pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
5.83	Baltruschat ChEMBL	1	0	CCCCCn1cc(C(=O)c2cccc3ccccc23)c2cc[nH+]cc21	CCCCCn1cc(C(=O)c2cccc3ccccc23)c2ccncc21	mol21131	CCCCCn1cc(C(=O)c2cccc3ccccc23)c2ccncc21