pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.5	OCHEM	1	0	Nc1ccc2[nH+]c(C=Cc3ccccc3)ccc2c1,[NH3+]c1ccc2nc(C=Cc3ccccc3)ccc2c1	Nc1ccc2nc(C=Cc3ccccc3)ccc2c1	mol32788	Nc1ccc2nc(C=Cc3ccccc3)ccc2c1