Molecule ID: mol34365

SMILES: O=C(O)c1cccc2c1C1CCC2c2cccc(Cl)c21

InChI: InChI=1S/C17H13ClO2/c18-14-6-2-4-11-9-7-8-12(16(11)14)15-10(9)3-1-5-13(15)17(19)20/h1-6,9,12H,7-8H2,(H,19,20)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
6.25 QSARToolbox 0 » -1
6.25 QSARToolbox 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization