Molecule ID: mol20520

SMILES: NC(=O)c1cc[n+](Cc2ccccc2C[n+]2cccc(/C=N/O)c2)cc1

InChI: InChI=1S/C20H18N4O2/c21-20(25)17-7-10-23(11-8-17)14-18-5-1-2-6-19(18)15-24-9-3-4-16(13-24)12-22-26/h1-13H,14-15H2,(H-2,21,25,26)/p+2/b22-12+

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
8.59 OCHEM 2 » 1
8.59 Baltruschat ChEMBL 2 » 1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization