smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=[N+]([O-])[C@@H](CC[C@@H](CC(CCO)([N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])CC(CCO)([N+](=O)[O-])[N+](=O)[O-]	ZINC000104253305	569844213	/nfs/dbraw/zinc/84/42/13/569844213.db2.gz	CYRAGTALAXQZSN-UWVGGRQHSA-N	0	2	472.320	-0.898	50	5		JBBALN
O=[N+]([O-])[C@H](CC[C@@H](CC(CCO)([N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])CC(CCO)([N+](=O)[O-])[N+](=O)[O-]	ZINC000104253311	569844218	/nfs/dbraw/zinc/84/42/18/569844218.db2.gz	CYRAGTALAXQZSN-AOOOYVTPSA-N	0	2	472.320	-0.898	50	5		JBBALN
O=[N+]([O-])[C@H](CC[C@H](CC(CCO)([N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])CC(CCO)([N+](=O)[O-])[N+](=O)[O-]	ZINC000104253315	569844161	/nfs/dbraw/zinc/84/41/61/569844161.db2.gz	CYRAGTALAXQZSN-NXEZZACHSA-N	0	2	472.320	-0.898	50	5		JBBALN