smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C1[N-]C(=O)C(=Cc2c3ccccc3cc3ccccc32)S1	ZINC000004017918	181063209	/nfs/dbraw/zinc/06/32/09/181063209.db2.gz	MUPCQOPJEWLLSO-MHWRWJLKSA-N	-1	1	305.358	4.317	10	5		DIBEMM
O=c1c(-c2ccccc2)c([O-])c2cccc3c4ccccc4n1c32	ZINC000033377110	563445626	/nfs/dbraw/zinc/44/56/26/563445626.db2.gz	AWYXUZHAOIWLOY-UHFFFAOYSA-N	-1	1	311.340	4.416	10	5		DIBEMM
O=[N+]([O-])c1c(Cl)ncnc1[N-]c1cccc(Cl)c1Cl	ZINC000040571299	183104438	/nfs/dbraw/zinc/10/44/38/183104438.db2.gz	UKLOFVVFNBMYII-UHFFFAOYSA-N	-1	1	319.535	4.089	10	5		DIBEMM
O=[N+]([O-])c1c(Cl)ncnc1[N-]c1cc(Cl)ccc1Cl	ZINC000040571296	183104349	/nfs/dbraw/zinc/10/43/49/183104349.db2.gz	UJDISPCQQQWCLW-UHFFFAOYSA-N	-1	1	319.535	4.089	10	5		DIBEMM