smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C([O-])c1ccc(N/N=C2/C(=O)[N-]C(=O)NC2=O)cc1	ZINC000018276684	304245963	/nfs/dbraw/zinc/24/59/63/304245963.db2.gz	YFBVHTQHOCUABL-UHFFFAOYSA-N	-2	2	276.208	0.359	50	30		CCEALL
O=C([O-])c1ccc(N/N=C2\C(=O)[N-]C(=O)NC2=O)cc1	ZINC000018276684	304245965	/nfs/dbraw/zinc/24/59/65/304245965.db2.gz	YFBVHTQHOCUABL-UHFFFAOYSA-N	-2	2	276.208	0.359	50	30		CCEALL
O=C([O-])c1ccccc1N/N=C1\C(=O)[N-]C(=O)NC1=O	ZINC000002413438	347967339	/nfs/dbraw/zinc/96/73/39/347967339.db2.gz	QLUAQPUFYMXSOU-UHFFFAOYSA-N	-2	2	276.208	0.359	50	30		CCEALL
O=C([O-])c1ccccc1N/N=C1/C(=O)[N-]C(=O)NC1=O	ZINC000002413438	347967340	/nfs/dbraw/zinc/96/73/40/347967340.db2.gz	QLUAQPUFYMXSOU-UHFFFAOYSA-N	-2	2	276.208	0.359	50	30		CCEALL
O=C([O-])c1cc(N/N=C2\C(=O)[N-]C(=O)NC2=O)ccc1O	ZINC000002429294	347966958	/nfs/dbraw/zinc/96/69/58/347966958.db2.gz	HSHCWJFCOQNVJD-UHFFFAOYSA-N	-2	2	292.207	0.065	50	30		CCEALL
O=C([O-])c1cc(N/N=C2/C(=O)[N-]C(=O)NC2=O)ccc1O	ZINC000002429294	347966962	/nfs/dbraw/zinc/96/69/62/347966962.db2.gz	HSHCWJFCOQNVJD-UHFFFAOYSA-N	-2	2	292.207	0.065	50	30		CCEALL
O=C([O-])c1cccc(N/N=C2/C(=O)[N-]C(=O)NC2=O)c1	ZINC000000539988	347949889	/nfs/dbraw/zinc/94/98/89/347949889.db2.gz	HFNZTHIRQHQBDF-UHFFFAOYSA-N	-2	2	276.208	0.359	50	30		CCEALL
O=C([O-])c1cccc(N/N=C2\C(=O)[N-]C(=O)NC2=O)c1	ZINC000000539988	347949894	/nfs/dbraw/zinc/94/98/94/347949894.db2.gz	HFNZTHIRQHQBDF-UHFFFAOYSA-N	-2	2	276.208	0.359	50	30		CCEALL