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-])c1ccc(Sc2cccc([O-])c2)cc1	ZINC000130426311	187395485	/nfs/dbraw/zinc/39/54/85/187395485.db2.gz	IAWUPSXNWVTVOF-UHFFFAOYSA-N	-1	3	247.275	3.452	20	5		BGBDHM
O=[N+]([O-])c1ccccc1Sc1cccc([O-])c1	ZINC000131667563	388349850	/nfs/dbraw/zinc/34/98/50/388349850.db2.gz	XPWFTNMRUNJHHG-UHFFFAOYSA-N	-1	3	247.275	3.452	20	5		BGBDHM
CC[C@@H](C)CO[N-]c1c(F)cccc1[N+](=O)[O-]	ZINC000813621858	586604716	/nfs/dbraw/zinc/60/47/16/586604716.db2.gz	HWQZSCIAJLNXLK-MRVPVSSYSA-N	-1	3	242.250	3.124	20	5		BGBDHM
CC[C@H](C)CO[N-]c1c(F)cccc1[N+](=O)[O-]	ZINC000813621859	586604734	/nfs/dbraw/zinc/60/47/34/586604734.db2.gz	HWQZSCIAJLNXLK-QMMMGPOBSA-N	-1	3	242.250	3.124	20	5		BGBDHM