Molecule ID: mol21119

SMILES: COC(=O)N1CCc2snc(O)c2CC1

InChI: InChI=1S/C9H12N2O3S/c1-14-9(13)11-4-2-6-7(3-5-11)15-10-8(6)12/h2-5H2,1H3,(H,10,12)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization