smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1[nH+]c(C)c(C(=O)[O-])c(-c2cccc3ccccc32)c1C(=O)[O-]	ZINC000030847151	563438990	/nfs/dbraw/zinc/43/89/90/563438990.db2.gz	RLBKMEZFXODUAS-UHFFFAOYSA-N	-1	2	321.332	3.915	50	0		DHAALM
O=C(c1ccccc1)c1ccc(O)c(C(=O)c2ccccc2)c1[O-]	ZINC000000397937	180776907	/nfs/dbraw/zinc/77/69/07/180776907.db2.gz	KOKLAVMEUFYRKV-UHFFFAOYSA-N	-1	2	318.328	3.560	50	0		DHAALM
O=C([O-])C(CC=C1c2ccccc2C=Cc2ccccc21)C(=O)O	ZINC000000393000	563249881	/nfs/dbraw/zinc/24/98/81/563249881.db2.gz	BMGGFNJAXLPMGF-UHFFFAOYSA-N	-1	2	320.344	3.778	50	0		DHAALM
O=C([O-])c1cccc(OCc2cccc(Br)c2)c1	ZINC000013419082	181848682	/nfs/dbraw/zinc/84/86/82/181848682.db2.gz	MFCMIELTDWJUDR-UHFFFAOYSA-N	-1	2	307.143	3.726	50	0		DHAALM
O=C(C=C([O-])c1ccc(Cl)cc1)C=C(O)c1ccccc1	ZINC000100629252	563552455	/nfs/dbraw/zinc/55/24/55/563552455.db2.gz	HHIALBZHOOYCLT-UHFFFAOYSA-N	-1	2	300.741	3.755	50	0		DHAALM
O=C(C=C([O-])c1ccccc1)C=C(O)c1ccc(Cl)cc1	ZINC000100629252	563552458	/nfs/dbraw/zinc/55/24/58/563552458.db2.gz	HHIALBZHOOYCLT-UHFFFAOYSA-N	-1	2	300.741	3.755	50	0		DHAALM
Cc1[nH+]c(C(C)C)c(C(=O)[O-])c(-c2ccc(F)cc2)c1C(=O)[O-]	ZINC000044126299	183395893	/nfs/dbraw/zinc/39/58/93/183395893.db2.gz	LIGQPKDDFUGMIV-UHFFFAOYSA-N	-1	2	317.316	3.716	50	0		DHAALM