Molecule ID: mol23599

SMILES: O=C(O)COc1cccc(NC(=O)CCl)c1

InChI: InChI=1S/C10H10ClNO4/c11-5-9(13)12-7-2-1-3-8(4-7)16-6-10(14)15/h1-4H,5-6H2,(H,12,13)(H,14,15)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization