Molecule ID: mol17250

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

InChI: InChI=1S/C9H15N3O2/c1-8(2)14-7-12-5-4-11(3)9(12)6-10-13/h4-6,8H,7H2,1-3H3/p+1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization