aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD30421 | 0.27 | 224.22 | C7H6O2N5S | C=CS(=O)(=O)Nc1ncnc2c1N=C[N]2 |
|
AD30422 | 0.37 | 188.19 | C9H8ON4 | NC(=O)c1cncn1-c1ccncc1 |
|
AD30423 | -0.13 | 209.25 | C10H15O2N3 | CN(C)c1ccncc1C(=O)NCCO |
|
AD30424 | 1.34 | 200.28 | C10H20O2N2 | CC1CC(N)CN1C(=O)OC(C)(C)C |
|
AD30425 | 0.5 | 217.26 | C10H13N6 | C1=Nc2c(ncnc2NCCN2CCC2)[N]1 |
|
AD30426 | 0.42 | 192.27 | C10H16N4 | CN1CCN(c2ccc(N)nc2)CC1 |
|
AD30427 | -1.61 | 131.2 | C6H15ON2 | CC(C)[NH+](C)CC(N)=O |
|
AD30428 | 0.06 | 205.22 | C10H11O2N3 | O=C(NCCO)c1ccn2cncc2c1 |
|
AD30429 | -0.32 | 206.21 | C9H10O2N4 | O=C(NCCO)c1[nH]nc2ccncc12 |
|
AD30430 | 0.53 | 231.28 | C11H15N6 | CCN1CCN(c2ncnc3c2N=C[N]3)CC1 |