pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.52	AttenGpKa training set	1	0	Cc1ccccc1-n1c(C)nc2ccccc2c1=[OH+],Cc1ccccc1-n1c(C)[nH+]c2ccccc2c1=O	Cc1ccccc1-n1c(C)nc2ccccc2c1=O	mol29661	Cc1ccccc1-n1c(C)nc2ccccc2c1=O