smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=[N+]([O-])c1cc(Cl)ccc1Sc1n[n-]c(C(F)(F)F)n1	ZINC000078406550	1019500193	/nfs/dbraw/zinc/50/01/93/1019500193.db2.gz	MGZHMLVRSTYNOO-UHFFFAOYSA-N	-1	1	324.671	3.536	40	5		DHBBMM
O=[N+]([O-])c1ccc(Sc2n[n-]c(C(F)(F)F)n2)c(Cl)c1	ZINC000078406586	563927974	/nfs/dbraw/zinc/92/79/74/563927974.db2.gz	VLLYVSWHRZZLGH-UHFFFAOYSA-N	-1	1	324.671	3.536	40	5		DHBBMM
CCOc1cc(/C=C/c2onc(C)c2[N+](=O)[O-])cc(Cl)c1[O-]	ZINC000408544443	257230143	/nfs/dbraw/zinc/23/01/43/257230143.db2.gz	TWULIPIRBLPHQB-SNAWJCMRSA-N	-1	1	324.720	3.819	40	5		DHBBMM
O=[N+]([O-])c1cccc(Cl)c1Sc1n[n-]c(C(F)(F)F)n1	ZINC000078406531	563927888	/nfs/dbraw/zinc/92/78/88/563927888.db2.gz	SQBAMEXKODMLNO-UHFFFAOYSA-N	-1	1	324.671	3.536	40	5		DHBBMM