aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD37451 | 1.88 | 281.3 | C14H13ON6 | CCNC(=O)c1ccc(Nc2ncnc3c2N=C[N]3)cc1 |
|
AD37452 | 1.43 | 282.33 | C15H16ON5 | OCCN(CCc1ccccc1)c1ncnc2c1N=C[N]2 |
|
AD37453 | 1.44 | 269.29 | C13H13ON6 | COc1cccc(CCNc2ncnc3c2N=C[N]3)n1 |
|
AD37454 | 1.52 | 274.33 | C11H12N7S | CN(C)c1nc(CNc2ncnc3c2N=C[N]3)cs1 |
|
AD37455 | 1.54 | 286.24 | C11H11ON5F3 | CC1CN(c2ncnc3c2N=C[N]3)CC(C(F)(F)F)O1 |
|
AD37456 | 1.44 | 287.35 | C14H19ON6 | CC(C)C(Nc1ncnc2c1N=C[N]2)C(=O)N1CCCC1 |
|
AD37457 | 1.8 | 267.32 | C14H15N6 | CCCc1ccc(-n2c(N)c3c(nc2=N)[N]C=N3)cc1 |
|
AD37458 | 1.83 | 283.31 | C14H15ON6 | CCOc1cccc(CCNc2ncnc3c2N=C[N]3)n1 |
|
AD37459 | 1.87 | 290.31 | C15H12N7 | C1=Nc2c(ncnc2N2CC(c3nc4ccccc4[nH]3)C2)[N]1 |
|
AD37460 | 1.43 | 269.29 | C13H13ON6 | COc1ccc(CN(C)c2ncnc3c2N=C[N]3)cn1 |