smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Nc1nc2ncc(-c3n[nH]c(-c4[nH]nc(-c5cnc6nc(N)nn6c5)c4[N+](=O)[O-])c3[N+](=O)[O-])cn2n1	ZINC000013642412	555548134	/nfs/dbraw/zinc/54/81/34/555548134.db2.gz	ZTQKRYMJCQYGGZ-UHFFFAOYSA-N	0	1	490.364	-0.010	40	5		JBBBMN
Nc1nc2ncc(-c3n[nH]c(-c4n[nH]c(-c5cnc6nc(N)nn6c5)c4[N+](=O)[O-])c3[N+](=O)[O-])cn2n1	ZINC000013642412	555548133	/nfs/dbraw/zinc/54/81/33/555548133.db2.gz	ZTQKRYMJCQYGGZ-UHFFFAOYSA-N	0	1	490.364	-0.010	40	5		JBBBMN
Nc1nc2c(ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(SCc2cc([N+](=O)[O-])ccc2O)n1	ZINC000029059342	556345592	/nfs/dbraw/zinc/34/55/92/556345592.db2.gz	JXIKYSYYTDTHBG-XNIJJKJLSA-N	0	1	450.433	-0.074	40	5		JBBBMN