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(=O)[n-]c(-c2ccc(Br)cc2)cc1-c1ccccc1[O-]	ZINC000045284340	205119251	/nfs/dbraw/zinc/11/92/51/205119251.db2.gz	YVBASZTXTKDBIJ-UHFFFAOYSA-N	-2	3	367.202	4.049	1	30		FIEFHL
COc1c(CC=C(C)C)c([O-])cc([O-])c1C(=O)/C=C/c1ccc(O)cc1	ZINC000040895402	205084126	/nfs/dbraw/zinc/08/41/26/205084126.db2.gz	MFZJQZIWPCJMCW-YRNVUSSQSA-N	-2	3	354.402	4.217	1	30		FIEFHL
N#Cc1c(=O)[n-]c(-c2ccccc2[O-])cc1-c1ccccc1Br	ZINC000029546409	207992876	/nfs/dbraw/zinc/99/28/76/207992876.db2.gz	HNXOXMAJZOCRJC-UHFFFAOYSA-N	-2	3	367.202	4.049	1	30		FIEFHL
O=C([O-])CCC(=O)N([O-])c1cccc(OCc2ccc3ccccc3c2)c1	ZINC000029222793	207986346	/nfs/dbraw/zinc/98/63/46/207986346.db2.gz	VVTSJWXHSHLBFL-UHFFFAOYSA-N	-2	3	365.385	4.006	1	30		FIEFHL
C=C(C)[C@@H](C)c1cc(/C=C/C(=O)c2ccc([O-])cc2[O-])cc(OC)c1O	ZINC000098084875	222227684	/nfs/dbraw/zinc/22/76/84/222227684.db2.gz	JHZHFQPOLQIURR-OQHXTRMZSA-N	-2	3	354.402	4.388	1	30		FIEFHL
C=C(C)[C@H](C)c1cc(/C=C/C(=O)c2ccc([O-])cc2[O-])cc(OC)c1O	ZINC000098084876	222227748	/nfs/dbraw/zinc/22/77/48/222227748.db2.gz	JHZHFQPOLQIURR-LJLILKBBSA-N	-2	3	354.402	4.388	1	30		FIEFHL
C=C(C)[C@@H](C)c1cc(/C=C/C(=O)c2c([O-])cc(O)cc2[O-])cc(OC)c1O	ZINC000098084873	222227815	/nfs/dbraw/zinc/22/78/15/222227815.db2.gz	XDMNEUBJCSHYRB-BTDICHCPSA-N	-2	3	370.401	4.093	1	30		FIEFHL
CC([O-])=C1C(=O)N([O-])c2cc(NC(=O)C=Cc3ccccc3Cl)ccc21	ZINC000103238379	222327761	/nfs/dbraw/zinc/32/77/61/222327761.db2.gz	YXVRFMVYARDEDK-VELFRKFLSA-N	-2	3	370.792	4.017	1	30		FIEFHL
CCCCCCCCCCCCSC[C@@H](O)c1oc([O-])c(OC)c1[O-]	ZINC000100904990	222256333	/nfs/dbraw/zinc/25/63/33/222256333.db2.gz	UGXPATRMJVJXNQ-NVXWUHKLSA-N	-2	3	374.543	4.343	1	30		FIEFHL
CCCCCCCCCCCCSC[C@@H](O)c1oc([O-])c(OC)c1[O-]	ZINC000100904997	222256391	/nfs/dbraw/zinc/25/63/91/222256391.db2.gz	UGXPATRMJVJXNQ-WBVHZDCISA-N	-2	3	374.543	4.343	1	30		FIEFHL