Molecule ID: mol11780
SMILES: O=C(CS)Nc1ccc2ccccc2c1
InChI: InChI=1S/C12H11NOS/c14-12(8-15)13-11-6-5-9-3-1-2-4-10(9)7-11/h1-7,15H,8H2,(H,13,14)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.21 | IUPAC digitized pKa | 0 » -1 |
| 8.39 | IUPAC digitized pKa | 0 » -1 |
| 8.52 | IUPAC digitized pKa | 0 » -1 |