pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.19999980926514	QSARToolbox	1	0	Nc1ncc(Cc2ccc3c(c2)OCO3)c(N)[nH+]1,Nc1nc(N)c(Cc2ccc3c(c2)OCO3)c[nH+]1,Nc1nc([NH3+])ncc1Cc1ccc2c(c1)OCO2,Nc1ncc(Cc2ccc3c(c2)OCO3)c([NH3+])n1	Nc1ncc(Cc2ccc3c(c2)OCO3)c(N)n1	mol33922	Nc1ncc(Cc2ccc3c(c2)OCO3)c(N)n1