pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.005	Novartis	1	0	CC(C)[NH+](CCc1c(C(C)(C)O)[nH]c2ccccc12)Cc1ccc(CCC(=O)N=O)cc1	CC(C)N(CCc1c(C(C)(C)O)[nH]c2ccccc12)Cc1ccc(CCC(=O)N=O)cc1	mol2797	CC(C)N(CCc1c(C(C)(C)O)[nH]c2ccccc12)Cc1ccc(CCC(=O)N=O)cc1