Molecule ID: mol20457

SMILES: O=C1NC(=O)[C@@]2(CCOc3ccc(Cl)cc32)O1

InChI: InChI=1S/C11H8ClNO4/c12-6-1-2-8-7(5-6)11(3-4-16-8)9(14)13-10(15)17-11/h1-2,5H,3-4H2,(H,13,14,15)/t11-/m0/s1

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
5.60 Baltruschat ChEMBL 0 » -1
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Charge States and Microspecies Visualization