Molecule ID: mol18941

SMILES: Cn1cc[n+](COC2CCCCCCCCCCC2)c1/C=N/O

InChI: InChI=1S/C18H31N3O2/c1-20-13-14-21(18(20)15-19-22)16-23-17-11-9-7-5-3-2-4-6-8-10-12-17/h13-15,17H,2-12,16H2,1H3/p+1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization