smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1ccc(-c2ccc(CCC(=O)[O-])n2CC(=O)[O-])cc1	ZINC000000094774	371528519	/nfs/dbraw/zinc/52/85/19/371528519.db2.gz	PCXIOEHMINECRC-UHFFFAOYSA-N	-2	0	287.315	2.565	50	10		CFCARL
Cc1oc(C(=O)[O-])cc1COc1ccccc1C(=O)[O-]	ZINC000005576854	170115375	/nfs/dbraw/zinc/11/53/75/170115375.db2.gz	YGZPFIUYRCBQJM-UHFFFAOYSA-N	-2	0	276.244	2.563	50	10		CFCARL
O=C1C=C([O-])C=CC1=NNc1ccc(S(=O)(=O)[O-])cc1	ZINC000003882219	371823037	/nfs/dbraw/zinc/82/30/37/371823037.db2.gz	MHKGJUOEEHNBLE-BUHFOSPRSA-N	-2	0	294.288	2.760	50	10	endogenous,in-man	CFCARL
O=C([O-])CCc1ccc(-c2ccccc2)n1CCC(=O)[O-]	ZINC000000559573	304063997	/nfs/dbraw/zinc/06/39/97/304063997.db2.gz	XUQIGGJYCFCTGT-UHFFFAOYSA-N	-2	0	287.315	2.647	50	10		CFCARL
Cc1oc(C(=O)[O-])cc1COc1ccc(C(=O)[O-])cc1	ZINC000005576850	170115295	/nfs/dbraw/zinc/11/52/95/170115295.db2.gz	MDDPOPOENGKBMI-UHFFFAOYSA-N	-2	0	276.244	2.563	50	10		CFCARL
O=C1C=C([O-])C=CC1=NNc1ccc(S(=O)(=O)[O-])cc1	ZINC000012405050	371960845	/nfs/dbraw/zinc/96/08/45/371960845.db2.gz	MHKGJUOEEHNBLE-UHFFFAOYSA-N	-2	0	294.288	2.760	50	10	endogenous,in-man	CFCARL
O=C([O-])CCc1ccc(-c2cccs2)n1CCC(=O)[O-]	ZINC000000559613	169668253	/nfs/dbraw/zinc/66/82/53/169668253.db2.gz	HHCVDGZCCRFXOU-UHFFFAOYSA-N	-2	0	293.344	2.709	50	10		CFCARL