pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
12.04	IUPAC digitized pKa	0	-1	C[C@@](O)(C1=NCCCN1)c1ccccc1Cl	C[C@@](O)(C1=NCCC[N-]1)c1ccccc1Cl,C[C@@]([O-])(C1=NCCCN1)c1ccccc1Cl	mol7232	CC(O)(C1=NCCCN1)c1ccccc1Cl
11.08	IUPAC digitized pKa	1	0	C[C@@](O)(C1=[NH+]CCCN1)c1ccccc1Cl	C[C@@](O)(C1=NCCCN1)c1ccccc1Cl	mol7232	CC(O)(C1=NCCCN1)c1ccccc1Cl