pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.37	Baltruschat ChEMBL	1	0	C[NH+](CCCCCCOc1ccc(C(=O)c2ccc(Br)cc2)cc1)CC1CC1	CN(CCCCCCOc1ccc(C(=O)c2ccc(Br)cc2)cc1)CC1CC1	mol19774	CN(CCCCCCOc1ccc(C(=O)c2ccc(Br)cc2)cc1)CC1CC1