Molecule ID: mol17986

SMILES: c1ccc2c(c1)CCc1cc3ccn4ccnc4c3nc1-2

InChI: InChI=1S/C18H13N3/c1-2-4-15-12(3-1)5-6-13-11-14-7-9-21-10-8-19-18(21)17(14)20-16(13)15/h1-4,7-11H,5-6H2

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
2.43 Baltruschat ChEMBL 2 » 1
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Charge States and Microspecies Visualization