aglycones
| Molecular_Structure | AD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
AD38991 | 1.97 | 297.14 | C10H11ON5Br | CC(C)(O)CC=Nc1ncnc2c1N=C(Br)[N]2 |
|
AD38992 | 0.3 | 281.33 | C14H20O2N3F | CN1CCN(c2ccc(C(=O)NCCO)c(F)c2)CC1 |
|
AD38993 | 0.95 | 293.33 | C12H13O3N4S | O=C1CCC(S(=O)(=O)Nc2ncnc3c2C=C[N]3)CC1 |
|
AD38994 | 0.78 | 311.34 | C12H15O4N4S | COC(=O)CCCCS(=O)(=O)Nc1ncnc2c1C=C[N]2 |
|
AD38995 | 1.82 | 283.38 | C11H13O2N3S2 | Cc1ncc(S(=O)(=O)Nc2ccc(S)cc2)n1C |
|
AD38996 | 1.05 | 284.11 | C10H10O2N3Br | O=C(NCCO)c1n[nH]c2ccc(Br)cc12 |
|
AD38997 | 0.99 | 303.12 | C7H5O2N5SBr | C=CS(=O)(=O)Nc1ncnc2c1N=C(Br)[N]2 |
|
AD38998 | 0.96 | 151.19 | C7H11N4 | C1=C(C2CCCCN2)N=N[N]1 |
|
AD38999 | 1.71 | 293.35 | C16H17N6 | CN(Cc1ccccc1)C1CN(c2ncnc3c2N=C[N]3)C1 |
|
AD39000 | -0.04 | 103.17 | C5H13ON | CC(C)C(O)CN |