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-])c1cc2ccccc2cc1O	71256626	171106744	/nfs/dbraw/zinc/10/67/44/171106744.db2.gz	MUELWRJOJXBHPA-UHFFFAOYSA-N	0	2	189.170	2.454	40	5		AEBBLN
O=[N+]([O-])Cc1cccc(Cl)c1	84915862	171131451	/nfs/dbraw/zinc/13/14/51/171131451.db2.gz	HBDVLCNYKBOPPO-UHFFFAOYSA-N	0	2	171.583	2.117	40	5		AEBBLN
O=[N+]([O-])Cc1ccccc1Cl	113525340	171154303	/nfs/dbraw/zinc/15/43/03/171154303.db2.gz	VDEXMYMRDWWWAE-UHFFFAOYSA-N	0	2	171.583	2.117	40	5		AEBBLN
CC(C)c1ccc([N+](=O)[O-])c(O)c1	34224531	343114122	/nfs/dbraw/zinc/11/41/22/343114122.db2.gz	QJJGPZTVVISLNI-UHFFFAOYSA-N	0	2	181.191	2.424	40	5		AEBBLN
Cc1c(Cl)ccc(O)c1[N+](=O)[O-]	38611070	343189771	/nfs/dbraw/zinc/18/97/71/343189771.db2.gz	CPLAVZOCFVGOGO-UHFFFAOYSA-N	0	2	187.582	2.262	40	5		AEBBLN