pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.17	Datawarrior	1	0	CCc1c(C)[nH+]nc(C)c1C,CCc1c(C)n[nH+]c(C)c1C	CCc1c(C)nnc(C)c1C	mol14144	CCc1c(C)nnc(C)c1C
5.1700001	OCHEM	1	0	CCc1c(C)[nH+]nc(C)c1C,CCc1c(C)n[nH+]c(C)c1C	CCc1c(C)nnc(C)c1C	mol14144	CCc1c(C)nnc(C)c1C
5.17000007629395	QSARToolbox	1	0	CCc1c(C)[nH+]nc(C)c1C,CCc1c(C)n[nH+]c(C)c1C	CCc1c(C)nnc(C)c1C	mol14144	CCc1c(C)nnc(C)c1C