aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD34881 | 0.92 | 260.28 | C12H14O2N5 | COC(=O)CC1CCCN1c1ncnc2c1N=C[N]2 |
|
AD34882 | 0.88 | 264.31 | C12H18O2N5 | COCCCOCCN(C)c1ncnc2c1N=C[N]2 |
|
AD34883 | 0.44 | 259.29 | C12H15ON6 | CC(=O)N1CCN(c2ncnc3c2N=C[N]3)C(C)C1 |
|
AD34884 | 0.69 | 261.31 | C12H17ON6 | CCCN(CC(=O)N(C)C)c1ncnc2c1N=C[N]2 |
|
AD34885 | 0.56 | 257.28 | C12H13ON6 | O=C1CC(Nc2ncnc3c2N=C[N]3)CN1C1CC1 |
|
AD34886 | -0.06 | 230.21 | C10H12O2N2F2 | O=CN1CC2(C1)CN(C(=O)C1CC1(F)F)C2 |
|
AD34887 | 0.08 | 230.21 | C10H12O2N2F2 | O=CN1CC2CC(C1)N2C(=O)C1CC1(F)F |
|
AD34888 | 0.08 | 230.21 | C10H12O2N2F2 | O=CN1CCC12CN(C(=O)C1CC1(F)F)C2 |
|
AD34889 | 0.88 | 264.31 | C12H18O2N5 | COCCCN(CCOC)c1ncnc2c1N=C[N]2 |
|
AD34890 | 0.86 | 259.29 | C12H15ON6 | O=C(CNc1ncnc2c1N=C[N]2)NC1CCCC1 |