aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD37441 | 0.24 | 290.28 | C13H13O2N5F | CN(C)C(=O)c1cc(NC2=C(C(N)=O)N=C[N]2)ccc1F |
|
AD37442 | 0.39 | 271.3 | C13H15ON6 | NC(=O)C1=C(Nc2ccc(N3CCCC3)nc2)[N]C=N1 |
|
AD37443 | 0.58 | 267.27 | C13H11ON6 | NC(=O)C1=C(Nc2ccc(-n3cccn3)cc2)[N]C=N1 |
|
AD37444 | 1.87 | 272.31 | C12H10ON5S | CS(=O)c1ccc(Nc2ncnc3c2N=C[N]3)cc1 |
|
AD37445 | 1.53 | 281.29 | C12H15N6F2 | FC(F)CN1CCC(Nc2ncnc3c2N=C[N]3)CC1 |
|
AD37446 | 1.77 | 291.3 | C14H11N8 | C1=Nc2c(ncnc2Nc2cnn(Cc3ccccn3)c2)[N]1 |
|
AD37447 | 1.7 | 280.31 | C15H14ON5 | Oc1ccc2c(c1)CCN(c1ncnc3c1N=C[N]3)CC2 |
|
AD37448 | 1.83 | 270.32 | C13H16N7 | CCn1nc(C)c(CNc2ncnc3c2N=C[N]3)c1C |
|
AD37449 | 1.92 | 284.34 | C15H18ON5 | C1=Nc2c(ncnc2N2CC3(CCC3)C2C2CCCO2)[N]1 |
|
AD37450 | 1.15 | 272.21 | C10H9ON5F3 | FC(F)(F)C1CN(c2ncnc3c2N=C[N]3)CCO1 |