pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.7	Baltruschat ChEMBL	1	0	Cc1[nH+]c2c(/C=C/Cc3ccccc3)cccn2c1CC#N	Cc1nc2c(/C=C/Cc3ccccc3)cccn2c1CC#N	mol18016	Cc1nc2c(/C=C/Cc3ccccc3)cccn2c1CC#N