smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Nc1ccccc1C(=O)NCC(=O)N[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@@H]1C(=O)[O-]	ZINC000028631580	556338160	/nfs/dbraw/zinc/33/81/60/556338160.db2.gz	ZCZHTWBKBLMIQM-RBUKOAKNSA-N	-1	0	483.481	0.710	10	5		JCBERM
Nc1ccccc1C(=O)NCC(=O)N[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@@H]1C(=O)[O-]	ZINC000028631584	556338262	/nfs/dbraw/zinc/33/82/62/556338262.db2.gz	ZCZHTWBKBLMIQM-RTBURBONSA-N	-1	0	483.481	0.710	10	5		JCBERM
Nc1ccccc1C(=O)NCC(=O)N[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@H]1C(=O)[O-]	ZINC000028631587	556338126	/nfs/dbraw/zinc/33/81/26/556338126.db2.gz	ZCZHTWBKBLMIQM-MOPGFXCFSA-N	-1	0	483.481	0.710	10	5		JCBERM
O=C([O-])CCC(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000071788473	569698367	/nfs/dbraw/zinc/69/83/67/569698367.db2.gz	BYWZKPJOMDSREE-SFHVURJKSA-N	-1	0	499.480	0.358	10	5		JCBERM