smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCC/C(=C(\C(=O)[O-])c1ccccc1)c1ccccc1C(=O)[O-]	ZINC000001736756	563294672	/nfs/dbraw/zinc/29/46/72/563294672.db2.gz	ZKDDTNQBWNROLU-FBMGVBCBSA-N	-2	0	324.376	4.570	40	0		DJABRL
CC(C)=CCC/C(C)=C/CC/C(C)=C/COP(=O)([O-])[O-]	ZINC000002556391	563924905	/nfs/dbraw/zinc/92/49/05/563924905.db2.gz	ALEWCKXBHSDCCT-YFVJMOTDSA-N	-2	0	302.351	4.515	40	0	in-vitro	DJABRL
CCCC/C(=C(/C(=O)[O-])c1ccccc1)c1ccccc1C(=O)[O-]	ZINC000001736754	563294663	/nfs/dbraw/zinc/29/46/63/563294663.db2.gz	ZKDDTNQBWNROLU-VLGSPTGOSA-N	-2	0	324.376	4.570	40	0		DJABRL
O=C([O-])CCCCCCCC#CCCCCCCCC(=O)[O-]	ZINC000004789573	563328120	/nfs/dbraw/zinc/32/81/20/563328120.db2.gz	GVDDUHNYNBHUMG-UHFFFAOYSA-N	-2	0	310.434	4.620	40	0		DJABRL