Molecule ID: mol19914

SMILES: CCOC(=O)c1nn(Cc2ccccc2)nc1O

InChI: InChI=1S/C12H13N3O3/c1-2-18-12(17)10-11(16)14-15(13-10)8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H,14,16)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization