smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1cc(C)cc(Nc2cc(N3CC[NH+](C)CC3)nc(C)[nH+]2)c1	ZINC000216848550	426561905	/nfs/dbraw/zinc/56/19/05/426561905.db2.gz	SPSBZDOYUKTDQC-UHFFFAOYSA-N	2	2	311.433	2.897	40	70		DFIBLP
Cc1nc(N2CC[NH+](C)CC2)cc(Nc2cccc(Cl)c2)[nH+]1	ZINC000216848935	426561319	/nfs/dbraw/zinc/56/13/19/426561319.db2.gz	MLBFIOWPDSESQL-UHFFFAOYSA-N	2	2	317.824	2.934	40	70		DFIBLP
Cc1nc(N2CC[NH+](C)CC2)cc(Nc2ccc(Cl)cc2)[nH+]1	ZINC000216848974	426562739	/nfs/dbraw/zinc/56/27/39/426562739.db2.gz	DYRORLGGWMEVBI-UHFFFAOYSA-N	2	2	317.824	2.934	40	70		DFIBLP
CCc1ccccc1Nc1cc(N2CC[NH+](C)CC2)nc(C)[nH+]1	ZINC000216848600	426562778	/nfs/dbraw/zinc/56/27/78/426562778.db2.gz	YJHISJOCFZFNLB-UHFFFAOYSA-N	2	2	311.433	2.843	40	70		DFIBLP
Cc1nc(N2CC[NH+](C)CC2)cc(Nc2ccccc2Cl)[nH+]1	ZINC000216848890	426562789	/nfs/dbraw/zinc/56/27/89/426562789.db2.gz	OYLBXLMBWBJBTJ-UHFFFAOYSA-N	2	2	317.824	2.934	40	70		DFIBLP
Cc1cccc(Nc2cc(N3CC[NH+](C)CC3)nc(C)[nH+]2)c1C	ZINC000216848371	426562663	/nfs/dbraw/zinc/56/26/63/426562663.db2.gz	HJZOYOUMYGGWAZ-UHFFFAOYSA-N	2	2	311.433	2.897	40	70		DFIBLP
CCc1ccc(Nc2cc(N3CC[NH+](C)CC3)nc(C)[nH+]2)cc1	ZINC000216848639	426561894	/nfs/dbraw/zinc/56/18/94/426561894.db2.gz	UFKCDFZHOYGJIY-UHFFFAOYSA-N	2	2	311.433	2.843	40	70		DFIBLP
Cc1ccc(Nc2cc(N3CC[NH+](C)CC3)nc(C)[nH+]2)c(C)c1	ZINC000216848416	426562417	/nfs/dbraw/zinc/56/24/17/426562417.db2.gz	JYZPRJOUSXIWHP-UHFFFAOYSA-N	2	2	311.433	2.897	40	70		DFIBLP
Cc1ccc(Nc2cc(N3CC[NH+](C)CC3)nc(C)[nH+]2)cc1C	ZINC000216848509	426561157	/nfs/dbraw/zinc/56/11/57/426561157.db2.gz	JSKMKQMVPZQFTE-UHFFFAOYSA-N	2	2	311.433	2.897	40	70		DFIBLP
Cc1ccc(C)c(Nc2cc(N3CC[NH+](C)CC3)nc(C)[nH+]2)c1	ZINC000216848465	426561916	/nfs/dbraw/zinc/56/19/16/426561916.db2.gz	YYMTYTFWJVEGRE-UHFFFAOYSA-N	2	2	311.433	2.897	40	70		DFIBLP