pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.89999961853027	QSARToolbox	0	-1	C[C@@H]1CN(c2c(F)c(F)c3c(c2F)[C@H](C2CC2)C=C(C(=O)[O-])C3=O)C[C@H](C)[NH2+]1	C[C@@H]1CN(c2c(F)c(F)c3c(c2F)[C@H](C2CC2)C=C(C(=O)[O-])C3=O)C[C@H](C)N1	mol35106	C[C@@H]1CN(c2c(F)c(F)c3c(c2F)C(C2CC2)C=C(C(=O)O)C3=O)C[C@H](C)N1