smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)[N@@H+](C)Cc1cc(=O)n2c(n1)CN(c1ccc(S(=O)(=O)F)nn1)CCC2	ZINC001164814055	720238188	/nfs/dbraw/zinc/23/81/88/720238188.db2.gz	UGIRWIGYEFEIFJ-UHFFFAOYSA-N	1	1	410.475	0.942	20	70		HCIDMO
CN(C)C(=O)C[N@H+]1CCOCC2(CCN(c3ccc(S(=O)(=O)F)nn3)CC2)C1	ZINC001164879183	721286759	/nfs/dbraw/zinc/28/67/59/721286759.db2.gz	WJZDINHXXIMDMI-UHFFFAOYSA-N	1	1	415.491	0.142	20	70		HCIDMO
C[NH+]1CCN(C[C@H]2CCC[C@]3(CCN(c4ccc(S(=O)(=O)F)nn4)C3)O2)CC1	ZINC001164895828	721437367	/nfs/dbraw/zinc/43/73/67/721437367.db2.gz	QCAZXQSTZYQMEC-CRAIPNDOSA-N	1	1	413.519	0.900	20	70		HCIDMO
C[NH+]1CCN(C[C@@H]2CCC[C@]3(CCN(c4ccc(S(=O)(=O)F)nn4)C3)O2)CC1	ZINC001164895829	721436984	/nfs/dbraw/zinc/43/69/84/721436984.db2.gz	QCAZXQSTZYQMEC-MAUKXSAKSA-N	1	1	413.519	0.900	20	70		HCIDMO
C[NH+]1CCN(C[C@H]2CCC[C@@]3(CCN(c4ccc(S(=O)(=O)F)nn4)C3)O2)CC1	ZINC001164895830	721437075	/nfs/dbraw/zinc/43/70/75/721437075.db2.gz	QCAZXQSTZYQMEC-QAPCUYQASA-N	1	1	413.519	0.900	20	70		HCIDMO
C[NH+]1CCN(C[C@@H]2CCC[C@@]3(CCN(c4ccc(S(=O)(=O)F)nn4)C3)O2)CC1	ZINC001164895831	721437346	/nfs/dbraw/zinc/43/73/46/721437346.db2.gz	QCAZXQSTZYQMEC-YJBOKZPZSA-N	1	1	413.519	0.900	20	70		HCIDMO
COC(=O)c1cnc(N2CC[C@H]3[C@@H]2CCN3CC[NH+](C)C)c(S(=O)(=O)F)c1	ZINC001164935457	721890052	/nfs/dbraw/zinc/89/00/52/721890052.db2.gz	WTHOFPQHRSULBW-KBPBESRZSA-N	1	1	400.476	0.741	20	70		HCIDMO
COC(=O)c1cnc(N2CC[C@@H]3[C@@H]2CCN3CC[NH+](C)C)c(S(=O)(=O)F)c1	ZINC001164935458	721889770	/nfs/dbraw/zinc/88/97/70/721889770.db2.gz	WTHOFPQHRSULBW-KGLIPLIRSA-N	1	1	400.476	0.741	20	70		HCIDMO
COC(=O)c1cnc(N2CC[C@H]3[C@H]2CCN3CC[NH+](C)C)c(S(=O)(=O)F)c1	ZINC001164935459	721889984	/nfs/dbraw/zinc/88/99/84/721889984.db2.gz	WTHOFPQHRSULBW-UONOGXRCSA-N	1	1	400.476	0.741	20	70		HCIDMO
COC(=O)c1cnc(N2CC[C@@H]3[C@H]2CCN3CC[NH+](C)C)c(S(=O)(=O)F)c1	ZINC001164935460	721889749	/nfs/dbraw/zinc/88/97/49/721889749.db2.gz	WTHOFPQHRSULBW-ZIAGYGMSSA-N	1	1	400.476	0.741	20	70		HCIDMO
C[NH+]1CCN(c2ncnc3c2CCN(c2ccc(S(=O)(=O)F)nn2)CC3)CC1	ZINC001165001789	722238243	/nfs/dbraw/zinc/23/82/43/722238243.db2.gz	LVMDEECIHCXDSX-UHFFFAOYSA-N	1	1	407.475	0.282	20	70		HCIDMO
C[NH+]1CCN(c2ncnc3c2CCN(c2cc(S(=O)(=O)F)ccn2)CC3)CC1	ZINC001165003135	722240045	/nfs/dbraw/zinc/24/00/45/722240045.db2.gz	ILTVTEHFNNCCGX-UHFFFAOYSA-N	1	1	406.487	0.887	20	70		HCIDMO