pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.22	Datawarrior	0	-1	CCc1n[nH]c(CC)n1	CCc1n[n-]c(CC)n1	mol4289	CCc1n[nH]c(CC)n1
10.2200002670288	QSARToolbox	0	-1	CCc1n[nH]c(CC)n1	CCc1n[n-]c(CC)n1	mol4289	CCc1n[nH]c(CC)n1
3.75	IUPAC digitized pKa	1	0	CCc1nc(CC)[nH+][nH]1,CCc1n[nH]c(CC)[nH+]1	CCc1n[nH]c(CC)n1	mol4289	CCc1n[nH]c(CC)n1
