smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC[C@H](NC(=O)c1ccc(O)cc1[O-])C(C)C	ZINC000218761745	385906939	/nfs/dbraw/zinc/90/69/39/385906939.db2.gz	HDBSYLDMIBLGPS-NSHDSACASA-N	-1	3	237.299	2.262	10	70		BEIEHM
C[C@@H]1CC[C@H](C(=O)Nc2cc(F)ccc2[O-])O1	ZINC000159874053	345579713	/nfs/dbraw/zinc/57/97/13/345579713.db2.gz	WKLMNMQXZFUHSE-RDDDGLTNSA-N	-1	3	239.246	2.037	10	70		BEIEHM
C[C@H]1CC[C@H](C(=O)Nc2cc(F)ccc2[O-])O1	ZINC000159874182	323051507	/nfs/dbraw/zinc/05/15/07/323051507.db2.gz	WKLMNMQXZFUHSE-WRWORJQWSA-N	-1	3	239.246	2.037	10	70		BEIEHM
CCn1ccc2c1cc(C(=O)OC)cc2[O-]	ZINC000218342254	351597524	/nfs/dbraw/zinc/59/75/24/351597524.db2.gz	GJLRBXBEKOUSJB-UHFFFAOYSA-N	-1	3	219.240	2.153	10	70		BEIEHM
C[C@H]1CC[C@@H](C(=O)Nc2cc(F)ccc2[O-])O1	ZINC000159874420	323051544	/nfs/dbraw/zinc/05/15/44/323051544.db2.gz	WKLMNMQXZFUHSE-CPCISQLKSA-N	-1	3	239.246	2.037	10	70		BEIEHM
C[C@@H]1CC[C@@H](C(=O)Nc2cc(F)ccc2[O-])O1	ZINC000159874301	323051459	/nfs/dbraw/zinc/05/14/59/323051459.db2.gz	WKLMNMQXZFUHSE-HQJQHLMTSA-N	-1	3	239.246	2.037	10	70		BEIEHM
O=C([N-]CCCCC1CC1)C(F)(F)F	ZINC000217464895	583178726	/nfs/dbraw/zinc/17/87/26/583178726.db2.gz	AOSXQHBKPFOYHE-UHFFFAOYSA-N	-1	3	209.211	2.245	10	70		BEIEHM
COc1ccc([C@H](C)[N-]C(=O)C(F)F)cc1F	ZINC000218692751	592173619	/nfs/dbraw/zinc/17/36/19/592173619.db2.gz	OBZCFLXXNVCLEU-LURJTMIESA-N	-1	3	247.216	2.277	10	70		BEIEHM
C[C@@H]([N-]C(=O)C(F)F)c1ccc(F)c(F)c1	ZINC000217637306	385889413	/nfs/dbraw/zinc/88/94/13/385889413.db2.gz	WNCXFALNSBKLGQ-RXMQYKEDSA-N	-1	3	235.180	2.407	10	70		BEIEHM
CC[C@@H](NC(=O)c1ccc(O)cc1[O-])C(C)C	ZINC000218761702	385906496	/nfs/dbraw/zinc/90/64/96/385906496.db2.gz	HDBSYLDMIBLGPS-LLVKDONJSA-N	-1	3	237.299	2.262	10	70		BEIEHM