smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)=CCC/C(C)=C/Cc1c([O-])cc([O-])c2c(=O)cc(-c3ccccc3)oc12	ZINC000005854064	204154599	/nfs/dbraw/zinc/15/45/99/204154599.db2.gz	LUWBCNVXYBOLTM-SFQUDFHCSA-N	-2	3	390.479	6.106	10	0	in-vitro	GKAEHL
O=C(c1ccc([O-])cc1Cc1ccccc1)c1ccc([O-])cc1Cc1ccccc1	ZINC000095079464	211219164	/nfs/dbraw/zinc/21/91/64/211219164.db2.gz	SVCSWJCWCJWDMQ-UHFFFAOYSA-N	-2	3	394.470	5.510	10	0		GKAEHL
CC(C)=CCc1c([O-])c(CC=C(C)C)c2oc(-c3ccccc3)cc(=O)c2c1[O-]	ZINC000000967864	209284741	/nfs/dbraw/zinc/28/47/41/209284741.db2.gz	RGGJEENSFLRVRP-UHFFFAOYSA-N	-2	3	390.479	5.889	10	0	in-vitro	GKAEHL
CC(C)=CCC/C(C)=C/Cc1c([O-])cc2oc(-c3ccccc3)cc(=O)c2c1[O-]	ZINC000001532297	560181704	/nfs/dbraw/zinc/18/17/04/560181704.db2.gz	ZGOCQRKXVIGZMZ-SFQUDFHCSA-N	-2	3	390.479	6.106	10	0	in-vitro	GKAEHL
CC(C)=CCc1c([O-])c(C(=O)C(C)C)c([O-])c2c(-c3ccccc3)cc(=O)oc12	ZINC000005359229	560201415	/nfs/dbraw/zinc/20/14/15/560201415.db2.gz	IWUNXYBEJCJQHB-UHFFFAOYSA-N	-2	3	392.451	5.219	10	0	biogenic,in-vitro	GKAEHL