Molecule ID: mol18865

SMILES: CO/N=C/C1=CCCNC1

InChI: InChI=1S/C7H12N2O/c1-10-9-6-7-3-2-4-8-5-7/h3,6,8H,2,4-5H2,1H3/b9-6+

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization