smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=c1ccc2c(cc(O)c(O)c2-c2c([O-])c(O)cc3ccc(=O)oc32)o1	ZINC000014559664	291054931	/nfs/dbraw/zinc/05/49/31/291054931.db2.gz	MCLQXBHUUFURBK-UHFFFAOYSA-N	-1	1	354.270	2.389	1	10	biogenic,in-vitro	FECFMM
CCOc1cc(N(CC)CC)ccc1C=C1C(=O)N(c2nn[n-]n2)N=C1C	ZINC000029135578	204896036	/nfs/dbraw/zinc/89/60/36/204896036.db2.gz	POUPBRUMWZTQIQ-GDNBJRDFSA-N	-1	1	369.429	2.251	1	10		FECFMM
O=c1[n-]nc(Sc2ncc([N+](=O)[O-])s2)n1-c1ccc(F)c(F)c1	ZINC000040395226	208251485	/nfs/dbraw/zinc/25/14/85/208251485.db2.gz	CLMZDOUZGJYFRO-UHFFFAOYSA-N	-1	1	357.323	2.355	1	10		FECFMM