pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.45000004768372	QSARToolbox	2	1	Cc1ncc(C[OH2+])c(/C=N/NC(=O)c2cc[nH+]cc2)c1O,Cc1[nH+]cc(CO)c(/C=[NH+]/NC(=O)c2ccncc2)c1O,Cc1ncc(CO)c(/C=[NH+]/NC(=O)c2cc[nH+]cc2)c1O	Cc1ncc(CO)c(/C=[NH+]/NC(=O)c2ccncc2)c1O,Cc1[nH+]cc(CO)c(/C=N/NC(=O)c2ccncc2)c1O,Cc1ncc(CO)c(/C=N/NC(=O)c2cc[nH+]cc2)c1O	mol36014	Cc1ncc(CO)c(/C=N/NC(=O)c2ccncc2)c1O