Molecule ID: mol18938

SMILES: Cn1cc[n+](COCC2CC2)c1/C=N/O

InChI: InChI=1S/C10H15N3O2/c1-12-4-5-13(10(12)6-11-14)8-15-7-9-2-3-9/h4-6,9H,2-3,7-8H2,1H3/p+1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization