pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.91	Baltruschat ChEMBL	1	0	C=C(C)C[C@H](OC[n+]1ccn(C)c1/C=N/O)C(=C)C	C=C(C)C[C@H](OC[n+]1ccn(C)c1/C=N/[O-])C(=C)C	mol21456	C=C(C)CC(OC[n+]1ccn(C)c1/C=N/O)C(=C)C
