Molecule ID: mol26651

SMILES: CCc1cccc2c(N)c3ccccc3nc12

InChI: InChI=1S/C15H14N2/c1-2-10-6-5-8-12-14(16)11-7-3-4-9-13(11)17-15(10)12/h3-9H,2H2,1H3,(H2,16,17)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization