pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.32999992370606	QSARToolbox	0	-1	O=C(CN=Cc1ccccc1O)c1ccc2c(c1)OCCOCCOCCOCCO2	O=C([CH-]N=Cc1ccccc1O)c1ccc2c(c1)OCCOCCOCCOCCO2,O=C(CN=Cc1ccccc1[O-])c1ccc2c(c1)OCCOCCOCCOCCO2	mol38254	O=C(CN=Cc1ccccc1O)c1ccc2c(c1)OCCOCCOCCOCCO2
