Molecule ID: mol7953

SMILES: CN(C)c1nc2c(o1)CCCC2

InChI: InChI=1S/C9H14N2O/c1-11(2)9-10-7-5-3-4-6-8(7)12-9/h3-6H2,1-2H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
5.90 IUPAC digitized pKa 1 » 0
6.16 OCHEM 1 » 0
6.16 Datawarrior 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization