Molecule ID: mol21492

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

InChI: InChI=1S/C12H19N3O2/c1-3-4-5-6-9-17-11-15-8-7-14(2)12(15)10-13-16/h5-8,10H,3-4,9,11H2,1-2H3/p+1/b6-5+

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization