Molecule ID: mol717

SMILES: COc1cc(OC)nc(Sc2cccc(Cl)c2C(=O)O)n1

InChI: InChI=1S/C13H11ClN2O4S/c1-19-9-6-10(20-2)16-13(15-9)21-8-5-3-4-7(14)11(8)12(17)18/h3-6H,1-2H3,(H,17,18)

Experimental Macro pKa Values

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