smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[N+](C)(C)CC(=O)NN=C1CCCC[C@H]1C1CCCCC1	ZINC000814694692	717190782	/nfs/dbraw/zinc/19/07/82/717190782.db2.gz	VFQPYSUGUKSPGF-HNNXBMFYSA-O	1	0	294.463	2.935	20	50		CFGDRO
CC(C)=CCC[C@H](C)CC=NNC(=O)C[N+](C)(C)C	ZINC000916270715	717193219	/nfs/dbraw/zinc/19/32/19/717193219.db2.gz	OYMIJLZPGSEDDJ-AWEZNQCLSA-O	1	0	268.425	2.567	20	50		CFGDRO
C[N+](C)(C)CC(=O)NN=C1CCCC[C@H]1C1=CCCCC1	ZINC000814694215	717191209	/nfs/dbraw/zinc/19/12/09/717191209.db2.gz	ACAWQZWEUKTFPZ-HNNXBMFYSA-O	1	0	292.447	2.855	20	50		CFGDRO
CC(CCC1CCCCC1)=NNC(=O)C[N+](C)(C)C	ZINC000794457556	717190434	/nfs/dbraw/zinc/19/04/34/717190434.db2.gz	SGBNPPSQJMIMPT-UHFFFAOYSA-O	1	0	268.425	2.545	20	50		CFGDRO
CCCC(CCc1ccccc1)=NNC(=O)C[N+](C)(C)C	ZINC000794455267	717189212	/nfs/dbraw/zinc/18/92/12/717189212.db2.gz	DHMGRKIMRDTSFW-UHFFFAOYSA-O	1	0	290.431	2.598	20	50		CFGDRO
CCCCCC[C@H]1CCCC1=NNC(=O)C[N+](C)(C)C	ZINC000794455439	717189233	/nfs/dbraw/zinc/18/92/33/717189233.db2.gz	GEUVMGOAVOUSRB-AWEZNQCLSA-O	1	0	282.452	2.935	20	50		CFGDRO
C[N+](C)(C)CC(=O)NN=C1CCCC[C@@H]1C1=CCCCC1	ZINC000814694216	717191105	/nfs/dbraw/zinc/19/11/05/717191105.db2.gz	ACAWQZWEUKTFPZ-OAHLLOKOSA-O	1	0	292.447	2.855	20	50		CFGDRO
CC(=NNC(=O)C[N+](C)(C)C)[C@@H](C)c1ccc(Cl)cc1	ZINC000794457912	717190385	/nfs/dbraw/zinc/19/03/85/717190385.db2.gz	WYLWCUGCZDAKNU-LLVKDONJSA-O	1	0	296.822	2.642	20	50		CFGDRO
CC(C)=CCC[C@@H](C)CC=NNC(=O)C[N+](C)(C)C	ZINC000916270824	717194383	/nfs/dbraw/zinc/19/43/83/717194383.db2.gz	OYMIJLZPGSEDDJ-CQSZACIVSA-O	1	0	268.425	2.567	20	50		CFGDRO
C[N+](C)(C)CC(=O)NN=C1CCC(C2CCCCC2)CC1	ZINC000794457867	717190330	/nfs/dbraw/zinc/19/03/30/717190330.db2.gz	VSWWPODTKKHSQA-UHFFFAOYSA-O	1	0	294.463	2.935	20	50		CFGDRO
CC(C)(C)C1CCC(C=NNC(=O)C[N+](C)(C)C)CC1	ZINC000794457235	717189616	/nfs/dbraw/zinc/18/96/16/717189616.db2.gz	PXWWLKBWELBSJJ-UHFFFAOYSA-O	1	0	282.452	2.647	20	50		CFGDRO
C/C(C=NNC(=O)C[N+](C)(C)C)=C/c1ccc(Cl)cc1	ZINC000794456738	717190004	/nfs/dbraw/zinc/19/00/04/717190004.db2.gz	MNQSEZKUSUMTLX-JDYMHBPESA-O	1	0	294.806	2.552	20	50		CFGDRO
