Molecule ID: mol11807

SMILES: C[N+](C)(CCC(=O)NO)Cc1ccccc1

InChI: InChI=1S/C12H18N2O2/c1-14(2,9-8-12(15)13-16)10-11-6-4-3-5-7-11/h3-7H,8-10H2,1-2H3,(H-,13,15,16)/p+1

Experimental Macro pKa Values

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