smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C([O-])C[NH+](CC(=O)[O-])Cc1cc2c(cc1O)Oc1cc(O)c(C[NH+](CC(=O)[O-])CC(=O)[O-])cc1C21OC(=O)c2ccccc21	ZINC000004217203	552450015	/nfs/dbraw/zinc/45/00/15/552450015.db2.gz	DEGAKNSWVGKMLS-UHFFFAOYSA-N	-2	2	622.539	1.608	50	10	world	KDCALL
CC1=NC(=NNc2ccc(S(=O)(=O)[O-])cc2S(=O)(=O)[O-])C(CO[P@](=O)([O-])O)=C(C=O)C1=O	ZINC000100001914	554177497	/nfs/dbraw/zinc/17/74/97/554177497.db2.gz	PNFZSRRRZNXSMF-WUKNDPDISA-N	-3	2	511.383	1.426	50	10	in-vitro	KDCALL
CC1=NC(=NNc2ccc(S(=O)(=O)[O-])cc2S(=O)(=O)[O-])C(CO[P@@](=O)([O-])O)=C(C=O)C1=O	ZINC000100001914	554177495	/nfs/dbraw/zinc/17/74/95/554177495.db2.gz	PNFZSRRRZNXSMF-WUKNDPDISA-N	-3	2	511.383	1.426	50	10	in-vitro	KDCALL