pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.7	Datawarrior	1	0	CC[NH+]=c1sc(-c2ccccc2)nn1CC,CCN=c1sc(-c2ccccc2)[nH+]n1CC	CCN=c1sc(-c2ccccc2)nn1CC	mol14594	CCN=c1sc(-c2ccccc2)nn1CC
6.6999998	OCHEM	1	0	CC[NH+]=c1sc(-c2ccccc2)nn1CC,CCN=c1sc(-c2ccccc2)[nH+]n1CC	CCN=c1sc(-c2ccccc2)nn1CC	mol14594	CCN=c1sc(-c2ccccc2)nn1CC