Molecule ID: mol31657

SMILES: Oc1ccc2c(c1)C13CCCCC1(O)C(C2)N(CC1CCC1)CC3

InChI: InChI=1S/C21H29NO2/c23-17-7-6-16-12-19-21(24)9-2-1-8-20(21,18(16)13-17)10-11-22(19)14-15-4-3-5-15/h6-7,13,15,19,23-24H,1-5,8-12,14H2

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
8.19 OCHEM 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization