smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[C@H]([NH2+]C1CCCCC1)c1ccc2ccccc2c1[O-]	ZINC000019878977	170907349	/nfs/dbraw/zinc/90/73/49/170907349.db2.gz	OMVQSZVYJAHSIY-ZDUSSCGKSA-N	0	1	269.388	4.529	20	10		CJCDMN
C[C@@H]([NH2+]Cc1cc(Cl)ccc1[O-])c1ccccc1Cl	ZINC000020124086	171005291	/nfs/dbraw/zinc/00/52/91/171005291.db2.gz	PXEIVQLWJNYEBB-SNVBAGLBSA-N	0	1	296.197	4.550	20	10		CJCDMN
C[C@H]([NH2+]Cc1cc(Cl)ccc1[O-])c1ccccc1Cl	ZINC000020124087	171005862	/nfs/dbraw/zinc/00/58/62/171005862.db2.gz	PXEIVQLWJNYEBB-JTQLQIEISA-N	0	1	296.197	4.550	20	10		CJCDMN
C[C@@H]([NH2+]Cc1cc(Cl)ccc1[O-])c1cccc(Cl)c1	ZINC000020124276	171006524	/nfs/dbraw/zinc/00/65/24/171006524.db2.gz	AZKHOSSLDBIWNO-SNVBAGLBSA-N	0	1	296.197	4.550	20	10		CJCDMN
CCc1cccc(NCc2cc(Cl)cc(Cl)c2O)c1	ZINC000021060549	171296952	/nfs/dbraw/zinc/29/69/52/171296952.db2.gz	GXPSCIKNNOPMIK-UHFFFAOYSA-N	0	1	296.197	4.874	20	10		CJCDMN
Cc1cc(C)cc(NCc2cc(Cl)cc(Cl)c2O)c1	ZINC000021805820	171327540	/nfs/dbraw/zinc/32/75/40/171327540.db2.gz	GICVQAVZHQPJCC-UHFFFAOYSA-N	0	1	296.197	4.928	20	10		CJCDMN
C[C@H]([NH2+]CCCC(F)(F)F)c1ccc2ccccc2c1[O-]	ZINC000130317026	525329815	/nfs/dbraw/zinc/32/98/15/525329815.db2.gz	FLNBUSCYFTZAPO-NSHDSACASA-N	0	1	297.320	4.539	20	10		CJCDMN
C[C@@H]([NH2+]CCCC(F)(F)F)c1ccc2ccccc2c1[O-]	ZINC000130317228	525432577	/nfs/dbraw/zinc/43/25/77/525432577.db2.gz	FLNBUSCYFTZAPO-LLVKDONJSA-N	0	1	297.320	4.539	20	10		CJCDMN