C[N+](C)(C)CC(=O)NN=Cc1ccc(C2CCCC2)cc1	ZINC000812222226	717190915	/nfs/dbraw/zinc/19/09/15/717190915.db2.gz	MVUSONNKTDHEFI-UHFFFAOYSA-O	1	0	288.415	2.501	20	50		CFGDRO
C[N+](C)(C)CC(=O)NN=Cc1ccc(-c2ccccc2)cc1	ZINC000916270393	717193368	/nfs/dbraw/zinc/19/33/68/717193368.db2.gz	BWRMYZLAXVDGBE-UHFFFAOYSA-O	1	0	296.394	2.510	20	50		CFGDRO
C/C(C=NNC(=O)C[N+](C)(C)C)=C\c1ccc(Cl)cc1	ZINC000794456750	717189930	/nfs/dbraw/zinc/18/99/30/717189930.db2.gz	MNQSEZKUSUMTLX-KBLMJJCZSA-O	1	0	294.806	2.552	20	50		CFGDRO
CC(=NNC(=O)C[N+](C)(C)C)[C@H](C)c1ccc(Cl)cc1	ZINC000794457913	717190325	/nfs/dbraw/zinc/19/03/25/717190325.db2.gz	WYLWCUGCZDAKNU-NSHDSACASA-O	1	0	296.822	2.642	20	50		CFGDRO
CCCCc1ccc(C(C)=NNC(=O)C[N+](C)(C)C)cc1	ZINC000916270414	717193040	/nfs/dbraw/zinc/19/30/40/717193040.db2.gz	DWPAJCCHGFZTQV-UHFFFAOYSA-O	1	0	290.431	2.576	20	50		CFGDRO
C[N+](C)(C)CC(=O)NN=C1CCC2(CCCCC2)CC1	ZINC000794456993	717189607	/nfs/dbraw/zinc/18/96/07/717189607.db2.gz	OBZUSMSHAOQDNE-UHFFFAOYSA-O	1	0	280.436	2.689	20	50		CFGDRO
C[N+](C)(C)CC(=O)NN=C1CCCC[C@@H]1C1CCCCC1	ZINC000814694693	717191076	/nfs/dbraw/zinc/19/10/76/717191076.db2.gz	VFQPYSUGUKSPGF-OAHLLOKOSA-O	1	0	294.463	2.935	20	50		CFGDRO
CC(C)(C)[C@H]1CCCC(=NNC(=O)C[N+](C)(C)C)CC1	ZINC000794458267	717191169	/nfs/dbraw/zinc/19/11/69/717191169.db2.gz	YXHCJURYAAVMIP-ZDUSSCGKSA-O	1	0	282.452	2.791	20	50		CFGDRO
CCCCCC[C@@H]1CCCC1=NNC(=O)C[N+](C)(C)C	ZINC000794455445	717189506	/nfs/dbraw/zinc/18/95/06/717189506.db2.gz	GEUVMGOAVOUSRB-CQSZACIVSA-O	1	0	282.452	2.935	20	50		CFGDRO
CC(C)(C)[C@@H]1CCCC(=NNC(=O)C[N+](C)(C)C)CC1	ZINC000794458266	717190354	/nfs/dbraw/zinc/19/03/54/717190354.db2.gz	YXHCJURYAAVMIP-CYBMUJFWSA-O	1	0	282.452	2.791	20	50		CFGDRO
CC(=NNC(=O)C[N+](C)(C)C)c1ccc(C(C)(C)C)cc1	ZINC000916270907	717193835	/nfs/dbraw/zinc/19/38/35/717193835.db2.gz	VQPIMQOSIWTAMF-UHFFFAOYSA-O	1	0	290.431	2.531	20	50		CFGDRO
CCCC(=NNC(=O)C[N+](C)(C)C)C1CCCCC1	ZINC000794455205	717189384	/nfs/dbraw/zinc/18/93/84/717189384.db2.gz	CUJSWSNKZKWDAE-UHFFFAOYSA-O	1	0	268.425	2.545	20	50		CFGDRO