aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD38151 | 0.57 | 88.11 | C4H8O2 | CCOC(C)=O |
|
AD38152 | 2.94 | 244.17 | C10H7O2N2F3 | Cc1nc(-c2ccc(OC(F)(F)F)cc2)no1 |
|
AD38153 | 1.45 | 216.29 | C12H16N4 | CN(Cc1ccccc1)Cc1cn(C)nn1 |
|
AD38154 | 1.84 | 187.6 | C9H7ONFCl | CNC(=O)c1ccc(F)c(Cl)c1 |
|
AD38155 | 3.36 | 237.35 | C17H19N | c1ccc(C2(c3ccccc3)CCNCC2)cc1 |
|
AD38156 | 2.91 | 290.76 | C13H9N5ClS | Nc1nc2c(c(SCc3ccc(Cl)cc3)n1)N=C[N]2 |
|
AD38157 | 2.71 | 218.23 | C11H6O3S | O=c1oc2c(cc(O)c3ccccc32)s1 |
|
AD38158 | 1.52 | 272.31 | C12H10ON5S | Nc1nc2c(c(=O)[nH]1)N=C(SCc1ccccc1)[N]2 |
|
AD38159 | 2.62 | 245.26 | C12H7O3NS | O=c1c(-c2cscn2)coc2cc(O)ccc12 |
|
AD38160 | 3.17 | 238.24 | C15H10O3 | O=c1cc(-c2ccccc2)oc2ccc(O)cc12 |