Molecule ID: mol18940

SMILES: CCC(C)C(=O)OC[n+]1ccn(C)c1/C=N/O

InChI: InChI=1S/C11H17N3O3/c1-4-9(2)11(15)17-8-14-6-5-13(3)10(14)7-12-16/h5-7,9H,4,8H2,1-3H3/p+1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization