Molecule ID: mol15066

SMILES: CC1=Nc2ccccc2C1=C/C=C1\Cc2ccccc2N1C

InChI: InChI=1S/C20H18N2/c1-14-17(18-8-4-5-9-19(18)21-14)12-11-16-13-15-7-3-6-10-20(15)22(16)2/h3-12H,13H2,1-2H3/b16-11+,17-12?

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
1.22 Datawarrior 1 » 0
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Charge States and Microspecies Visualization