Molecule ID: mol21015

SMILES: NCc1c(Cl)ccc(NC(=O)Nc2ccccc2Br)c1O

InChI: InChI=1S/C14H13BrClN3O2/c15-9-3-1-2-4-11(9)18-14(21)19-12-6-5-10(16)8(7-17)13(12)20/h1-6,20H,7,17H2,(H2,18,19,21)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization