Molecule ID: mol31999

SMILES: O=C(NCCCCCCNCCc1ccc(O)c2nc(O)sc12)Nc1ccccc1

InChI: InChI=1S/C22H28N4O3S/c27-18-11-10-16(20-19(18)26-22(29)30-20)12-15-23-13-6-1-2-7-14-24-21(28)25-17-8-4-3-5-9-17/h3-5,8-11,23,27H,1-2,6-7,12-15H2,(H,26,29)(H2,24,25,28)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
8.00 OCHEM 1 » 0
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Charge States and Microspecies Visualization