Molecule ID: mol34921

SMILES: CC1(C)OC[C@H](Cc2ccccc2)N1C(=O)c1cccnc1

InChI: InChI=1S/C18H20N2O2/c1-18(2)20(17(21)15-9-6-10-19-12-15)16(13-22-18)11-14-7-4-3-5-8-14/h3-10,12,16H,11,13H2,1-2H3/t16-/m0/s1

Experimental Macro pKa Values

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