Molecule ID: mol15774

SMILES: Cc1cccc(C)c1Oc1ccccn1

InChI: InChI=1S/C13H13NO/c1-10-6-5-7-11(2)13(10)15-12-8-3-4-9-14-12/h3-9H,1-2H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
2.26 QSARToolbox 1 » 0
2.26 Datawarrior 1 » 0
2.26 OCHEM 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization