Molecule ID: mol16596

SMILES: c1ccc2c(NCCN3CCOCC3)c3oc4ccccc4c3nc2c1

InChI: InChI=1S/C21H21N3O2/c1-3-7-17-15(5-1)19(22-9-10-24-11-13-25-14-12-24)21-20(23-17)16-6-2-4-8-18(16)26-21/h1-8H,9-14H2,(H,22,23)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization