pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.66	OCHEM	1	0	Cc1cn2c3c(=O)n(C)c(=O)n(C)c3nc2n1CCC[NH+]1CCc2ccccc2C1	Cc1cn2c3c(=O)n(C)c(=O)n(C)c3nc2n1CCCN1CCc2ccccc2C1	mol19634	Cc1cn2c3c(=O)n(C)c(=O)n(C)c3nc2n1CCCN1CCc2ccccc2C1