smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCc1ccc(CC(=O)[O-])c2ccc3c(C)ccc(C)c3c12	ZINC000001600745	567839445	/nfs/dbraw/zinc/83/94/45/567839445.db2.gz	XDSIMGPJHWJWKV-UHFFFAOYSA-N	-1	0	292.378	4.799	40	5		CJBBRM
O=C([O-])c1cc2c3ccccc3sc2c2ccccc12	ZINC000001607739	567839224	/nfs/dbraw/zinc/83/92/24/567839224.db2.gz	SYJUHUVLKNKMHZ-UHFFFAOYSA-N	-1	0	278.332	4.906	40	5		CJBBRM
Cc1ccc(CCCC(=O)[O-])c2ccc3ccccc3c12	ZINC000001661367	566996112	/nfs/dbraw/zinc/99/61/12/566996112.db2.gz	OPECTSSXLXTIME-UHFFFAOYSA-N	-1	0	278.351	4.709	40	5		CJBBRM
O=C([O-])Cc1cccc2cc3c(ccc4ccccc43)cc21	ZINC000001661374	567840473	/nfs/dbraw/zinc/84/04/73/567840473.db2.gz	YVOAZNOUAGAOMB-UHFFFAOYSA-N	-1	0	286.330	4.773	40	5		CJBBRM
O=C([O-])C[C@H]1CCCc2cc3c(ccc4ccccc43)cc21	ZINC000001676942	567840975	/nfs/dbraw/zinc/84/09/75/567840975.db2.gz	ZGXFGMPELSAHGR-OAHLLOKOSA-N	-1	0	290.362	4.888	40	5		CJBBRM
O=C([O-])c1cc(-c2ccccc2)nc2c3ccccc3ccc12	ZINC000001703597	567841990	/nfs/dbraw/zinc/84/19/90/567841990.db2.gz	DULGCYHBYNNEPB-UHFFFAOYSA-N	-1	0	299.329	4.753	40	5		CJBBRM
O=C([O-])C[C@@H]1CCCc2cc3c(ccc4ccccc43)cc21	ZINC000002045425	169771822	/nfs/dbraw/zinc/77/18/22/169771822.db2.gz	ZGXFGMPELSAHGR-HNNXBMFYSA-N	-1	0	290.362	4.888	40	5		CJBBRM
O=C([O-])/C=C/c1c2ccccc2c(Cl)c2ccccc12	ZINC000044201194	175153768	/nfs/dbraw/zinc/15/37/68/175153768.db2.gz	SQUSETPFBSFUSQ-MDZDMXLPSA-N	-1	0	282.726	4.744	40	5		CJBBRM