smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1noc([C@H]2COCCN2CC(=O)NOCc2ccccc2)n1	ZINC000161230204	436884960	/nfs/dbraw/zinc/88/49/60/436884960.db2.gz	YEYYPTIGSMCVBF-CQSZACIVSA-N	0	2	332.360	0.999	10	70		ECIELN
CCC[C@@H](C(=O)N1CCC[N@@H+](CC(=O)N2CCCC2)CC1)[NH+](C)C	ZINC000159737205	436863633	/nfs/dbraw/zinc/86/36/33/436863633.db2.gz	YEIXMMMXPLETMB-INIZCTEOSA-N	0	2	338.496	0.873	10	70		ECIELN
Cc1noc([C@@H]2COCCN2CC(=O)NOCc2ccccc2)n1	ZINC000161230093	436885751	/nfs/dbraw/zinc/88/57/51/436885751.db2.gz	YEYYPTIGSMCVBF-AWEZNQCLSA-N	0	2	332.360	0.999	10	70		ECIELN
CCC[C@H](C(=O)N1CCC[N@@H+](CC(=O)N2CCCC2)CC1)[NH+](C)C	ZINC000159737337	436863536	/nfs/dbraw/zinc/86/35/36/436863536.db2.gz	YEIXMMMXPLETMB-MRXNPFEDSA-N	0	2	338.496	0.873	10	70		ECIELN
CC[C@@H]1C[N@H+](CCc2cn(CC(=O)OC)nn2)CCN1CCOC	ZINC000159926752	436866616	/nfs/dbraw/zinc/86/66/16/436866616.db2.gz	LZSCERXPWFXCBM-OAHLLOKOSA-N	0	2	339.440	0.036	10	70		ECIELN
CC[C@H]1C[N@H+](CCc2cn(CC(=O)OC)nn2)CCN1CCOC	ZINC000159926908	436865122	/nfs/dbraw/zinc/86/51/22/436865122.db2.gz	LZSCERXPWFXCBM-HNNXBMFYSA-N	0	2	339.440	0.036	10	70		ECIELN