smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Nc1c([N+](=O)[O-])c([N-]c2ccccc2)nc([N-]c2ccccc2)c1[N+](=O)[O-]	ZINC000019637739	571326831	/nfs/dbraw/zinc/32/68/31/571326831.db2.gz	UTGGOFIQPVPHMS-UHFFFAOYSA-N	-2	3	366.337	3.967	50	5		FHBAHL
O=C([O-])c1ccc(COc2cc(=O)c3c([O-])c4ccccc4oc-3c2)cc1	ZINC000020412587	211279865	/nfs/dbraw/zinc/27/98/65/211279865.db2.gz	VVGDKPAICMUBJI-UHFFFAOYSA-N	-2	3	362.337	3.929	50	5		FHBAHL
O=C([O-])c1ccc(COc2cc([O-])c3c(c2)oc2ccccc2c3=O)cc1	ZINC000020412587	211279868	/nfs/dbraw/zinc/27/98/68/211279868.db2.gz	VVGDKPAICMUBJI-UHFFFAOYSA-N	-2	3	362.337	3.929	50	5		FHBAHL
Cn1ncc2c1nc1c3ccc([O-])cc3oc1c2-c1ccc(C(=O)[O-])cc1	ZINC000253411885	571312390	/nfs/dbraw/zinc/31/23/90/571312390.db2.gz	PFSRHBICVMYSLN-UHFFFAOYSA-N	-2	3	359.341	3.939	50	5		FHBAHL