pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.06	Datawarrior	1	0	CC[NH2+]CC(=O)Nc1c(C)cccc1C	CCNCC(=O)Nc1c(C)cccc1C	mol14306	CCNCC(=O)Nc1c(C)cccc1C
8.0600004	OCHEM	1	0	CC[NH2+]CC(=O)Nc1c(C)cccc1C	CCNCC(=O)Nc1c(C)cccc1C	mol14306	CCNCC(=O)Nc1c(C)cccc1C