Molecule ID: mol28964

SMILES: CP(=O)(S)NCc1ccccc1

InChI: InChI=1S/C8H12NOPS/c1-11(10,12)9-7-8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H2,9,10,12)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
2.86 AttenGpKa training set 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization