Molecule ID: mol20798

SMILES: CC1(C)CCN1Cc1ccc2c(c1)OCO2

InChI: InChI=1S/C13H17NO2/c1-13(2)5-6-14(13)8-10-3-4-11-12(7-10)16-9-15-11/h3-4,7H,5-6,8-9H2,1-2H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization