Molecule ID: mol1252

SMILES: CC[C@@H](C)N1CCC(c2ccccc2)(c2ccccc2)CC1

InChI: InChI=1S/C21H27N/c1-3-18(2)22-16-14-21(15-17-22,19-10-6-4-7-11-19)20-12-8-5-9-13-20/h4-13,18H,3,14-17H2,1-2H3/t18-/m1/s1

Experimental Macro pKa Values

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