Molecule ID: mol36654

SMILES: COCCNc1cccc(C(F)(F)F)c1

InChI: InChI=1S/C10H12F3NO/c1-15-6-5-14-9-4-2-3-8(7-9)10(11,12)13/h2-4,7,14H,5-6H2,1H3

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
2.50 QSARToolbox 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization