Molecule ID: mol2387

SMILES: C[C@H]1CC[C@@H](O)[C@@H](N)C1

InChI: InChI=1S/C7H15NO/c1-5-2-3-7(9)6(8)4-5/h5-7,9H,2-4,8H2,1H3/t5-,6-,7+/m0/s1

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
9.38 OCHEM 1 » 0
9.38 Hunt 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization