2.2 | 297.34 | C14H11ON5S | O=C(Nc1ccc(S)cc1)c1cn(-c2ncccn2)cn1 |