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(c2ccc(C[NH+]3CCN(C(=O)C(=O)N4CCOCC4)CC3)cc2)CC1	ZINC000775645049	1071715218	/nfs/dbraw/zinc/71/52/18/1071715218.db2.gz	VEKVWSIEPVPKFR-UHFFFAOYSA-N	2	2	415.538	-0.059	20	10		HBCDLP
Cc1cc(=O)oc2cc(O)c(C[N@@H+](C)CC(=O)NCCN(CC[NH3+])N(O)N=O)cc12	ZINC001184359530	1071492184	/nfs/dbraw/zinc/49/21/84/1071492184.db2.gz	FTEUIYNARYJALT-UHFFFAOYSA-N	2	2	422.442	-0.097	20	10		HBCDLP
Cc1cc(=O)oc2cc(O)c(C[N@H+](C)CC(=O)NCCN(CC[NH3+])N(O)N=O)cc12	ZINC001184359530	1071492180	/nfs/dbraw/zinc/49/21/80/1071492180.db2.gz	FTEUIYNARYJALT-UHFFFAOYSA-N	2	2	422.442	-0.097	20	10		HBCDLP
CNC(=O)C[N@H+]1CCCN(C[C@H](O)C[NH+]2CCN(c3ccc(OC)cc3)CC2)CC1	ZINC001197960771	1071755893	/nfs/dbraw/zinc/75/58/93/1071755893.db2.gz	YEWAGEBLSGZAKQ-FQEVSTJZSA-N	2	2	419.570	-0.068	20	10		HBCDLP
CNC(=O)C[N@@H+]1CCCN(C[C@H](O)C[NH+]2CCN(c3ccc(OC)cc3)CC2)CC1	ZINC001197960771	1071755888	/nfs/dbraw/zinc/75/58/88/1071755888.db2.gz	YEWAGEBLSGZAKQ-FQEVSTJZSA-N	2	2	419.570	-0.068	20	10		HBCDLP
CNC(=O)C[N@H+]1CCCN(C[C@@H](O)C[NH+]2CCN(c3ccc(OC)cc3)CC2)CC1	ZINC001197960778	1071755971	/nfs/dbraw/zinc/75/59/71/1071755971.db2.gz	YEWAGEBLSGZAKQ-HXUWFJFHSA-N	2	2	419.570	-0.068	20	10		HBCDLP
CNC(=O)C[N@@H+]1CCCN(C[C@@H](O)C[NH+]2CCN(c3ccc(OC)cc3)CC2)CC1	ZINC001197960778	1071755962	/nfs/dbraw/zinc/75/59/62/1071755962.db2.gz	YEWAGEBLSGZAKQ-HXUWFJFHSA-N	2	2	419.570	-0.068	20	10		HBCDLP