aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD27341 | 1.52 | 211.21 | C10H7N6 | C1=Nc2c(ncnc2Nc2ccncc2)[N]1 |
|
AD27342 | -0.21 | 202.2 | C9H8ON5 | NC(=O)C1=C(Nc2ccncc2)[N]C=N1 |
|
AD27343 | -0.42 | 198.27 | C10H18O2N2 | O=C(NCCO)C1CC2CCN1CC2 |
|
AD27344 | -0.87 | 205.2 | C8H9ON6 | Cn1cncc1NC1=C(C(N)=O)N=C[N]1 |
|
AD27345 | -1.24 | 184.2 | C7H12O2N4 | Cc1nc(CC(=O)NCCO)n[nH]1 |
|
AD27346 | -0.42 | 186.25 | C9H18O2N2 | CN1CCCCC1C(=O)NCCO |
|
AD27347 | -0.5 | 185.27 | C9H19ON3 | CC(C)N1CCN(CC(N)=O)CC1 |
|
AD27348 | -0.21 | 177.22 | C6H11O3NS | NS(=O)(=O)C1CCC(=O)CC1 |
|
AD27349 | -2.31 | 172.25 | C8H18ON3 | C[NH+]1CCN(CCC(N)=O)CC1 |
|
AD27350 | -1.39 | 202.26 | C7H12O2N3S | [NH3+]Cc1ncc(C(=O)NCCO)s1 |