Molecule ID: mol1628

SMILES: CC(C)C1=NC[C@H](C)S1

InChI: InChI=1S/C7H13NS/c1-5(2)7-8-4-6(3)9-7/h5-6H,4H2,1-3H3/t6-/m0/s1

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
5.16 OCHEM 1 » 0
5.16 Hunt 1 » 0
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Charge States and Microspecies Visualization