smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cn1cc([N+](=O)[O-])c(=O)[nH]c1=O	2562221	169043500	/nfs/dbraw/zinc/04/35/00/169043500.db2.gz	JTVBCXIVJCAUBK-UHFFFAOYSA-N	0	1	171.112	-1.018	50	5		AABAMN
Nc1nc(N)c([N+](=O)[O-])c(=O)[nH]1	16989893	169305571	/nfs/dbraw/zinc/30/55/71/169305571.db2.gz	XNFGVBWYGFPSDN-UHFFFAOYSA-N	0	1	171.116	-1.158	50	5	in-vivo	AABAMN
O=c1[n-][n+](-c2[nH]ncc2[N+](=O)[O-])no1	6188120	171019986	/nfs/dbraw/zinc/01/99/86/171019986.db2.gz	UTTPOWVSVFFJQV-UHFFFAOYSA-O	0	1	199.106	-1.729	50	5		AABAMN