Molecule ID: mol2992

SMILES: O=C(O)COc1ccc(Cl)cc1C1CCCCC1

InChI: InChI=1S/C14H17ClO3/c15-11-6-7-13(18-9-14(16)17)12(8-11)10-4-2-1-3-5-10/h6-8,10H,1-5,9H2,(H,16,17)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
3.51 Novartis 0 » -1
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Charge States and Microspecies Visualization