pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.8	AttenGpKa training set	1	0	C[NH+](C)Cc1nnc2n1-c1ccc(Cl)cc1C(c1ccccc1)=NC2	CN(C)Cc1nnc2n1-c1ccc(Cl)cc1C(c1ccccc1)=NC2	mol29928	CN(C)Cc1nnc2n1-c1ccc(Cl)cc1C(c1ccccc1)=NC2