Molecule ID: mol7486

SMILES: COc1nc(C)cc(C)n1

InChI: InChI=1S/C7H10N2O/c1-5-4-6(2)9-7(8-5)10-3/h4H,1-3H3

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
2.70 IUPAC digitized pKa 1 » 0
2.70 OCHEM 1 » 0
2.70 QSARToolbox 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization