pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.5	Datawarrior	0	-1	C=CC[NH+](C)CCCNC(=O)/C=N/[O-],C=CCN(C)CCCNC(=O)/C=N/O	C=CCN(C)CCCNC(=O)/C=N/[O-]	mol13341	C=CCN(C)CCCNC(=O)/C=N/O
8.48	Datawarrior	1	0	C=CC[NH+](C)CCCNC(=O)/C=N/O	C=CC[NH+](C)CCCNC(=O)/C=N/[O-],C=CCN(C)CCCNC(=O)/C=N/O	mol13341	C=CCN(C)CCCNC(=O)/C=N/O