Molecule ID: mol21845

SMILES: CCCOCC(=Nc1ccc(Cl)cc1C(F)(F)F)n1ccnc1

InChI: InChI=1S/C15H15ClF3N3O/c1-2-7-23-9-14(22-6-5-20-10-22)21-13-4-3-11(16)8-12(13)15(17,18)19/h3-6,8,10H,2,7,9H2,1H3

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
3.70 Organic Oxygen Acids and Nitrogen Bases 2 » 1
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Charge States and Microspecies Visualization