pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.19	IUPAC digitized pKa	1	0	Cc1cc(C)c(C)[nH+]c1C	Cc1cc(C)c(C)nc1C	mol3791	Cc1cc(C)c(C)nc1C
7.9	IUPAC digitized pKa	1	0	Cc1cc(C)c(C)[nH+]c1C	Cc1cc(C)c(C)nc1C	mol3791	Cc1cc(C)c(C)nc1C
7.58	IUPAC digitized pKa	1	0	Cc1cc(C)c(C)[nH+]c1C	Cc1cc(C)c(C)nc1C	mol3791	Cc1cc(C)c(C)nc1C
7.90000009536743	QSARToolbox	1	0	Cc1cc(C)c(C)[nH+]c1C	Cc1cc(C)c(C)nc1C	mol3791	Cc1cc(C)c(C)nc1C