pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.0	Hunt	1	0	N#Cc1ccc(C(=O)N2CCC3(CC2)Nc2cccc(F)c2C(N)=[NH+]3)cc1,N#Cc1ccc(C(=O)N2CCC3(CC2)N=C(N)c2c(F)cccc2[NH2+]3)cc1	N#Cc1ccc(C(=O)N2CCC3(CC2)N=C(N)c2c(F)cccc2N3)cc1	mol593	N#Cc1ccc(C(=O)N2CCC3(CC2)N=C(N)c2c(F)cccc2N3)cc1
9.1	Baltruschat ChEMBL	1	0	N#Cc1ccc(C(=O)N2CCC3(CC2)Nc2cccc(F)c2C(N)=[NH+]3)cc1,N#Cc1ccc(C(=O)N2CCC3(CC2)N=C(N)c2c(F)cccc2[NH2+]3)cc1	N#Cc1ccc(C(=O)N2CCC3(CC2)N=C(N)c2c(F)cccc2N3)cc1	mol593	N#Cc1ccc(C(=O)N2CCC3(CC2)N=C(N)c2c(F)cccc2N3)cc1