pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.99	Baltruschat ChEMBL	1	0	C#CC[C@H](OC[n+]1ccn(C)c1/C=N/O)c1ccccc1	C#CC[C@H](OC[n+]1ccn(C)c1/C=N/[O-])c1ccccc1	mol21484	C#CCC(OC[n+]1ccn(C)c1/C=N/O)c1ccccc1