Molecule ID: mol5300

SMILES: NCCCCCOP(=O)(O)O

InChI: InChI=1S/C5H14NO4P/c6-4-2-1-3-5-10-11(7,8)9/h1-6H2,(H2,7,8,9)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
2.60 IUPAC digitized pKa 1 » 0
7.60 IUPAC digitized pKa 0 » -1
11.00 IUPAC digitized pKa -1 » -2
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization