pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.1	Baltruschat ChEMBL	1	0	Cc1nn(C)c(C)c1NS(=O)(=O)c1ccc(NCCCn2ccnc2)[nH+]c1,Cc1nn(C)c(C)c1NS(=O)(=O)c1ccc([NH2+]CCCn2ccnc2)nc1,Cc1nn(C)c(C)c1NS(=O)(=O)c1ccc(NCCCn2cc[nH+]c2)nc1,Cc1nn(C)c(C)c1[NH2+]S(=O)(=O)c1ccc(NCCCn2ccnc2)nc1	Cc1nn(C)c(C)c1NS(=O)(=O)c1ccc(NCCCn2ccnc2)nc1	mol19700	Cc1nn(C)c(C)c1NS(=O)(=O)c1ccc(NCCCn2ccnc2)nc1