pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.4	Novartis	1	0	C[NH+](C)CCSc1nc2ccccc2cc1-c1ccccc1	CN(C)CCSc1nc2ccccc2cc1-c1ccccc1	mol2888	CN(C)CCSc1nc2ccccc2cc1-c1ccccc1