smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1ccc(COc2ccc([N+](=O)[O-])cc2C=C2SC(=O)[N-]C2=S)cc1	ZINC000001447474	209327722	/nfs/dbraw/zinc/32/77/22/209327722.db2.gz	GNAQIMZLQDJUOW-CXUHLZMHSA-N	-1	1	386.454	4.607	10	10		GJCEMM
Cc1ccccc1Sc1ccc(C=C2SC(=S)[N-]C2=O)cc1[N+](=O)[O-]	ZINC000254286810	209043556	/nfs/dbraw/zinc/04/35/56/209043556.db2.gz	SHKDXDWJERWCHI-OQLLNIDSSA-N	-1	1	388.495	4.543	10	10	in-vitro	GJCEMM
Cc1cc[nH+]c(N[C@H](c2ccncc2)c2cc(Cl)c3cccnc3c2O)c1	ZINC000045944569	212119594	/nfs/dbraw/zinc/11/95/94/212119594.db2.gz	OKFNGUUHEGVVEI-LJQANCHMSA-N	-1	1	376.847	4.894	10	10		GJCEMM
[O-]c1cccc([C@@H](Nc2ccccn2)c2ccc3cccnc3c2O)c1Cl	ZINC000002502843	570289000	/nfs/dbraw/zinc/28/90/00/570289000.db2.gz	KITWISGNBVVYDE-HXUWFJFHSA-N	-1	1	377.831	4.896	10	10	aggregator	GJCEMM