Molecule ID: mol15100

SMILES: Oc1cc2nc(c1)COCCOCCSCCOCCOC2

InChI: InChI=1S/C15H23NO5S/c17-15-9-13-11-20-3-1-18-5-7-22-8-6-19-2-4-21-12-14(10-15)16-13/h9-10H,1-8,11-12H2,(H,16,17)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization