Molecule ID: mol18944

SMILES: Cn1cc[n+](COC(=O)C(C)(C)C)c1/C=N/O

InChI: InChI=1S/C11H17N3O3/c1-11(2,3)10(15)17-8-14-6-5-13(4)9(14)7-12-16/h5-7H,8H2,1-4H3/p+1

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
8.30 Baltruschat ChEMBL 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization