Molecule ID: mol7951

SMILES: Nc1nc2c(o1)CCCC2

InChI: InChI=1S/C7H10N2O/c8-7-9-5-3-1-2-4-6(5)10-7/h1-4H2,(H2,8,9)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization