Molecule ID: mol21226

SMILES: N#Cc1ccc(Nc2nc(N)nc(Cc3c(Cl)cccc3Cl)n2)cc1

InChI: InChI=1S/C17H12Cl2N6/c18-13-2-1-3-14(19)12(13)8-15-23-16(21)25-17(24-15)22-11-6-4-10(9-20)5-7-11/h1-7H,8H2,(H3,21,22,23,24,25)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization