pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.15999984741211	QSARToolbox	1	0	Clc1ccc2[nH]c(NCCc3c[nH]c[nH+]3)nc2c1,Clc1ccc2[nH]c([NH2+]CCc3c[nH]cn3)nc2c1,Clc1ccc2[nH]c(NCCc3c[nH]cn3)[nH+]c2c1	Clc1ccc2[nH]c(NCCc3c[nH]cn3)nc2c1	mol36211	Clc1ccc2[nH]c(NCCc3c[nH]cn3)nc2c1
