pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.94	AttenGpKa training set	0	-1	C(Cc1nnn[nH]1)Cc1nnn[nH]1	C(Cc1nnn[n-]1)Cc1nnn[nH]1	mol25926	C(Cc1nnn[nH]1)Cc1nnn[nH]1
4.94999980926514	QSARToolbox	-1	-2	C(Cc1nnn[n-]1)Cc1nnn[nH]1	C(Cc1nnn[n-]1)Cc1nnn[n-]1	mol25926	C(Cc1nnn[nH]1)Cc1nnn[nH]1
4.95	AttenGpKa training set	-1	-2	C(Cc1nnn[n-]1)Cc1nnn[nH]1	C(Cc1nnn[n-]1)Cc1nnn[n-]1	mol25926	C(Cc1nnn[nH]1)Cc1nnn[nH]1