smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCCCCCCC(=O)C(=O)c1ccc([O-])cc1[O-]	ZINC000001563305	567837888	/nfs/dbraw/zinc/83/78/88/567837888.db2.gz	WDIFCFDQBXPIKJ-UHFFFAOYSA-N	-2	3	278.348	3.600	40	30		CHEBHL
Cc1cc([O-])c(/N=C/c2cccc(F)c2[O-])cc1C	ZINC000000225297	567822359	/nfs/dbraw/zinc/82/23/59/567822359.db2.gz	OORWBADILQSRCW-CAOOACKPSA-N	-2	3	259.280	3.604	40	30		CHEBHL
O=C([O-])c1ccccc1/N=C/c1ccc2ccccc2c1[O-]	ZINC000409181404	567934895	/nfs/dbraw/zinc/93/48/95/567934895.db2.gz	CLXJOAOIXQZEJD-YBFXNURJSA-N	-2	3	291.306	3.994	40	30		CHEBHL
CCCCCCCCC(=O)C(=O)c1ccc([O-])c(C)c1[O-]	ZINC000001563300	567837935	/nfs/dbraw/zinc/83/79/35/567837935.db2.gz	QPLSRDRSRNSAOY-UHFFFAOYSA-N	-2	3	292.375	3.909	40	30		CHEBHL
O=C([O-])c1ccc(N=Cc2ccc3ccccc3c2[O-])cc1	ZINC000260840642	328073703	/nfs/dbraw/zinc/07/37/03/328073703.db2.gz	QPXXXUZIWYCYNN-UHFFFAOYSA-N	-2	3	291.306	3.994	40	30		CHEBHL
CCCCCCCC(=O)C(=O)c1ccc([O-])c(C)c1[O-]	ZINC000001563299	567837990	/nfs/dbraw/zinc/83/79/90/567837990.db2.gz	XMLTVZQCKWAKOX-UHFFFAOYSA-N	-2	3	278.348	3.519	40	30		CHEBHL
O=C([O-])c1ccc(/N=C/c2ccc3ccccc3c2[O-])cc1	ZINC000032101638	171697144	/nfs/dbraw/zinc/69/71/44/171697144.db2.gz	QPXXXUZIWYCYNN-YBFXNURJSA-N	-2	3	291.306	3.994	40	30		CHEBHL
CCCCCCCCCC(=O)C(=O)c1ccc([O-])cc1[O-]	ZINC000001563296	567837963	/nfs/dbraw/zinc/83/79/63/567837963.db2.gz	KHYIFVRHOKNANE-UHFFFAOYSA-N	-2	3	292.375	3.990	40	30		CHEBHL
O=C([O-])c1ccc(/N=C\c2c([O-])ccc3ccccc32)cc1	ZINC000013124361	567941355	/nfs/dbraw/zinc/94/13/55/567941355.db2.gz	VZEJBHQYZBEMMM-ODLFYWEKSA-N	-2	3	291.306	3.994	40	30		CHEBHL
O=C([O-])c1ccc(/N=C\c2ccc3ccccc3c2[O-])cc1	ZINC000100248505	230391681	/nfs/dbraw/zinc/39/16/81/230391681.db2.gz	QPXXXUZIWYCYNN-ODLFYWEKSA-N	-2	3	291.306	3.994	40	30		CHEBHL