Molecule ID: mol21498

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

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