pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
4.2	Hunt	1	0	c1ccc(CSc2[nH]c3ccccc3[nH+]2)cc1	c1ccc(CSc2nc3ccccc3[nH]2)cc1	mol509	c1ccc(CSc2nc3ccccc3[nH]2)cc1