pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.08	IUPAC digitized pKa	1	0	Cc1nc2nc(NCC(C)C)[nH+]c(C)c2nc1C,Cc1nc2nc([NH2+]CC(C)C)nc(C)c2nc1C,Cc1nc2[nH+]c(NCC(C)C)nc(C)c2nc1C,Cc1nc2c(C)nc(NCC(C)C)nc2[nH+]c1C,Cc1nc2nc(NCC(C)C)nc(C)c2[nH+]c1C	Cc1nc2nc(NCC(C)C)nc(C)c2nc1C	mol8207	Cc1nc2nc(NCC(C)C)nc(C)c2nc1C
