smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCC(=O)N1CC[C@@H](C(=O)NC[C@H]2C[N@H+](C)CCO2)C1	ZINC000161117335	521130005	/nfs/dbraw/zinc/13/00/05/521130005.db2.gz	IVXPJAISAKFICG-NEPJUHHUSA-N	1	2	283.372	-0.308	10	70		CBIELO
CCC(=O)N1CC[C@@H](C(=O)NC[C@H]2C[N@@H+](C)CCO2)C1	ZINC000161117335	521130011	/nfs/dbraw/zinc/13/00/11/521130011.db2.gz	IVXPJAISAKFICG-NEPJUHHUSA-N	1	2	283.372	-0.308	10	70		CBIELO
O=C(N[C@H]1CCOC1)N1CC[C@@H]([NH+]2CCOCC2)C1	ZINC000159376202	295882516	/nfs/dbraw/zinc/88/25/16/295882516.db2.gz	FXJIAQBEVWCOET-NWDGAFQWSA-N	1	2	269.345	-0.109	10	70		CBIELO
O=C(N[C@@H]1CCOC1)N1CC[C@H]([NH+]2CCOCC2)C1	ZINC000159376062	295762087	/nfs/dbraw/zinc/76/20/87/295762087.db2.gz	FXJIAQBEVWCOET-NEPJUHHUSA-N	1	2	269.345	-0.109	10	70		CBIELO
CCC(=O)N1CC[C@@H](C(=O)NC[C@@H]2C[N@H+](C)CCO2)C1	ZINC000161117077	521128807	/nfs/dbraw/zinc/12/88/07/521128807.db2.gz	IVXPJAISAKFICG-VXGBXAGGSA-N	1	2	283.372	-0.308	10	70		CBIELO
CCC(=O)N1CC[C@@H](C(=O)NC[C@@H]2C[N@@H+](C)CCO2)C1	ZINC000161117077	521128813	/nfs/dbraw/zinc/12/88/13/521128813.db2.gz	IVXPJAISAKFICG-VXGBXAGGSA-N	1	2	283.372	-0.308	10	70		CBIELO
O=C(N[C@H]1CCOC1)N1CC[C@H]([NH+]2CCOCC2)C1	ZINC000159376350	351963339	/nfs/dbraw/zinc/96/33/39/351963339.db2.gz	FXJIAQBEVWCOET-RYUDHWBXSA-N	1	2	269.345	-0.109	10	70		CBIELO
CCC(=O)N1CC[C@H](C(=O)NC[C@@H]2C[N@H+](C)CCO2)C1	ZINC000161116954	521143457	/nfs/dbraw/zinc/14/34/57/521143457.db2.gz	IVXPJAISAKFICG-NWDGAFQWSA-N	1	2	283.372	-0.308	10	70		CBIELO
CCC(=O)N1CC[C@H](C(=O)NC[C@@H]2C[N@@H+](C)CCO2)C1	ZINC000161116954	521143463	/nfs/dbraw/zinc/14/34/63/521143463.db2.gz	IVXPJAISAKFICG-NWDGAFQWSA-N	1	2	283.372	-0.308	10	70		CBIELO
O=C(N[C@@H]1CCOC1)N1CC[C@@H]([NH+]2CCOCC2)C1	ZINC000159375923	351963161	/nfs/dbraw/zinc/96/31/61/351963161.db2.gz	FXJIAQBEVWCOET-VXGBXAGGSA-N	1	2	269.345	-0.109	10	70		CBIELO
CCC(=O)N1CC[C@H](C(=O)NC[C@H]2C[N@H+](C)CCO2)C1	ZINC000161117215	521142164	/nfs/dbraw/zinc/14/21/64/521142164.db2.gz	IVXPJAISAKFICG-RYUDHWBXSA-N	1	2	283.372	-0.308	10	70		CBIELO
CCC(=O)N1CC[C@H](C(=O)NC[C@H]2C[N@@H+](C)CCO2)C1	ZINC000161117215	521142171	/nfs/dbraw/zinc/14/21/71/521142171.db2.gz	IVXPJAISAKFICG-RYUDHWBXSA-N	1	2	283.372	-0.308	10	70		CBIELO