Molecule ID: mol17017

SMILES: CN1C=CN(C2OC(C(F)(F)F)=CN2c2ccc(S(N)(=O)=O)cc2)C=C1

InChI: InChI=1S/C15H15F3N4O3S/c1-20-6-8-21(9-7-20)14-22(10-13(25-14)15(16,17)18)11-2-4-12(5-3-11)26(19,23)24/h2-10,14H,1H3,(H2,19,23,24)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
7.18 Baltruschat ChEMBL 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization