Molecule ID: mol37028

SMILES: Cc1c(O)c(C=O)c(CO)c[n+]1C

InChI: InChI=1S/C9H11NO3/c1-6-9(13)8(5-12)7(4-11)3-10(6)2/h3,5,11H,4H2,1-2H3/p+1

Experimental Macro pKa Values

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