Molecule ID: mol21283

SMILES: O=C(CCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1)NS(=O)(=O)c1ccccc1

InChI: InChI=1S/C29H28NO3PS/c31-29(30-35(32,33)28-21-11-4-12-22-28)23-13-14-24-34(25-15-5-1-6-16-25,26-17-7-2-8-18-26)27-19-9-3-10-20-27/h1-12,15-22H,13-14,23-24H2/p+1

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
5.12 Baltruschat ChEMBL 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization