pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.36	Manchester	1	0	CCNC1=[NH+]c2ccccc2C(c2ccccc2)=N[C@H]1c1cccs1,CCNC1=Nc2ccccc2C(c2ccccc2)=[NH+][C@H]1c1cccs1	CCNC1=Nc2ccccc2C(c2ccccc2)=N[C@H]1c1cccs1	mol2616	CCNC1=Nc2ccccc2C(c2ccccc2)=NC1c1cccs1