pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
1.25	IUPAC digitized pKa	1	0	CCOc1nc(N(C)C)[nH+]cc1[N+](=O)[O-],CCOc1nc([NH+](C)C)ncc1[N+](=O)[O-],CCOc1[nH+]c(N(C)C)ncc1[N+](=O)[O-]	CCOc1nc(N(C)C)ncc1[N+](=O)[O-]	mol7401	CCOc1nc(N(C)C)ncc1[N+](=O)[O-]