pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.81999969482422	QSARToolbox	0	-1	O=CNNC(=O)[C@H](Cc1ccccc1)NC=O	O=CN[N-]C(=O)[C@H](Cc1ccccc1)NC=O,O=C[N-]NC(=O)[C@H](Cc1ccccc1)NC=O	mol37442	O=CNNC(=O)[C@H](Cc1ccccc1)NC=O