smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1cccc2c1C(=O)c1c([O-])c(CCl)ccc1C2=O	ZINC000036430872	398553170	/nfs/dbraw/zinc/55/31/70/398553170.db2.gz	RLKMJFLQDDMUPF-UHFFFAOYSA-N	-1	1	302.713	2.915	10	50		DFGEMM
COc1ccc(Br)c([O-])c1C(=O)CBr	ZINC000033823409	398546512	/nfs/dbraw/zinc/54/65/12/398546512.db2.gz	BVFQOLCIMBLWSI-UHFFFAOYSA-N	-1	1	323.968	2.741	10	50		DFGEMM
N#C/C(=C\c1ccccc1[O-])C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000005678509	264019249	/nfs/dbraw/zinc/01/92/49/264019249.db2.gz	VDEGTMRIPXMDKE-XYOKQWHBSA-N	-1	1	309.281	2.846	10	50		DFGEMM