Molecule ID: mol29609

SMILES: CC(C)C(/N=C/c1ccncc1O)C(=O)O

InChI: InChI=1S/C11H14N2O3/c1-7(2)10(11(15)16)13-5-8-3-4-12-6-9(8)14/h3-7,10,14H,1-2H3,(H,15,16)/b13-5+

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
2.60 AttenGpKa training set 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization