Molecule ID: mol14148
SMILES: NC(=S)Nc1cccc(Cl)c1
InChI: InChI=1S/C7H7ClN2S/c8-5-2-1-3-6(4-5)10-7(9)11/h1-4H,(H3,9,10,11)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 12.00 | Datawarrior | 0 » -1 |
| 12.00 | OCHEM | 0 » -1 |
| 12.00 | QSARToolbox | 0 » -1 |
| 12.00 | AttenGpKa training set | 0 » -1 |