smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=[N+]([O-])c1c([N-]c2nccs2)ncnc1[N-]c1cccc2cccnc21	ZINC000040626215	205074815	/nfs/dbraw/zinc/07/48/15/205074815.db2.gz	HFUQOYLLMWPKTQ-UHFFFAOYSA-N	-2	3	365.378	3.877	10	5		FHBEHL
Cc1cccc([N-]c2ncnc([N-]c3cccnc3Cl)c2[N+](=O)[O-])n1	ZINC000040584894	205073282	/nfs/dbraw/zinc/07/32/82/205073282.db2.gz	BJPSKRWNAVPAMN-UHFFFAOYSA-N	-2	3	357.761	3.624	10	5		FHBEHL
O=[N+]([O-])c1c([N-]c2nccs2)ncnc1[N-]c1cc(F)ccc1F	ZINC000040647834	205074514	/nfs/dbraw/zinc/07/45/14/205074514.db2.gz	LEGBYZQYLGPZRH-UHFFFAOYSA-N	-2	3	350.310	3.607	10	5		FHBEHL
O=C([O-])c1ccc(Nc2ncnc([N-]c3ccccc3F)c2[N+](=O)[O-])cc1	ZINC000040627843	205075025	/nfs/dbraw/zinc/07/50/25/205075025.db2.gz	RJXNSKTXHKIZTA-UHFFFAOYSA-N	-2	3	369.312	3.709	10	5		FHBEHL
Cc1ccc([N-]c2ncnc([N-]c3cc(F)ccc3F)c2[N+](=O)[O-])nc1	ZINC000040660626	205075886	/nfs/dbraw/zinc/07/58/86/205075886.db2.gz	SOIQFBAQKOOTIR-UHFFFAOYSA-N	-2	3	358.308	3.854	10	5		FHBEHL
Cc1ccc([N-]c2ncnc([N-]c3cccnc3Cl)c2[N+](=O)[O-])nc1	ZINC000040660649	208260858	/nfs/dbraw/zinc/26/08/58/208260858.db2.gz	FGUGJEXFIRDDII-UHFFFAOYSA-N	-2	3	357.761	3.624	10	5		FHBEHL
O=[N+]([O-])c1c([N-]c2nccs2)ncnc1[N-]c1ccc(F)cc1F	ZINC000040647835	208261308	/nfs/dbraw/zinc/26/13/08/208261308.db2.gz	FHOSEUYVUKCXHJ-UHFFFAOYSA-N	-2	3	350.310	3.607	10	5		FHBEHL
Cc1cccnc1[N-]c1ncnc([N-]c2ccc(F)cc2F)c1[N+](=O)[O-]	ZINC000040626035	208259069	/nfs/dbraw/zinc/25/90/69/208259069.db2.gz	SCCYZRIOTHJKKM-UHFFFAOYSA-N	-2	3	358.308	3.854	10	5		FHBEHL