Molecule ID: mol620

SMILES: O=C(NCC12CC3CC(CC(C3)C1)C2)c1cc(OCCCNCCCO)ccc1Cl

InChI: InChI=1S/C24H35ClN2O3/c25-22-4-3-20(30-8-2-6-26-5-1-7-28)12-21(22)23(29)27-16-24-13-17-9-18(14-24)11-19(10-17)15-24/h3-4,12,17-19,26,28H,1-2,5-11,13-16H2,(H,27,29)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
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Charge States and Microspecies Visualization