Molecule ID: mol36348

SMILES: O=C(O)[C@H]1CNCC[C@@H]1S

InChI: InChI=1S/C6H11NO2S/c8-6(9)4-3-7-2-1-5(4)10/h4-5,7,10H,1-3H2,(H,8,9)/t4-,5-/m0/s1

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
3.16 QSARToolbox 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization