pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.35	IUPAC digitized pKa	1	0	C[C@H]1C[C@H](OC(=O)c2ccccc2)CC(C)(C)[NH2+]1	C[C@H]1C[C@H](OC(=O)c2ccccc2)CC(C)(C)N1	mol5185	CC1CC(OC(=O)c2ccccc2)CC(C)(C)N1
8.9700003	OCHEM	1	0	C[C@H]1C[C@H](OC(=O)c2ccccc2)CC(C)(C)[NH2+]1	C[C@H]1C[C@H](OC(=O)c2ccccc2)CC(C)(C)N1	mol5185	CC1CC(OC(=O)c2ccccc2)CC(C)(C)N1