Molecule ID: mol29923
SMILES: CCOC(=O)c1sc(NC(=S)NC(=O)c2ccccc2)nc1C
InChI: InChI=1S/C15H15N3O3S2/c1-3-21-13(20)11-9(2)16-15(23-11)18-14(22)17-12(19)10-7-5-4-6-8-10/h4-8H,3H2,1-2H3,(H2,16,17,18,19,22)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.80 | AttenGpKa training set | 0 » -1 |