smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
N#Cc1c([S-])cc(C(=O)[O-])cc1C(F)(F)F	ZINC000396143598	344617066	/nfs/dbraw/zinc/61/70/66/344617066.db2.gz	MRSUUJALBJPOCV-UHFFFAOYSA-N	-2	0	247.197	2.564	10	30		BFEERL
CCCCCCCC[C@@H](CC(=O)[O-])C(=O)[O-]	ZINC000002510057	346163228	/nfs/dbraw/zinc/16/32/28/346163228.db2.gz	FPOGSOBFOIGXPR-JTQLQIEISA-N	-2	0	230.304	2.913	10	30		BFEERL
CCCCCCCCCC(C(=O)[O-])C(=O)[O-]	ZINC000002170162	346496889	/nfs/dbraw/zinc/49/68/89/346496889.db2.gz	FWQNYUYRXNWOOM-UHFFFAOYSA-N	-2	0	230.304	2.913	10	30		BFEERL
N#Cc1cc([S-])c(C(=O)[O-])cc1C(F)(F)F	ZINC000396146307	344619648	/nfs/dbraw/zinc/61/96/48/344619648.db2.gz	VVIOEYDZIUZFRF-UHFFFAOYSA-N	-2	0	247.197	2.564	10	30		BFEERL
CCCCCC/C=C/[C@@H](CC(=O)[O-])C(=O)[O-]	ZINC000002568354	322811396	/nfs/dbraw/zinc/81/13/96/322811396.db2.gz	KCYQMQGPYWZZNJ-JARNTUPDSA-N	-2	0	228.288	2.689	10	30		BFEERL
CCCCCCCCCOP(=O)([O-])[O-]	ZINC000002560060	342724224	/nfs/dbraw/zinc/72/42/24/342724224.db2.gz	WYAKJXQRALMWPB-UHFFFAOYSA-N	-2	0	224.237	2.846	10	30		BFEERL
N#Cc1c(C(=O)[O-])cc([S-])cc1C(F)(F)F	ZINC000396144957	344618405	/nfs/dbraw/zinc/61/84/05/344618405.db2.gz	RFTQPKFJFWAJFT-UHFFFAOYSA-N	-2	0	247.197	2.564	10	30		BFEERL
N#Cc1c([S-])ccc(C(F)(F)F)c1C(=O)[O-]	ZINC000396143676	344617079	/nfs/dbraw/zinc/61/70/79/344617079.db2.gz	NIPGOYXZSAMIJJ-UHFFFAOYSA-N	-2	0	247.197	2.564	10	30		BFEERL
N#Cc1c([S-])cc(C(F)(F)F)cc1C(=O)[O-]	ZINC000396143685	344617146	/nfs/dbraw/zinc/61/71/46/344617146.db2.gz	NMDHSGCIRMHGMO-UHFFFAOYSA-N	-2	0	247.197	2.564	10	30		BFEERL
N#Cc1ccc(C(=O)[O-])c([S-])c1C(F)(F)F	ZINC000396144993	344618138	/nfs/dbraw/zinc/61/81/38/344618138.db2.gz	RODUHRKOWQXVKY-UHFFFAOYSA-N	-2	0	247.197	2.564	10	30		BFEERL
N#Cc1ccc(C(=O)[O-])c(C(F)(F)F)c1[S-]	ZINC000396140809	344615611	/nfs/dbraw/zinc/61/56/11/344615611.db2.gz	BSOIIHPWGDKSFE-UHFFFAOYSA-N	-2	0	247.197	2.564	10	30		BFEERL
CCCCCC/C=C/[C@H](CC(=O)[O-])C(=O)[O-]	ZINC000100050289	384612828	/nfs/dbraw/zinc/61/28/28/384612828.db2.gz	KCYQMQGPYWZZNJ-QROSGCPLSA-N	-2	0	228.288	2.689	10	30		BFEERL
N#Cc1cc(C(F)(F)F)c(C(=O)[O-])cc1[S-]	ZINC000396141148	344615869	/nfs/dbraw/zinc/61/58/69/344615869.db2.gz	DEFHRKZKEFLAQE-UHFFFAOYSA-N	-2	0	247.197	2.564	10	30		BFEERL