Molecule ID: mol36081

SMILES: Cc1ncc(CO)c(/C=N/NC(=S)N(C)C)c1O

InChI: InChI=1S/C11H16N4O2S/c1-7-10(17)9(8(6-16)4-12-7)5-13-14-11(18)15(2)3/h4-5,16-17H,6H2,1-3H3,(H,14,18)/b13-5+

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
11.16 QSARToolbox -2 » -3
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization