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)=CCOc1c(C)cc2oc3ccc(CC=C(C)C)c(=O)c-3c([O-])c2c1CO	ZINC000013328039	291285326	/nfs/dbraw/zinc/28/53/26/291285326.db2.gz	MDBQNLFOBADTEY-UHFFFAOYSA-N	-1	3	408.494	5.306	1	5	biogenic,in-vitro	HKBFHM
CC(C)=CCOc1c(C)cc2oc3ccc(CC=C(C)C)c([O-])c3c(=O)c2c1CO	ZINC000013328039	291285330	/nfs/dbraw/zinc/28/53/30/291285330.db2.gz	MDBQNLFOBADTEY-UHFFFAOYSA-N	-1	3	408.494	5.306	1	5	biogenic,in-vitro	HKBFHM
COc1cc(CC=C(C)C)c2c([O-])c3c(=O)cc(OC)c(CC=C(C)C)c-3oc2c1O	ZINC000014727620	571722714	/nfs/dbraw/zinc/72/27/14/571722714.db2.gz	ZAAAUPCCIDWPPI-UHFFFAOYSA-N	-1	3	424.493	5.392	1	5	endogenous,in-man	HKBFHM
CC(C)=CCOc1c(C)cc2oc3c(CC=C(C)C)ccc(=O)c-3c([O-])c2c1CO	ZINC000014827610	560226984	/nfs/dbraw/zinc/22/69/84/560226984.db2.gz	JZHBEPYIKRDWBE-UHFFFAOYSA-N	-1	3	408.494	5.306	1	5	in-vitro	HKBFHM
CC(C)=CCOc1c(C)cc2oc3c(CC=C(C)C)ccc([O-])c3c(=O)c2c1CO	ZINC000014827610	560226985	/nfs/dbraw/zinc/22/69/85/560226985.db2.gz	JZHBEPYIKRDWBE-UHFFFAOYSA-N	-1	3	408.494	5.306	1	5	in-vitro	HKBFHM