Molecule ID: mol37669

SMILES: NCCNC(=O)C1=C=C=C=C=C1

InChI: InChI=1S/C9H8N2O/c10-6-7-11-9(12)8-4-2-1-3-5-8/h4H,6-7,10H2,(H,11,12)

Experimental Macro pKa Values

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