smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC[N+](C)(C)C[C@H](Br)[C@H](C)Br	ZINC000003164417	717095755	/nfs/dbraw/zinc/09/57/55/717095755.db2.gz	YXIPKWBUPAZNIX-YUMQZZPRSA-N	1	0	288.047	2.630	40	50		CFGBRO
CC[N+](C)(C)C[C@@H](Br)[C@@H](C)Br	ZINC000000028135	717087738	/nfs/dbraw/zinc/08/77/38/717087738.db2.gz	YXIPKWBUPAZNIX-HTQZYQBOSA-N	1	0	288.047	2.630	40	50		CFGBRO
CC[N+](C)(C)C[C@@H](Br)[C@H](C)Br	ZINC000003164418	717095205	/nfs/dbraw/zinc/09/52/05/717095205.db2.gz	YXIPKWBUPAZNIX-JGVFFNPUSA-N	1	0	288.047	2.630	40	50		CFGBRO
CC[N+](C)(C)C[C@H](Br)[C@@H](C)Br	ZINC000003164415	717095148	/nfs/dbraw/zinc/09/51/48/717095148.db2.gz	YXIPKWBUPAZNIX-SFYZADRCSA-N	1	0	288.047	2.630	40	50		CFGBRO
ClCC[N+](CCCl)(CCCl)CCCl	ZINC000002165519	717094251	/nfs/dbraw/zinc/09/42/51/717094251.db2.gz	NHGLISYPORTNHN-UHFFFAOYSA-N	1	0	268.035	2.758	40	50		CFGBRO
C[N+](C)(CC#Cc1ccccc1)CCBr	ZINC000000330679	717087794	/nfs/dbraw/zinc/08/77/94/717087794.db2.gz	PJSDSVRPRMPWCL-UHFFFAOYSA-N	1	0	267.190	2.509	40	50		CFGBRO