pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.23	Hunt	1	0	C[C@@H]1CCC[NH+]([C@@H](C)C=C(c2cccs2)c2cccs2)C1	C[C@@H]1CCCN([C@@H](C)C=C(c2cccs2)c2cccs2)C1	mol1250	C[C@@H]1CCCN([C@@H](C)C=C(c2cccs2)c2cccs2)C1