Molecule ID: mol1956

SMILES: CCCCN1CCCC[C@@H]1C(=O)Nc1c(C)cccc1C

InChI: InChI=1S/C18H28N2O/c1-4-5-12-20-13-7-6-11-16(20)18(21)19-17-14(2)9-8-10-15(17)3/h8-10,16H,4-7,11-13H2,1-3H3,(H,19,21)/t16-/m1/s1

Experimental Macro pKa Values

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