Molecule ID: mol21472

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

InChI: InChI=1S/C9H13N3O2/c1-3-6-14-8-12-5-4-11(2)9(12)7-10-13/h3-5,7H,1,6,8H2,2H3/p+1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization