pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.73	Datawarrior	1	0	CCNC(=[OH+])/C=C(/[70SH])c1ccccc1	CCNC(=O)/C=C(/[70SH])c1ccccc1	mol13288	CCNC(=O)/C=C(/[70SH])c1ccccc1