Molecule ID: mol18574

SMILES: O=C(O)c1cccc(/C=N/NC(=S)NC2CCCCC2)c1

InChI: InChI=1S/C15H19N3O2S/c19-14(20)12-6-4-5-11(9-12)10-16-18-15(21)17-13-7-2-1-3-8-13/h4-6,9-10,13H,1-3,7-8H2,(H,19,20)(H2,17,18,21)/b16-10+

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
5.40 Baltruschat ChEMBL 0 » -1
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Charge States and Microspecies Visualization