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/CCCCC(P(=O)([O-])O)[P@@](=O)([O-])O	ZINC000013742035	560220278	/nfs/dbraw/zinc/22/02/78/560220278.db2.gz	JCYZSGYSCXRCHX-UKTHLTGXSA-N	-2	2	354.320	3.921	1	0	in-vitro	FHAFLL
CC(C)=CCC/C(C)=C/CCCCC(P(=O)([O-])O)[P@](=O)([O-])O	ZINC000013742035	560220279	/nfs/dbraw/zinc/22/02/79/560220279.db2.gz	JCYZSGYSCXRCHX-UKTHLTGXSA-N	-2	2	354.320	3.921	1	0	in-vitro	FHAFLL
CC1(C)C=Cc2c(O)c3c(cc2O1)occ(-c1ccc(O)c(C=O)c1)c3=O	ZINC000014692068	291075605	/nfs/dbraw/zinc/07/56/05/291075605.db2.gz	IPYCUHYELBKADC-UHFFFAOYSA-N	-2	2	364.353	3.868	1	0	biogenic,in-vitro	FHAFLL
CC1(C)C=Cc2c(O)c3c(=O)cc(-c4ccc(O)cc4O)oc3cc2O1	ZINC000013414436	210181500	/nfs/dbraw/zinc/18/15/00/210181500.db2.gz	LXEJWVDCRDILQQ-UHFFFAOYSA-N	-2	2	352.342	3.761	1	0	endogenous,in-man	FHAFLL
CC1(C)C=Cc2cc(-c3cc(=O)c4c(O)cc(O)cc4o3)cc(O)c2O1	ZINC000015119492	291075594	/nfs/dbraw/zinc/07/55/94/291075594.db2.gz	FIKLOAGOJKGOFT-UHFFFAOYSA-N	-2	2	352.342	3.761	1	0	biogenic,in-vitro	FHAFLL