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=C/C1=C(C)CCCC1(C)C)=C\C=C(C(=O)[O-])/C(C)=C\C(=O)[O-]	ZINC000005497332	563535432	/nfs/dbraw/zinc/53/54/32/563535432.db2.gz	BGOMUHYKLNJWPG-WPRRFWQKSA-N	-2	0	344.451	5.057	40	0		EKABRL
CC(/C=C/C1=C(C)CCCC1(C)C)=C/C=C(C(=O)[O-])\C(C)=C/C(=O)[O-]	ZINC000008614644	563633233	/nfs/dbraw/zinc/63/32/33/563633233.db2.gz	BGOMUHYKLNJWPG-POJZKHNRSA-N	-2	0	344.451	5.057	40	0		EKABRL
O=C([O-])CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)[O-]	ZINC000027645640	563898135	/nfs/dbraw/zinc/89/81/35/563898135.db2.gz	BGOJKUCHTMYINI-DTLRTWKJSA-N	-2	0	334.456	5.281	40	0	in-vitro	EKABRL
CC(/C=C\C1=C(C)CCCC1(C)C)=C/C=C(C(=O)[O-])\C(C)=C/C(=O)[O-]	ZINC000104331254	219375622	/nfs/dbraw/zinc/37/56/22/219375622.db2.gz	BGOMUHYKLNJWPG-OIBYOSSYSA-N	-2	0	344.451	5.057	40	0		EKABRL
CC(=C\C=C(C(=O)[O-])/C(C)=C\C(=O)[O-])/C=C\C1=C(C)CCCC1(C)C	ZINC000104331262	219375479	/nfs/dbraw/zinc/37/54/79/219375479.db2.gz	BGOMUHYKLNJWPG-YPUXCLGGSA-N	-2	0	344.451	5.057	40	0		EKABRL