pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
8.46000003814697	QSARToolbox	1	0	c1nc(CCCc2[nH]cc(C3CCCCC3)[nH+]2)c[nH]1,c1[nH]cc(CCCc2nc(C3CCCCC3)c[nH]2)[nH+]1	c1nc(CCCc2nc(C3CCCCC3)c[nH]2)c[nH]1	mol34558	c1nc(CCCc2nc(C3CCCCC3)c[nH]2)c[nH]1