Molecule ID: mol28654
SMILES: O=S(=O)(NCc1ccccc1)c1nc2ccccc2s1
InChI: InChI=1S/C14H12N2O2S2/c17-20(18,15-10-11-6-2-1-3-7-11)14-16-12-8-4-5-9-13(12)19-14/h1-9,15H,10H2
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.15 | AttenGpKa training set | 0 » -1 |