smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCc1nc(SC(=Cc2cc(C)n(-c3ccc(F)c(Cl)c3)c2C)C(=O)[O-])n[n-]1	ZINC000408632763	557574794	/nfs/dbraw/zinc/57/47/94/557574794.db2.gz	SHEZONVXTFPIRK-PXNMLYILSA-N	-2	3	420.897	4.785	40	10		HJCBHL
Cc1ccc2ccc([C@H](Nc3ccccc3C(=O)[O-])c3ccc(O)cc3)c([O-])c2n1	ZINC000408731558	557795635	/nfs/dbraw/zinc/79/56/35/557795635.db2.gz	NQLKBTSSTKINDM-OAQYLSRUSA-N	-2	3	400.434	4.854	40	10		HJCBHL
COc1ccc(S(=O)(=O)[N-]c2ccc(/N=N/c3ccccc3)cc2)cc1C(=O)[O-]	ZINC000226857081	559274073	/nfs/dbraw/zinc/27/40/73/559274073.db2.gz	OCAHDQATWPGLDQ-QURGRASLSA-N	-2	3	411.439	4.610	40	10		HJCBHL
Cc1ccc2ccc([C@@H](Nc3ccccc3C(=O)[O-])c3ccc(O)cc3)c([O-])c2n1	ZINC000408731556	557795347	/nfs/dbraw/zinc/79/53/47/557795347.db2.gz	NQLKBTSSTKINDM-NRFANRHFSA-N	-2	3	400.434	4.854	40	10		HJCBHL