aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD35331 | -0.11 | 260.35 | C13H20N6 | CC[NH+]1CCCN(c2ncnc3c2N=C[N]3)C(C)C1 |
|
AD35332 | 0.25 | 260.35 | C13H20N6 | CC(C)(C)[NH+]1CCC1CNc1ncnc2c1N=C[N]2 |
|
AD35333 | -0.25 | 260.35 | C13H20N6 | CC1C[NH+](C)CCC1N(C)c1ncnc2c1N=C[N]2 |
|
AD35334 | 0.26 | 260.35 | C13H20N6 | CCC[NH+]1CCCC1CNc1ncnc2c1N=C[N]2 |
|
AD35335 | 0.25 | 260.35 | C13H20N6 | CC(C)(C)[NH+]1CCC(Nc2ncnc3c2N=C[N]3)C1 |
|
AD35336 | 1.83 | 254.23 | C12H8O2N5 | O=C(O)c1ccccc1Nc1ncnc2c1N=C[N]2 |
|
AD35337 | 0.9 | 250.3 | C13H18O3N2 | O=C(CCCC(=O)Nc1ccccc1)NCCO |
|
AD35338 | 1.59 | 248.31 | C12H18ON5 | CCC(C)CC(CO)Nc1ncnc2c1N=C[N]2 |
|
AD35339 | 1.76 | 246.29 | C12H16ON5 | C1=Nc2c(ncnc2NCCOC2CCCC2)[N]1 |
|
AD35340 | 1.93 | 254.27 | C13H12ON5 | C1=Nc2c(ncnc2N2CCCc3occc3C2)[N]1 |