pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.4	IUPAC digitized pKa	1	0	CC(C)[NH2+]C[C@H](O)c1ccccc1Br	CC(C)NC[C@H](O)c1ccccc1Br	mol6127	CC(C)NCC(O)c1ccccc1Br