pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.8	IUPAC digitized pKa	1	0	Cn1c([NH3+])nc(=O)c2nccnc21,Cn1c(N)nc(=O)c2ncc[nH+]c21,Cn1c(N)[nH+]c(=O)c2nccnc21,Cn1c(N)nc(=O)c2[nH+]ccnc21	Cn1c(N)nc(=O)c2nccnc21	mol4714	Cn1c(N)nc(=O)c2nccnc21
2.86	IUPAC digitized pKa	1	0	Cn1c([NH3+])nc(=O)c2nccnc21,Cn1c(N)nc(=O)c2ncc[nH+]c21,Cn1c(N)[nH+]c(=O)c2nccnc21,Cn1c(N)nc(=O)c2[nH+]ccnc21	Cn1c(N)nc(=O)c2nccnc21	mol4714	Cn1c(N)nc(=O)c2nccnc21