Molecule ID: mol18674

SMILES: CCOc1ccc2c3c(nccc13)-c1ccc(N)cc1N2

InChI: InChI=1S/C17H15N3O/c1-2-21-15-6-5-13-16-12(15)7-8-19-17(16)11-4-3-10(18)9-14(11)20-13/h3-9,20H,2,18H2,1H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization