pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
10.6	Hunt	1	0	Cc1cc(C(C)(C)C)cc(C)c1CC1=[NH+]CCN1	Cc1cc(C(C)(C)C)cc(C)c1CC1=NCCN1	mol588	Cc1cc(C(C)(C)C)cc(C)c1CC1=NCCN1
10.2	Baltruschat ChEMBL	1	0	Cc1cc(C(C)(C)C)cc(C)c1CC1=[NH+]CCN1	Cc1cc(C(C)(C)C)cc(C)c1CC1=NCCN1	mol588	Cc1cc(C(C)(C)C)cc(C)c1CC1=NCCN1
10.91	AttenGpKa training set	1	0	Cc1cc(C(C)(C)C)cc(C)c1CC1=[NH+]CCN1	Cc1cc(C(C)(C)C)cc(C)c1CC1=NCCN1	mol588	Cc1cc(C(C)(C)C)cc(C)c1CC1=NCCN1