Molecule ID: mol24310

SMILES: COc1cc(C(CO)N(C)C)ccc1O

InChI: InChI=1S/C11H17NO3/c1-12(2)9(7-13)8-4-5-10(14)11(6-8)15-3/h4-6,9,13-14H,7H2,1-3H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
9.52 AttenGpKa training set 0 » -1
9.54 AttenGpKa training set 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization