Molecule ID: mol21458

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

InChI: InChI=1S/C10H13N3O2/c1-4-9(2)15-8-13-6-5-12(3)10(13)7-11-14/h1,5-7,9H,8H2,2-3H3/p+1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization