Molecule ID: mol21439

SMILES: Clc1ccc(CN(Cc2nnn[nH]2)c2ccccc2)cc1Cl

InChI: InChI=1S/C15H13Cl2N5/c16-13-7-6-11(8-14(13)17)9-22(10-15-18-20-21-19-15)12-4-2-1-3-5-12/h1-8H,9-10H2,(H,18,19,20,21)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
4.49 Baltruschat ChEMBL 0 » -1
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Charge States and Microspecies Visualization