aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD10081 | 1.32 | 165.17 | C9H8ONF | NC(=O)C=Cc1ccc(F)cc1 |
|
AD10082 | -1.57 | 239.25 | C10H15O3N4 | NC(CCCCNc1cc[nH]c(=O)n1)C(=O)[O-] |
|
AD10083 | 3.4 | 344.26 | C10H8N5F6S | FC(F)(F)CCSc1nc2c(c(NCC(F)(F)F)n1)N=C[N]2 |
|
AD10084 | 1.84 | 386.42 | C16H16O3N7S | C=CCN(C)S(=O)(=O)c1ccc(NC(=O)Nc2ncnc3c2N=C[N]3)cc1 |
|
AD10085 | 0.69 | 441.48 | C21H31O9N | Cc1cc(COC(=O)NC2(C)CC(O)OC(C)C2O)cc(C)c1OC(=O)COCCO |
|
AD10086 | 2.72 | 277.23 | C13H8N4F3 | Nc1ncnc2c1C(c1ccc(C(F)(F)F)cc1)=C[N]2 |
|
AD10087 | 4.31 | 347.45 | C18H11N4S2 | Nc1ncnc2c1C(c1cccc3c1Sc1ccccc1S3)=C[N]2 |
|
AD10088 | 1.59 | 384.4 | C16H14O3N7S | O=C(Nc1ccc(S(=O)(=O)N2CC=CC2)cc1)Nc1ncnc2c1N=C[N]2 |
|
AD10089 | 4.26 | 320.34 | C20H16O4 | O=C(O)C(Oc1cccc(-c2ccccc2O)c1)c1ccccc1 |
|
AD10090 | 9.15 | 569.96 | C35H71O4N | CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)NC(CO)C(O)C(O)CCCCC |