aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD39281 | 1.38 | 302.29 | C14H13O2N5F | OC(CNc1ncnc2c1N=C[N]2)COc1ccc(F)cc1 |
|
AD39282 | 1.93 | 298.31 | C12H8ON7S | Cn1c(Sc2ncnc3c2N=C[N]3)nnc1-c1ccco1 |
|
AD39283 | 1.85 | 297.32 | C15H14N6F | Fc1ccccc1N1CCN(c2ncnc3c2N=C[N]3)CC1 |
|
AD39284 | 1.92 | 314.29 | C13H15ON5F3 | CC(O)(C1CCN(c2ncnc3c2N=C[N]3)CC1)C(F)(F)F |
|
AD39285 | 1.53 | 300.26 | C12H13ON5F3 | OC(C1CCN(c2ncnc3c2N=C[N]3)CC1)C(F)(F)F |
|
AD39286 | 1.42 | 295.33 | C15H15ON6 | Oc1ccc(N2CCN(c3ncnc4c3N=C[N]4)CC2)cc1 |
|
AD39287 | 1.72 | 309.35 | C16H17ON6 | COc1cccc(N2CCN(c3ncnc4c3N=C[N]4)CC2)c1 |
|
AD39288 | 1.2 | 297.35 | C14H17N8 | Cn1cc(N2CCCC(Nc3ncnc4c3N=C[N]4)C2)cn1 |
|
AD39289 | 1.76 | 314.76 | C15H13N7Cl | Clc1ccc(N2CCN(c3ncnc4c3N=C[N]4)CC2)nc1 |
|
AD39290 | 1.74 | 311.3 | C15H12ON6F | O=C1C(Nc2ncnc3c2N=C[N]3)CCN1c1ccccc1F |