smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1c([O-])cc2c3c(cc4ccccc4c13)NC(=O)C2=O	ZINC000013385025	560216117	/nfs/dbraw/zinc/21/61/17/560216117.db2.gz	FPIKZASYTJSPJN-UHFFFAOYSA-N	-1	3	293.278	2.842	1	5	biogenic,in-vitro	CFBFHM
O=C1[N-]C(=O)[C@@H](c2c3ccccc3cc3ccccc32)N1	ZINC000073159919	176457333	/nfs/dbraw/zinc/45/73/33/176457333.db2.gz	CTJRNZMUMVUMDA-OAHLLOKOSA-N	-1	3	276.295	2.874	1	5		CFBFHM
CN(C)c1cccc(-c2nc3ccc([N+](=O)[O-])cc3n2[O-])c1	ZINC000028957227	171581830	/nfs/dbraw/zinc/58/18/30/171581830.db2.gz	STYKMJLGIKIXIB-UHFFFAOYSA-N	-1	3	298.302	2.915	1	5		CFBFHM
COc1ccc2oc3c([O-])c(OC)ccc3c(=O)c2c1	ZINC000014822064	290857335	/nfs/dbraw/zinc/85/73/35/290857335.db2.gz	MFXGHYSTFDEGTO-UHFFFAOYSA-N	-1	3	272.256	2.669	1	5	biogenic,in-vitro	CFBFHM
COc1cc(=O)c2c([O-])c3c(C)cccc3n(C)c-2c1	ZINC000006491438	170205937	/nfs/dbraw/zinc/20/59/37/170205937.db2.gz	YEYSAZDGERSVQW-UHFFFAOYSA-N	-1	3	269.300	2.714	1	5		CFBFHM
COc1cc([O-])c2c(=O)c3c(C)cccc3n(C)c2c1	ZINC000006491438	170205939	/nfs/dbraw/zinc/20/59/39/170205939.db2.gz	YEYSAZDGERSVQW-UHFFFAOYSA-N	-1	3	269.300	2.714	1	5		CFBFHM
COc1cc(=O)c2c([O-])c3cccc(C)c3[nH]c-2c1	ZINC000006491432	170206039	/nfs/dbraw/zinc/20/60/39/170206039.db2.gz	KIOGLALGCJHJDX-UHFFFAOYSA-N	-1	3	255.273	2.704	1	5		CFBFHM
COc1cc([O-])c2c(c1)[nH]c1c(C)cccc1c2=O	ZINC000006491432	170206040	/nfs/dbraw/zinc/20/60/40/170206040.db2.gz	KIOGLALGCJHJDX-UHFFFAOYSA-N	-1	3	255.273	2.704	1	5		CFBFHM
COc1cc2c3c(cc4c(O)cccc4c3c1[O-])NC2=O	ZINC000095910074	560059122	/nfs/dbraw/zinc/05/91/22/560059122.db2.gz	SKDMRFXMURMAQL-UHFFFAOYSA-N	-1	3	281.267	2.979	1	5	biogenic,in-vitro	CFBFHM
O=c1c2ccccc2oc2c([O-])ccc(Cn3ccnc3)c12	ZINC000095589185	185013514	/nfs/dbraw/zinc/01/35/14/185013514.db2.gz	PHSPPOUTJWWXDM-UHFFFAOYSA-N	-1	3	292.294	2.897	1	5		CFBFHM