Molecule ID: mol20477

SMILES: Clc1ccc2c(NCc3nc(-c4ccccc4)cs3)ccnc2c1

InChI: InChI=1S/C19H14ClN3S/c20-14-6-7-15-16(8-9-21-17(15)10-14)22-11-19-23-18(12-24-19)13-4-2-1-3-5-13/h1-10,12H,11H2,(H,21,22)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization