Molecule ID: mol20262

SMILES: CCN(CC)CCNc1c2ccccc2[n+](C)c2c1[nH]c1ccccc12

InChI: InChI=1S/C22H26N4/c1-4-26(5-2)15-14-23-20-17-11-7-9-13-19(17)25(3)22-16-10-6-8-12-18(16)24-21(20)22/h6-13H,4-5,14-15H2,1-3H3,(H,23,24)/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