smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C([O-])CCCc1c(C(=O)[O-])[nH]c2cc(Cl)cc(Cl)c21	ZINC000013490385	181855400	/nfs/dbraw/zinc/85/54/00/181855400.db2.gz	MXCLNMLWTQWHFP-UHFFFAOYSA-N	-2	0	316.140	3.580	1	0		DHAFRL
CCCCCC(=O)c1c([O-])oc(=O)c(C(=O)CCCCC)c1[O-]	ZINC000169321095	197740890	/nfs/dbraw/zinc/74/08/90/197740890.db2.gz	NMSJEOMORIBFDZ-UHFFFAOYSA-N	-2	0	324.373	3.577	1	0		DHAFRL
O=C([O-])c1cccc(OCCCC2CCCCC2)c1C(=O)[O-]	ZINC000096911030	185390985	/nfs/dbraw/zinc/39/09/85/185390985.db2.gz	HNUDOOSRJQQHBM-UHFFFAOYSA-N	-2	0	306.358	3.822	1	0		DHAFRL
O=C([O-])CC1=C/C(=C\c2ccc(C(=O)[O-])cc2)c2ccc(F)cc21	ZINC000040845075	183141083	/nfs/dbraw/zinc/14/10/83/183141083.db2.gz	ZKMYIZMNTQPMDC-NTUHNPAUSA-N	-2	0	324.307	3.936	1	0		DHAFRL
O=C([O-])CCc1ccc(Oc2ccc(CCC(=O)[O-])cc2)cc1	ZINC000014620416	181961885	/nfs/dbraw/zinc/96/18/85/181961885.db2.gz	UKCHMOVWJBXLBX-UHFFFAOYSA-N	-2	0	314.337	3.513	1	0		DHAFRL
O=C([O-])c1cc(C(=O)[O-])cc(C23CC4CC(CC(C4)C2)C3)c1	ZINC000004592840	181128171	/nfs/dbraw/zinc/12/81/71/181128171.db2.gz	JZDIDJAWBZXAFK-UHFFFAOYSA-N	-2	0	300.354	3.551	1	0		DHAFRL