smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=S(=O)([N-]c1cc(Cl)c([O-])c(Cl)c1Cl)c1ccccc1	ZINC000000944044	570464751	/nfs/dbraw/zinc/46/47/51/570464751.db2.gz	BQZKHPFZSKTMOX-UHFFFAOYSA-N	-2	3	352.626	4.153	50	10		FICAHL
Cc1ccc(S(=O)(=O)[N-]c2cc(Cl)c([O-])c(Cl)c2Cl)cc1	ZINC000001232927	570495744	/nfs/dbraw/zinc/49/57/44/570495744.db2.gz	OQDKJHNFJNVPTA-UHFFFAOYSA-N	-2	3	366.653	4.462	50	10		FICAHL
O=S(=O)([N-]c1ccc([O-])c(-c2nc3ccccc3o2)c1)c1ccccc1	ZINC000022135448	1081372998	/nfs/dbraw/zinc/37/29/98/1081372998.db2.gz	ZOPDGTVNGMYKON-UHFFFAOYSA-N	-2	3	366.398	4.001	50	10		FICAHL
O=S(=O)([N-]c1cc(Cl)c([O-])c2ccccc12)c1ccc(F)cc1	ZINC000004134583	204123605	/nfs/dbraw/zinc/12/36/05/204123605.db2.gz	XHQHOCGYFJHKMR-UHFFFAOYSA-N	-2	3	351.786	4.139	50	10		FICAHL
CC(C)c1ccc(S(=O)(=O)[N-]c2ccc([O-])c(Br)c2)cc1	ZINC000000645598	570443867	/nfs/dbraw/zinc/44/38/67/570443867.db2.gz	PHFZAIMLJZXLKT-UHFFFAOYSA-N	-2	3	370.268	4.079	50	10		FICAHL
COc1ccc(S(=O)(=O)[N-]c2cc(Cl)c([O-])c3ccccc23)cc1	ZINC000000944045	570464806	/nfs/dbraw/zinc/46/48/06/570464806.db2.gz	PBHNALRVEVSVQD-UHFFFAOYSA-N	-2	3	363.822	4.008	50	10		FICAHL
Cc1[n-]n(-c2ccc(Cl)cc2)c(=O)c1C=Nc1cc(C(=O)[O-])ccc1C	ZINC000004982667	570571943	/nfs/dbraw/zinc/57/19/43/570571943.db2.gz	MARAZEJHABJPPY-MHWRWJLKSA-N	-2	3	369.808	4.065	50	10		FICAHL
Cc1[n-]n(-c2ccc(Cl)cc2)c(=O)c1C=Nc1cc(C(=O)[O-])ccc1C	ZINC000100501678	222244937	/nfs/dbraw/zinc/24/49/37/222244937.db2.gz	MARAZEJHABJPPY-YBEGLDIGSA-N	-2	3	369.808	4.065	50	10		FICAHL