pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.30000019073486	QSARToolbox	1	0	O[C@@H](C[NH2+]Cc1ccccc1)CON=C(C1CC1)C1CC1	O[C@@H](CNCc1ccccc1)CON=C(C1CC1)C1CC1	mol38127	OC(CNCc1ccccc1)CON=C(C1CC1)C1CC1