Molecule ID: mol36822

SMILES: CC(=O)Nc1ccc2c(c1)C([P+](c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1-2

InChI: InChI=1S/C33H26NOP/c1-24(35)34-25-21-22-30-29-19-11-12-20-31(29)33(32(30)23-25)36(26-13-5-2-6-14-26,27-15-7-3-8-16-27)28-17-9-4-10-18-28/h2-23,33H,1H3/p+1

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
9.25 QSARToolbox 1 » 0
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Charge States and Microspecies Visualization