Molecule ID: mol18021

SMILES: Cc1c(C(F)(F)F)nc2c(OCc3ccccc3)cccn12

InChI: InChI=1S/C16H13F3N2O/c1-11-14(16(17,18)19)20-15-13(8-5-9-21(11)15)22-10-12-6-3-2-4-7-12/h2-9H,10H2,1H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization