pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.54	SAMPL8	1	0	Cc1ccccc1[NH2+]c1nc(Cl)nc2ccccc12,Cc1ccccc1Nc1nc(Cl)[nH+]c2ccccc12,Cc1ccccc1Nc1[nH+]c(Cl)nc2ccccc12	Cc1ccccc1Nc1nc(Cl)nc2ccccc12	SAMPL8-15	Cc1ccccc1Nc1nc(Cl)nc2ccccc12