pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.4	OCHEM	1	0	Cc1cnc([NH2+]CCc2ccc3c(c2)CCC3)c(=O)n1CC(=O)NCc1ccc2c(ccn2N)c1,Cc1c[nH+]c(NCCc2ccc3c(c2)CCC3)c(=O)n1CC(=O)NCc1ccc2c(ccn2N)c1,Cc1cnc(NCCc2ccc3c(c2)CCC3)c(=O)n1CC(=O)NCc1ccc2c(ccn2[NH3+])c1	Cc1cnc(NCCc2ccc3c(c2)CCC3)c(=O)n1CC(=O)NCc1ccc2c(ccn2N)c1	mol18774	Cc1cnc(NCCc2ccc3c(c2)CCC3)c(=O)n1CC(=O)NCc1ccc2c(ccn2N)c1