pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.33	Datawarrior	0	-1	Cc1c(C(=O)O)[nH]c2ccccc12	Cc1c(C(=O)[O-])[nH]c2ccccc12	mol13787	Cc1c(C(=O)O)[nH]c2ccccc12
4.3299999	OCHEM	0	-1	Cc1c(C(=O)O)[nH]c2ccccc12	Cc1c(C(=O)[O-])[nH]c2ccccc12	mol13787	Cc1c(C(=O)O)[nH]c2ccccc12
4.32999992370606	QSARToolbox	0	-1	Cc1c(C(=O)O)[nH]c2ccccc12	Cc1c(C(=O)[O-])[nH]c2ccccc12	mol13787	Cc1c(C(=O)O)[nH]c2ccccc12