Molecule ID: mol11578

SMILES: O=c1[nH]c2ccc3c(c2[nH]1)CCCC3

InChI: InChI=1S/C11H12N2O/c14-11-12-9-6-5-7-3-1-2-4-8(7)10(9)13-11/h5-6H,1-4H2,(H2,12,13,14)

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
13.00 IUPAC digitized pKa 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization