pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.30000019073486	QSARToolbox	1	0	COc1ccc(CC[NH2+]C[C@H](O)CON=C(C2CC2)C2CC2)cc1OC	COc1ccc(CCNC[C@H](O)CON=C(C2CC2)C2CC2)cc1OC	mol38078	COc1ccc(CCNCC(O)CON=C(C2CC2)C2CC2)cc1OC