Molecule ID: mol20259

SMILES: CCN(CC)CCCCNc1c2ccccc2[n+](C)c2c1[nH]c1ccccc12

InChI: InChI=1S/C24H30N4/c1-4-28(5-2)17-11-10-16-25-22-19-13-7-9-15-21(19)27(3)24-18-12-6-8-14-20(18)26-23(22)24/h6-9,12-15H,4-5,10-11,16-17H2,1-3H3,(H,25,26)/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