Molecule ID: mol21488

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

InChI: InChI=1S/C11H15N3O2/c1-4-10(5-2)16-9-14-7-6-13(3)11(14)8-12-15/h1,6-8,10H,5,9H2,2-3H3/p+1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization