smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[NH+]1CCN(S(=O)(=O)c2cc([N+](=O)[O-])ccc2N2CC[NH2+]CC2)CC1	ZINC000004182315	484028051	/nfs/dbraw/zinc/02/80/51/484028051.db2.gz	IVPRYHSZZKSBPM-UHFFFAOYSA-N	2	2	369.447	-0.060	50	5		FBBALP
CC[NH+]1CCN(c2nc(N3CC[NH+](C)CC3)nc(N)c2[N+](=O)[O-])CC1	ZINC000005025762	483885404	/nfs/dbraw/zinc/88/54/04/483885404.db2.gz	WCYOMIGBQJFLOG-UHFFFAOYSA-N	2	2	350.427	-0.139	50	5		FBBALP
CC[NH+]1CCN(c2nc(N)c([N+](=O)[O-])c(N3CC[NH+](C)CC3)n2)CC1	ZINC000005030823	483886033	/nfs/dbraw/zinc/88/60/33/483886033.db2.gz	WEHGXXUDMPWQHR-UHFFFAOYSA-N	2	2	350.427	-0.139	50	5		FBBALP
C[NH+]1CCN(c2nc(NCC[NH+]3CCOCC3)nc(N)c2[N+](=O)[O-])CC1	ZINC000020394278	523928211	/nfs/dbraw/zinc/92/82/11/523928211.db2.gz	WMMYULWNIJAKNU-UHFFFAOYSA-N	2	2	366.426	-0.537	50	5		FBBALP