smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CN(C)[C@@H]1C(=O)C(C(N)=O)=C([O-])[C@@]2(O)C(=O)C3=C([O-])c4c(O)cccc4[C@H](O)[C@H]3[C@H](O)[C@@H]12	ZINC000071789627	522033845	/nfs/dbraw/zinc/03/38/45/522033845.db2.gz	HFGJDTOOQKHXKS-NWIXSBDRSA-N	-2	3	446.412	-1.418	10	30		IAEEHL
CN(C)[C@@H]1C(=O)C(C(N)=O)=C([O-])[C@@]2(O)C(=O)C3=C([O-])c4c(O)cccc4[C@H](O)[C@H]3[C@H](O)[C@H]12	ZINC000071789629	522034437	/nfs/dbraw/zinc/03/44/37/522034437.db2.gz	HFGJDTOOQKHXKS-GVLOLPRISA-N	-2	3	446.412	-1.418	10	30		IAEEHL
CN(C)[C@@H]1C(=O)C(C(N)=O)=C([O-])[C@@]2(O)C(=O)C3=C([O-])c4c(O)cccc4[C@H](O)[C@@H]3[C@H](O)[C@@H]12	ZINC000071789630	522032804	/nfs/dbraw/zinc/03/28/04/522032804.db2.gz	HFGJDTOOQKHXKS-GFVCRYCESA-N	-2	3	446.412	-1.418	10	30		IAEEHL
CN(C)[C@@H]1C(=O)C(C(N)=O)=C([O-])[C@@]2(O)C(=O)C3=C([O-])c4c(O)cccc4[C@H](O)[C@@H]3[C@H](O)[C@H]12	ZINC000071789631	522033636	/nfs/dbraw/zinc/03/36/36/522033636.db2.gz	HFGJDTOOQKHXKS-ONILDFRDSA-N	-2	3	446.412	-1.418	10	30		IAEEHL