Molecule ID: mol9909
SMILES: Cc1[nH]c(=S)[nH]c(=O)c1C
InChI: InChI=1S/C6H8N2OS/c1-3-4(2)7-6(10)8-5(3)9/h1-2H3,(H2,7,8,9,10)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.76 | IUPAC digitized pKa | 0 » -1 |
| 8.06 | IUPAC digitized pKa | 0 » -1 |
| 8.08 | IUPAC digitized pKa | 0 » -1 |