Molecule ID: mol34655

SMILES: c1ccc(-c2cc3nc(c2)COCCOCCOCCOCCOCCOCCOC3)cc1

InChI: InChI=1S/C25H35NO7/c1-2-4-22(5-3-1)23-18-24-20-32-16-14-30-12-10-28-8-6-27-7-9-29-11-13-31-15-17-33-21-25(19-23)26-24/h1-5,18-19H,6-17,20-21H2

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
3.97 QSARToolbox 1 » 0
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Charge States and Microspecies Visualization