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](Oc1ccc2c(c1)oc(=O)c1cc([O-])ccc21)C1=CC=C[CH]1	ZINC001229798124	1053406333	/nfs/dbraw/zinc/40/63/33/1053406333.db2.gz	RRCBSOVNFWEGBM-GFCCVEGCSA-N	-2	0	319.336	4.120	20	5		DIBDRL
C[C@H](Oc1ccc2c(c1)oc1cc(O)ccc1c2=O)C1=CC=C[CH]1	ZINC001229519046	1053342674	/nfs/dbraw/zinc/34/26/74/1053342674.db2.gz	YGIVDJHTYWYAKY-LBPRGKRZSA-N	-2	0	319.336	4.120	20	5		DIBDRL
O=[N+]([O-])c1cc(Nc2c(Cl)ccc(O)c2Cl)ccc1[O-]	ZINC001210397945	1036679303	/nfs/dbraw/zinc/67/93/03/1036679303.db2.gz	JOSDHBJHDYXNOU-UHFFFAOYSA-N	-2	0	315.112	4.056	20	5		DIBDRL
O=[N+]([O-])c1cc(Nc2cc(Cl)cc(Cl)c2[O-])ccc1[O-]	ZINC001210401737	1050232851	/nfs/dbraw/zinc/23/28/51/1050232851.db2.gz	YOAZESQADUGFMT-UHFFFAOYSA-N	-2	0	315.112	4.056	20	5		DIBDRL
O=[N+]([O-])c1cc(Nc2ccc(Cl)c(Cl)c2[O-])ccc1[O-]	ZINC001210397812	1050233492	/nfs/dbraw/zinc/23/34/92/1050233492.db2.gz	IWOUWZUPSFJVMN-UHFFFAOYSA-N	-2	0	315.112	4.056	20	5		DIBDRL
O=c1[nH]c(-c2cc(O)cc(F)c2)nc2cc3ccccc3cc12	ZINC000515089323	1042807567	/nfs/dbraw/zinc/80/75/67/1042807567.db2.gz	DJBPYRCZHFOYJN-UHFFFAOYSA-N	-2	0	306.296	4.000	20	5		DIBDRL
C[C@@H](Oc1ccc2c(c1)oc1cc(O)ccc1c2=O)C1=CC=C[CH]1	ZINC001229519039	1053343107	/nfs/dbraw/zinc/34/31/07/1053343107.db2.gz	YGIVDJHTYWYAKY-GFCCVEGCSA-N	-2	0	319.336	4.120	20	5		DIBDRL
C[C@H](Oc1ccc2c(c1)oc(=O)c1cc([O-])ccc21)C1=CC=C[CH]1	ZINC001229798125	1053406800	/nfs/dbraw/zinc/40/68/00/1053406800.db2.gz	RRCBSOVNFWEGBM-LBPRGKRZSA-N	-2	0	319.336	4.120	20	5		DIBDRL
O=[N+]([O-])c1cc(Nc2cc(Cl)c([O-])cc2Cl)ccc1[O-]	ZINC001210400190	1050234283	/nfs/dbraw/zinc/23/42/83/1050234283.db2.gz	FCZYZVXHTMLVNN-UHFFFAOYSA-N	-2	0	315.112	4.056	20	5		DIBDRL