Molecule ID: mol33997

SMILES: CCn1cc(C(=O)O)c(=O)c2cc(F)c(N3CCNCC3)c(F)c21

InChI: InChI=1S/C16H17F2N3O3/c1-2-20-8-10(16(23)24)15(22)9-7-11(17)14(12(18)13(9)20)21-5-3-19-4-6-21/h7-8,19H,2-6H2,1H3,(H,23,24)

Experimental Macro pKa Values

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