Molecule ID: mol38198

SMILES: COc1ccc(C2=NCC(=O)N(C)c3ccc(Cl)cc32)cc1

InChI: InChI=1S/C17H15ClN2O2/c1-20-15-8-5-12(18)9-14(15)17(19-10-16(20)21)11-3-6-13(22-2)7-4-11/h3-9H,10H2,1-2H3

Experimental Macro pKa Values

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