Molecule ID: mol20864

SMILES: CNCC[C@H](Oc1cccc2ccccc12)c1cccs1

InChI: InChI=1S/C18H19NOS/c1-19-12-11-17(18-10-5-13-21-18)20-16-9-4-7-14-6-2-3-8-15(14)16/h2-10,13,17,19H,11-12H2,1H3/t17-/m0/s1

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
9.97 Baltruschat ChEMBL 1 » 0
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Charge States and Microspecies Visualization