pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.49	IUPAC digitized pKa	1	0	Cc1nc(N(C)C)cc[nH+]1,Cc1nccc(N(C)C)[nH+]1,Cc1nccc([NH+](C)C)n1	Cc1nccc(N(C)C)n1	mol7408	Cc1nccc(N(C)C)n1
6.13	AttenGpKa training set	1	0	Cc1nc(N(C)C)cc[nH+]1,Cc1nccc(N(C)C)[nH+]1,Cc1nccc([NH+](C)C)n1	Cc1nccc(N(C)C)n1	mol7408	Cc1nccc(N(C)C)n1