Molecule ID: mol642

SMILES: Cn1c([S@@+]([O-])Cc2ccccn2)nc2ccccc21

InChI: InChI=1S/C14H13N3OS/c1-17-13-8-3-2-7-12(13)16-14(17)19(18)10-11-6-4-5-9-15-11/h2-9H,10H2,1H3/t19-/m0/s1

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
2.60 Hunt 2 » 1
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Charge States and Microspecies Visualization