smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
N#CC(=Cc1ccc(C(=O)[O-])cc1)c1nc2ccc(Br)cc2c(=O)[nH]1	ZINC000025582478	957162231	/nfs/dbraw/zinc/16/22/31/957162231.db2.gz	WHCOYLNLZMTGAA-KPKJPENVSA-N	-1	0	396.200	3.448	40	50		GGGBRM
CCOc1ccc(NC(=O)/C(C#N)=C\c2ccc(O[C@H](C)C(=O)[O-])cc2)cc1	ZINC000059678576	957563115	/nfs/dbraw/zinc/56/31/15/957563115.db2.gz	UOLAQYQHIQBCBB-IZCBMXNHSA-N	-1	0	380.400	3.483	40	50		GGGBRM
COc1cc(/C=C(/C#N)C(=O)NC(C)C)ccc1OCc1ccc(C(=O)[O-])cc1	ZINC000034737097	957192729	/nfs/dbraw/zinc/19/27/29/957192729.db2.gz	XDCLXSUXUHMIEB-ZDLGFXPLSA-N	-1	0	394.427	3.404	40	50		GGGBRM
CCOc1ccc(NC(=O)/C(C#N)=C\c2ccc(O[C@@H](C)C(=O)[O-])cc2)cc1	ZINC000059678575	957563904	/nfs/dbraw/zinc/56/39/04/957563904.db2.gz	UOLAQYQHIQBCBB-QXPQOBGOSA-N	-1	0	380.400	3.483	40	50		GGGBRM