smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
N[C@H](CCCC[NH3+])C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000004556755	169983576	/nfs/dbraw/zinc/98/35/76/169983576.db2.gz	VUUNELJIFNFWJC-LLVKDONJSA-N	1	3	266.301	0.990	40	5	in-vitro	CCBBHO
N=C(Nc1ccc([N+](=O)[O-])cn1)N1CC[NH2+]CC1	ZINC000225239829	352001460	/nfs/dbraw/zinc/00/14/60/352001460.db2.gz	APYLYSUCPNCZRZ-UHFFFAOYSA-N	1	3	250.262	0.242	40	5		CCBBHO
N=C(Nc1ccc([N+](=O)[O-])cn1)N1CCC([NH3+])CC1	ZINC000225239717	352001450	/nfs/dbraw/zinc/00/14/50/352001450.db2.gz	STLJSNYXAZOLNM-UHFFFAOYSA-N	1	3	264.289	0.760	40	5		CCBBHO