smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1ccnc([N-]c2ncnc([N-]c3cc(C)ccn3)c2[N+](=O)[O-])c1	ZINC000040588147	213355173	/nfs/dbraw/zinc/35/51/73/213355173.db2.gz	YAXONXMWABVCDW-UHFFFAOYSA-N	-2	1	337.343	3.279	10	5		EGBEML
Cc1cccc([N-]c2ncnc([N-]c3cccc(C)n3)c2[N+](=O)[O-])n1	ZINC000040584476	213353506	/nfs/dbraw/zinc/35/35/06/213353506.db2.gz	WFEWILRIZIZRAL-UHFFFAOYSA-N	-2	1	337.343	3.279	10	5		EGBEML
Cc1nc([N-]c2ncnc([N-]c3ccccn3)c2[N+](=O)[O-])sc1C	ZINC000040646818	213364237	/nfs/dbraw/zinc/36/42/37/213364237.db2.gz	RXKXLUGOLMAFFI-UHFFFAOYSA-N	-2	1	343.372	3.340	10	5		EGBEML
O=C(Nc1ccc(F)cc1[O-])c1cc(Cl)cc([N+](=O)[O-])c1[O-]	ZINC001183054940	1387256331	/nfs/dbraw/zinc/25/63/31/1387256331.db2.gz	XJOPPWHYBGKQSR-UHFFFAOYSA-N	-2	1	326.667	3.051	10	5		EGBEML
Cc1cc([N-]c2ncnc([N-]c3cccnc3Cl)c2[N+](=O)[O-])no1	ZINC000040582422	213354054	/nfs/dbraw/zinc/35/40/54/213354054.db2.gz	CAZGLCISGUURNW-UHFFFAOYSA-N	-2	1	347.722	3.217	10	5		EGBEML
Cc1ccc([N-]c2ncnc([N-]c3nccs3)c2[N+](=O)[O-])nc1	ZINC000040647824	213363950	/nfs/dbraw/zinc/36/39/50/213363950.db2.gz	RWPGZPQFMMAACV-UHFFFAOYSA-N	-2	1	329.345	3.032	10	5		EGBEML
O=[N+]([O-])c1c([N-]c2ccccn2)ncnc1[N-]c1ccc(Cl)cn1	ZINC000040646794	213364186	/nfs/dbraw/zinc/36/41/86/213364186.db2.gz	NCYQXGLAQVCHKV-UHFFFAOYSA-N	-2	1	343.734	3.315	10	5		EGBEML
Cc1ccnc([N-]c2ncnc([N-]c3nccs3)c2[N+](=O)[O-])c1	ZINC000040588248	213355791	/nfs/dbraw/zinc/35/57/91/213355791.db2.gz	QIKHFNZSEYYKDD-UHFFFAOYSA-N	-2	1	329.345	3.032	10	5		EGBEML