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(Nc1nn[n-]n1)c1cc(Cl)cc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000029313244	202184562	/nfs/dbraw/zinc/18/45/62/202184562.db2.gz	CQHWPYMRGJFYQL-UHFFFAOYSA-N	-1	1	345.706	2.076	1	5		EEBFMM
Cc1ccc2oc3nc(C)c(C(=O)C=C(O)C(=O)[O-])cc3c(=O)c2c1	ZINC000028645828	202174621	/nfs/dbraw/zinc/17/46/21/202174621.db2.gz	KVWKYQQJBMZAEQ-UHFFFAOYSA-N	-1	1	339.303	2.185	1	5		EEBFMM
CCOCCCCc1[n-]c2ccc([N+](=O)[O-])cc2c(=O)c1C(=O)O	ZINC000169308238	528657284	/nfs/dbraw/zinc/65/72/84/528657284.db2.gz	YLQVAYALFZYOQL-UHFFFAOYSA-N	-1	1	334.328	2.494	1	5		EEBFMM
O=c1c(=O)c(Nc2c([O-])cccc2[N+](=O)[O-])c1Nc1ccccc1	ZINC000101103810	219116419	/nfs/dbraw/zinc/11/64/19/219116419.db2.gz	DEQVCEOQNMGQBN-UHFFFAOYSA-N	-1	1	325.280	2.384	1	5		EEBFMM
O=c1c(=O)c(Nc2ccc([N+](=O)[O-])cc2[O-])c1Nc1ccccc1	ZINC000101087114	219116272	/nfs/dbraw/zinc/11/62/72/219116272.db2.gz	LXSMTFUUFKLGLR-LGMDPLHJSA-N	-1	1	325.280	2.218	1	5		EEBFMM
COCC1CC(=O)C(=C([O-])c2ccc(Cl)cc2[N+](=O)[O-])C(=O)C1	ZINC000103275193	219281524	/nfs/dbraw/zinc/28/15/24/219281524.db2.gz	IMTWSXOMJIFHPX-UHFFFAOYSA-N	-1	1	339.731	2.242	1	5		EEBFMM