Molecule ID: mol19926

SMILES: O=[N+]([O-])c1cccc2nc3ccccc3c(NCCc3ccccc3)c12

InChI: InChI=1S/C21H17N3O2/c25-24(26)19-12-6-11-18-20(19)21(16-9-4-5-10-17(16)23-18)22-14-13-15-7-2-1-3-8-15/h1-12H,13-14H2,(H,22,23)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization