Molecule ID: mol20212

SMILES: Clc1ccccc1Nc1c2ccccc2nc2ccccc12

InChI: InChI=1S/C19H13ClN2/c20-15-9-3-6-12-18(15)22-19-13-7-1-4-10-16(13)21-17-11-5-2-8-14(17)19/h1-12H,(H,21,22)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization