Molecule ID: mol13902
SMILES: CCCC1(Br)C(=O)NC(=O)NC1=O
InChI: InChI=1S/C7H9BrN2O3/c1-2-3-7(8)4(11)9-6(13)10-5(7)12/h2-3H2,1H3,(H2,9,10,11,12,13)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 6.60 | OCHEM | 0 » -1 |
| 6.60 | QSARToolbox | 0 » -1 |
| 6.60 | Datawarrior | 0 » -1 |