Molecule ID: mol3001

SMILES: O=C(O)c1ccccc1Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1

InChI: InChI=1S/C15H9F6NO2/c16-14(17,18)8-5-9(15(19,20)21)7-10(6-8)22-12-4-2-1-3-11(12)13(23)24/h1-7,22H,(H,23,24)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
3.90 Novartis 0 » -1
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Charge States and Microspecies Visualization