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	522033834	/nfs/dbraw/zinc/03/38/34/522033834.db2.gz	HFGJDTOOQKHXKS-NWIXSBDRSA-N	-2	1	446.412	-1.418	10	30		IAEEML
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	522034425	/nfs/dbraw/zinc/03/44/25/522034425.db2.gz	HFGJDTOOQKHXKS-GVLOLPRISA-N	-2	1	446.412	-1.418	10	30		IAEEML
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	522032789	/nfs/dbraw/zinc/03/27/89/522032789.db2.gz	HFGJDTOOQKHXKS-GFVCRYCESA-N	-2	1	446.412	-1.418	10	30		IAEEML
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	522033626	/nfs/dbraw/zinc/03/36/26/522033626.db2.gz	HFGJDTOOQKHXKS-ONILDFRDSA-N	-2	1	446.412	-1.418	10	30		IAEEML