Molecule ID: mol2893

SMILES: Cc1[nH]c2ccccc2c1CCNCc1ccc(CCC(=O)N=O)cc1

InChI: InChI=1S/C21H23N3O2/c1-15-18(19-4-2-3-5-20(19)23-15)12-13-22-14-17-8-6-16(7-9-17)10-11-21(25)24-26/h2-9,22-23H,10-14H2,1H3

Experimental Macro pKa Values

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