pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
15.6000003814697	QSARToolbox	0	-1	COc1ccc2[nH]c3c(c2c1)CCN[C@H]3C	COc1ccc2[n-]c3c(c2c1)CCN[C@H]3C	mol34750	COc1ccc2[nH]c3c(c2c1)CCNC3C