Molecule ID: mol1509

SMILES: CCN(CC)CCCCC(O)(c1ccccc1)c1ccccc1

InChI: InChI=1S/C21H29NO/c1-3-22(4-2)18-12-11-17-21(23,19-13-7-5-8-14-19)20-15-9-6-10-16-20/h5-10,13-16,23H,3-4,11-12,17-18H2,1-2H3

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
10.08 IUPAC digitized pKa 1 » 0
10.08 Hunt 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization