pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.76	AvLiLuMoVe	1	0	N#Cc1ccc2c(c1)N(CCCC[NH+]1CCC(O)CC1)c1ccccc1S2	N#Cc1ccc2c(c1)N(CCCCN1CCC(O)CC1)c1ccccc1S2	mol75	N#Cc1ccc2c(c1)N(CCCCN1CCC(O)CC1)c1ccccc1S2