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-])c1cc(-c2ccc(-c3nc4sc5c(c4c(=O)[n-]3)CCCCC5)o2)ccc1Cl	ZINC000408988592	556910538	/nfs/dbraw/zinc/91/05/38/556910538.db2.gz	ILAIIMBPQOWQDG-UHFFFAOYSA-N	-2	1	440.908	5.944	40	0		IKABML
O=C([O-])c1ccc(-c2ccc(-c3nc4sc5c(c4c(=O)[n-]3)CCCC5)o2)cc1Cl	ZINC000408820159	557232552	/nfs/dbraw/zinc/23/25/52/557232552.db2.gz	VRAAJRLBALQWEO-UHFFFAOYSA-N	-2	1	426.881	5.554	40	0		IKABML
O=C([O-])c1ccc(-c2ccc(-c3nc4sc5c(c4c(=O)[n-]3)CCCCC5)o2)cc1Cl	ZINC000409004250	556915118	/nfs/dbraw/zinc/91/51/18/556915118.db2.gz	XBARCLPHHSMLFQ-UHFFFAOYSA-N	-2	1	440.908	5.944	40	0		IKABML
CCOc1cc(C=C2SC(=S)[N-]C2=O)cc(Cl)c1OCc1ccc(C(=O)[O-])cc1	ZINC000033659204	569245506	/nfs/dbraw/zinc/24/55/06/569245506.db2.gz	DXPTVBANTKBKPX-SXGWCWSVSA-N	-2	1	449.937	5.345	40	0		IKABML