Molecule ID: mol7888

SMILES: OC1NC=Nc2cc(C(F)(F)F)ccc21

InChI: InChI=1S/C9H7F3N2O/c10-9(11,12)5-1-2-6-7(3-5)13-4-14-8(6)15/h1-4,8,15H,(H,13,14)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
6.85 IUPAC digitized pKa 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization