pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.29	IUPAC digitized pKa	1	0	Cc1cccc(C)c1C(=[NH2+])c1ccccc1	Cc1cccc(C)c1C(=N)c1ccccc1	mol3475	Cc1cccc(C)c1C(=N)c1ccccc1
7.71	Datawarrior	1	0	Cc1cccc(C)c1C(=[NH2+])c1ccccc1	Cc1cccc(C)c1C(=N)c1ccccc1	mol3475	Cc1cccc(C)c1C(=N)c1ccccc1
8.0	OCHEM	1	0	Cc1cccc(C)c1C(=[NH2+])c1ccccc1	Cc1cccc(C)c1C(=N)c1ccccc1	mol3475	Cc1cccc(C)c1C(=N)c1ccccc1