aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD37391 | 0.1 | 272.29 | C13H14O2N5 | CN(C)C(=O)c1ccc(NC2=C(C(N)=O)N=C[N]2)cc1 |
|
AD37392 | 1.88 | 287.69 | C13H8ON6Cl | NC(=O)c1ccc(Nc2nc(Cl)nc3c2N=C[N]3)cc1 |
|
AD37393 | 1.23 | 253.25 | C12H9ON6 | NC(=O)c1cccc(Nc2ncnc3c2N=C[N]3)c1 |
|
AD37394 | 1.88 | 287.69 | C13H8ON6Cl | NC(=O)c1cccc(Nc2nc(Cl)nc3c2N=C[N]3)c1 |
|
AD37395 | 1.83 | 281.3 | C14H13ON6 | CN(C)C(=O)c1ccc(Nc2ncnc3c2N=C[N]3)cc1 |
|
AD37396 | 0.64 | 281.3 | C14H13ON6 | NC(=O)C1=C(Nc2cnn(Cc3ccccc3)c2)[N]C=N1 |
|
AD37397 | 0.1 | 272.29 | C13H14O2N5 | CN(C)C(=O)c1cccc(NC2=C(C(N)=O)N=C[N]2)c1 |
|
AD37398 | 1.23 | 253.24 | C12H9ON6 | NC(=O)c1ccccc1Nc1ncnc2c1N=C[N]2 |
|
AD37399 | 1.41 | 254.36 | C12H18O2N2S | CS(=O)(=O)N1CCC(c2ccc(N)cc2)CC1 |
|
AD37400 | 0.83 | 241.23 | C11H9ON6 | Cn1cc(Nc2ncnc3c2N=C[N]3)ccc1=O |