Molecule ID: mol19022

SMILES: Cc1cccc(C)c1CNc1nccc2cc[nH]c12

InChI: InChI=1S/C16H17N3/c1-11-4-3-5-12(2)14(11)10-19-16-15-13(6-8-17-15)7-9-18-16/h3-9,17H,10H2,1-2H3,(H,18,19)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
8.63 Baltruschat ChEMBL 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization