Molecule ID: mol17356

SMILES: O=C(O)c1cccc(NCc2ccc3sc(B(O)O)cc3c2)c1

InChI: InChI=1S/C16H14BNO4S/c19-16(20)11-2-1-3-13(7-11)18-9-10-4-5-14-12(6-10)8-15(23-14)17(21)22/h1-8,18,21-22H,9H2,(H,19,20)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
6.39 Baltruschat ChEMBL 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization