Molecule ID: mol35950
SMILES: O=S1(=O)OC(c2ccc(NCc3ccccc3)cc2)(c2ccc(NCc3ccccc3)cc2)c2ccccc21
InChI: InChI=1S/C33H28N2O3S/c36-39(37)32-14-8-7-13-31(32)33(38-39,27-15-19-29(20-16-27)34-23-25-9-3-1-4-10-25)28-17-21-30(22-18-28)35-24-26-11-5-2-6-12-26/h1-22,34-35H,23-24H2
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 0.30 | QSARToolbox | 1 » 0 |