pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
3.88	OCHEM	1	0	O=c1c(-c2nnn[nH]2)cccn1C[C@@H]1C[NH2+]CCO[C@H]1c1ccc(Cl)c(F)c1	O=c1c(-c2nnn[nH]2)cccn1C[C@@H]1CNCCO[C@H]1c1ccc(Cl)c(F)c1	mol16365	O=c1c(-c2nnn[nH]2)cccn1C[C@@H]1CNCCO[C@H]1c1ccc(Cl)c(F)c1