Molecule ID: mol35636

SMILES: CCN(CC)CCCNc1nccc2c(C)c3c(cc12)c1cnccc1n3C

InChI: InChI=1S/C23H29N5/c1-5-28(6-2)13-7-10-25-23-19-14-18-20-15-24-11-9-21(20)27(4)22(18)16(3)17(19)8-12-26-23/h8-9,11-12,14-15H,5-7,10,13H2,1-4H3,(H,25,26)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
5.40 QSARToolbox 3 » 2
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Charge States and Microspecies Visualization