Molecule ID: mol38273

SMILES: c1cc2nc(c1)-c1cccc(n1)-c1cccc(n1)CNCCNCc1cccc(n1)-c1cccc(n1)-c1cccc(n1)CNCCNC2

InChI: InChI=1S/C38H38N10/c1-7-27-23-39-19-20-40-24-29-9-3-13-33(45-29)37-17-6-18-38(48-37)34-14-4-10-30(46-34)26-42-22-21-41-25-28-8-2-12-32(44-28)36-16-5-15-35(47-36)31(11-1)43-27/h1-18,39-42H,19-26H2

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
7.69 QSARToolbox 1 » 0
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Charge States and Microspecies Visualization