pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.69	OCHEM	1	0	C[NH+](C)c1cnc2ccccc2n1,CN(C)c1cnc2ccccc2[nH+]1,CN(C)c1c[nH+]c2ccccc2n1	CN(C)c1cnc2ccccc2n1	mol4673	CN(C)c1cnc2ccccc2n1
