Molecule ID: mol19777

SMILES: CN(CCCO)CCCCCCOc1ccc(C(=O)c2ccc(Br)cc2)cc1

InChI: InChI=1S/C23H30BrNO3/c1-25(16-6-17-26)15-4-2-3-5-18-28-22-13-9-20(10-14-22)23(27)19-7-11-21(24)12-8-19/h7-14,26H,2-6,15-18H2,1H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization