pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.29	Baltruschat ChEMBL	1	0	C[NH+](C)CCCN1c2ccccc2Sc2ccc(C#N)cc21,CN(C)CCC[NH+]1c2ccccc2Sc2ccc(C#N)cc21	CN(C)CCCN1c2ccccc2Sc2ccc(C#N)cc21	mol17523	CN(C)CCCN1c2ccccc2Sc2ccc(C#N)cc21