smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1cc([N+](=O)[O-])cc(C=Cc2[nH]c(=O)[n-]c(=O)c2[N+](=O)[O-])c1O	ZINC000016194935	518745477	/nfs/dbraw/zinc/74/54/77/518745477.db2.gz	GKWRNRXRNXFSPK-NSCUHMNNSA-N	-1	2	350.243	1.177	50	5		FDBALM
Cc1[nH][nH]c(=O)c1C(c1c(C)[nH][nH]c1=O)c1cc([N+](=O)[O-])c([O-])cc1O	ZINC000020131004	211268486	/nfs/dbraw/zinc/26/84/86/211268486.db2.gz	RGXXLKLIJCOKHR-UHFFFAOYSA-N	-1	2	361.314	1.660	50	5		FDBALM
O=C([O-])[C@H](Cc1ccc(O)c([N+](=O)[O-])c1)NS(=O)(=O)c1ccccc1	ZINC000035287481	519603808	/nfs/dbraw/zinc/60/38/08/519603808.db2.gz	FFTGZNSFCAEWNX-LBPRGKRZSA-N	-1	2	366.351	1.275	50	5		FDBALM
O=C([O-])COc1ccc(NS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1	ZINC000007360757	518417102	/nfs/dbraw/zinc/41/71/02/518417102.db2.gz	NPNVUBHNZKIDKN-UHFFFAOYSA-N	-1	2	352.324	1.859	50	5		FDBALM