smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1cccc(O)c1C[N@H+]1CCN(C2CC[NH+](C(C)C)CC2)[C@H](CCO)C1	ZINC000104325896	570257054	/nfs/dbraw/zinc/25/70/54/570257054.db2.gz	LCAJJOOJMVJUCN-LJQANCHMSA-N	2	1	391.556	2.142	50	10		GECAMP
COc1ccc(N2CC[NH+](Cc3cccc(C(=O)NCC[NH+](C)C)c3)CC2)cc1	ZINC000034684237	570301401	/nfs/dbraw/zinc/30/14/01/570301401.db2.gz	WBFRLYBVUSYEOA-UHFFFAOYSA-N	2	1	396.535	2.309	50	10		GECAMP
COc1ccc(O)c(C[N@H+]2CCN(C3CC[NH+](C(C)C)CC3)[C@@H](CCO)C2)c1	ZINC000019744474	210291372	/nfs/dbraw/zinc/29/13/72/210291372.db2.gz	JNYRKTGLJJWHPY-FQEVSTJZSA-N	2	1	391.556	2.142	50	10		GECAMP
COc1cccc(C[N@H+]2CCN(C3CC[NH+](C(C)C)CC3)[C@@H](CCO)C2)c1O	ZINC000019336397	210242482	/nfs/dbraw/zinc/24/24/82/210242482.db2.gz	LLKDGSMJQFDXDH-FQEVSTJZSA-N	2	1	391.556	2.142	50	10		GECAMP
COc1cccc(O)c1C[N@H+]1CCN(C2CC[NH+](C(C)C)CC2)[C@@H](CCO)C1	ZINC000095498914	222333614	/nfs/dbraw/zinc/33/36/14/222333614.db2.gz	LCAJJOOJMVJUCN-IBGZPJMESA-N	2	1	391.556	2.142	50	10		GECAMP
COc1cccc(C[N@H+]2CCN(C3CC[NH+](C(C)C)CC3)[C@H](CCO)C2)c1O	ZINC000104439283	570258551	/nfs/dbraw/zinc/25/85/51/570258551.db2.gz	LLKDGSMJQFDXDH-HXUWFJFHSA-N	2	1	391.556	2.142	50	10		GECAMP
COc1ccc(O)c(C[N@H+]2CCN(C3CC[NH+](C(C)C)CC3)[C@H](CCO)C2)c1	ZINC000104318727	570257037	/nfs/dbraw/zinc/25/70/37/570257037.db2.gz	JNYRKTGLJJWHPY-HXUWFJFHSA-N	2	1	391.556	2.142	50	10		GECAMP