pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.52	Novartis	1	0	CCCCCCCCc1ccc(CCC([NH3+])(CO)CO)cc1	CCCCCCCCc1ccc(CCC(N)(CO)CO)cc1	mol2806	CCCCCCCCc1ccc(CCC(N)(CO)CO)cc1
