aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD40081 | 0.86 | 298.13 | C8H9O3NFSBr | O=S(=O)(NCCO)c1ccc(Br)c(F)c1 |
|
AD40082 | 1.12 | 283.27 | C10H12O3NF3S | O=S(=O)(Cc1ccc(C(F)(F)F)cc1)NCCO |
|
AD40083 | 1.03 | 294.17 | C9H12O3NSBr | Cc1cc(S(=O)(=O)NCCO)ccc1Br |
|
AD40084 | 0.46 | 299.76 | C9H10O5NClS2 | COC(=O)c1sc(Cl)cc1S(=O)(=O)NCCO |
|
AD40085 | 1.42 | 295.33 | C15H15ON6 | Oc1ccccc1N1CCN(c2ncnc3c2N=C[N]3)CC1 |
|
AD40086 | 1.81 | 296.31 | C15H14O2N5 | C1=Nc2c(ncnc2NCCc2ccc3c(c2)OCCO3)[N]1 |
|
AD40087 | 1.82 | 309.34 | C13H9N8S | Cc1ccc(-n2nnnc2Sc2ncnc3c2N=C[N]3)cc1 |
|
AD40088 | 1.85 | 295.28 | C14H11O2N6 | CC1Oc2ccc(Nc3ncnc4c3N=C[N]4)cc2NC1=O |
|
AD40089 | 1.57 | 309.34 | C13H9N8S | C1=Nc2c(ncnc2Sc2nnnn2Cc2ccccc2)[N]1 |
|
AD40090 | 1.91 | 315.4 | C16H23ON6 | CCCCCNC(=O)C1CCN(c2ncnc3c2N=C[N]3)CC1 |