Molecule ID: mol20265

SMILES: CCN(CC)CCCNc1c2ccccc2[n+](C)c2c1[nH]c1ccccc12

InChI: InChI=1S/C23H28N4/c1-4-27(5-2)16-10-15-24-21-18-12-7-9-14-20(18)26(3)23-17-11-6-8-13-19(17)25-22(21)23/h6-9,11-14H,4-5,10,15-16H2,1-3H3,(H,24,25)/p+1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization