Molecule ID: mol38409

SMILES: COc1ccc(Nc2ccnc3cc(Cl)ccc23)cc1

InChI: InChI=1S/C16H13ClN2O/c1-20-13-5-3-12(4-6-13)19-15-8-9-18-16-10-11(17)2-7-14(15)16/h2-10H,1H3,(H,18,19)

Experimental Macro pKa Values

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