Molecule ID: mol4430

SMILES: COc1cc(NC(C)CCCNC(C)C)c2ncccc2c1

InChI: InChI=1S/C18H27N3O/c1-13(2)19-9-5-7-14(3)21-17-12-16(22-4)11-15-8-6-10-20-18(15)17/h6,8,10-14,19,21H,5,7,9H2,1-4H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization