pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.73	IUPAC digitized pKa	0	-1	Cc1nc[nH]n1	Cc1nc[n-]n1	mol7676	Cc1nc[nH]n1
10.6	AttenGpKa training set	0	-1	Cc1nc[nH]n1	Cc1nc[n-]n1	mol7676	Cc1nc[nH]n1
3.28	IUPAC digitized pKa	1	0	Cc1n[nH]c[nH+]1,Cc1nc[nH][nH+]1	Cc1nc[nH]n1	mol7676	Cc1nc[nH]n1
3.68	IUPAC digitized pKa	1	0	Cc1n[nH]c[nH+]1,Cc1nc[nH][nH+]1	Cc1nc[nH]n1	mol7676	Cc1nc[nH]n1
3.23	AttenGpKa training set	1	0	Cc1n[nH]c[nH+]1,Cc1nc[nH][nH+]1	Cc1nc[nH]n1	mol7676	Cc1nc[nH]n1