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(=S)SC1=CC=CC=Cc1ccc([N+](=O)[O-])cc1	ZINC000033402741	563566203	/nfs/dbraw/zinc/56/62/03/563566203.db2.gz	PEBPEACSBWBPRK-CGRPXXQQSA-N	-1	1	318.379	4.036	50	5		DIBAMM
O=C1[N-]C(=O)C(=Cc2c3ccccc3cc3ccccc32)S1	ZINC000023411446	182359965	/nfs/dbraw/zinc/35/99/65/182359965.db2.gz	MUPCQOPJEWLLSO-YBEGLDIGSA-N	-1	1	305.358	4.317	50	5		DIBAMM
Cc1ccc(C(c2ccc(C)o2)c2ccc([N+](=O)[O-])cc2[O-])o1	ZINC000075260940	563862156	/nfs/dbraw/zinc/86/21/56/563862156.db2.gz	JONGDXLFTYKBJN-UHFFFAOYSA-N	-1	1	313.309	4.283	50	5		DIBAMM
O=[N+]([O-])c1ccc(/C=C/c2cc(Cl)ccc2[O-])c([N+](=O)[O-])c1	ZINC000004702260	181139934	/nfs/dbraw/zinc/13/99/34/181139934.db2.gz	KMRRNHLOEVIPRB-OWOJBTEDSA-N	-1	1	320.688	4.032	50	5		DIBAMM