pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.67	OCHEM	1	0	C[C@@H]1C[C@H](Cl)[C@@H]2CCCC[C@@H]2[NH2+]1	C[C@@H]1C[C@H](Cl)[C@@H]2CCCC[C@@H]2N1	mol1637	C[C@@H]1C[C@H](Cl)[C@@H]2CCCC[C@@H]2N1