smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[C@@H]1C[N@H+](CCCNC(=O)c2c[nH]c3cccc(Br)c23)C[C@H](C)O1	ZINC000159537097	565208912	/nfs/dbraw/zinc/20/89/12/565208912.db2.gz	CBXNMEPBUBQGIG-BETUJISGSA-N	1	1	394.313	3.160	10	70		GGIEMO
NC(=O)CC[N@H+](Cc1nc2cc(Br)ccc2[nH]1)Cc1ccccc1	ZINC000160338010	565241447	/nfs/dbraw/zinc/24/14/47/565241447.db2.gz	QKXWUZKYRKLNJW-UHFFFAOYSA-N	1	1	387.281	3.203	10	70		GGIEMO
NC(=O)CC[N@@H+](Cc1nc2cc(Br)ccc2[nH]1)Cc1ccccc1	ZINC000160338010	565241450	/nfs/dbraw/zinc/24/14/50/565241450.db2.gz	QKXWUZKYRKLNJW-UHFFFAOYSA-N	1	1	387.281	3.203	10	70		GGIEMO
C[C@@H]([NH2+]CC(=O)NC(=O)NCc1cccs1)c1ccccc1Br	ZINC000160440605	565245857	/nfs/dbraw/zinc/24/58/57/565245857.db2.gz	TVKFCKGDUDZZIE-LLVKDONJSA-N	1	1	396.310	3.187	10	70		GGIEMO
C[C@@H]1CC[C@H](C(N)=O)C[N@H+]1Cc1ncc(-c2ccccc2Br)o1	ZINC000160530092	565249811	/nfs/dbraw/zinc/24/98/11/565249811.db2.gz	XYMLLSTXVWOHKB-NEPJUHHUSA-N	1	1	378.270	3.190	10	70		GGIEMO
OCCn1nccc1C1CC[NH+](Cc2ccc(F)cc2Br)CC1	ZINC000160553736	565250183	/nfs/dbraw/zinc/25/01/83/565250183.db2.gz	MSHYYXRXUMZBES-UHFFFAOYSA-N	1	1	382.277	3.157	10	70		GGIEMO
CC[C@H]1CN(C(=O)c2c[nH]c3cccc(Br)c23)CC[N@H+]1CCOC	ZINC000160920363	565264082	/nfs/dbraw/zinc/26/40/82/565264082.db2.gz	SISIDCDSRKGKCE-ZDUSSCGKSA-N	1	1	394.313	3.113	10	70		GGIEMO
O=C(CC[N@H+]1CC[C@@]2(O)CCCC[C@@H]2C1)Nc1ccc(Br)cc1	ZINC000161156595	565275191	/nfs/dbraw/zinc/27/51/91/565275191.db2.gz	CJUDNYKMWQSXLA-KDOFPFPSSA-N	1	1	381.314	3.405	10	70		GGIEMO
O=C(CC[N@H+]1CC[C@]2(O)CCCC[C@@H]2C1)Nc1ccc(Br)cc1	ZINC000161156466	565275471	/nfs/dbraw/zinc/27/54/71/565275471.db2.gz	CJUDNYKMWQSXLA-RDTXWAMCSA-N	1	1	381.314	3.405	10	70		GGIEMO
COCC[N@@H+]1CCN(C(=O)Nc2ccc(Br)c(Cl)c2)C[C@@H]1C	ZINC000161236326	565278275	/nfs/dbraw/zinc/27/82/75/565278275.db2.gz	IPUGFQFKQFMGIZ-NSHDSACASA-N	1	1	390.709	3.287	10	70		GGIEMO
COCC[N@H+]1CCN(C(=O)Nc2ccc(Br)c(Cl)c2)C[C@@H]1C	ZINC000161236326	565278279	/nfs/dbraw/zinc/27/82/79/565278279.db2.gz	IPUGFQFKQFMGIZ-NSHDSACASA-N	1	1	390.709	3.287	10	70		GGIEMO
Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)Cc1ccc(Br)c(F)c1	ZINC000161360358	565282741	/nfs/dbraw/zinc/28/27/41/565282741.db2.gz	VFYYRAJGYZDVFB-AWEZNQCLSA-N	1	1	380.261	3.327	10	70		GGIEMO
COc1c(Br)c(C)sc1C(=O)N[C@@H]1C[N@H+](C(C)C)C[C@@H]1C	ZINC000161393495	565283536	/nfs/dbraw/zinc/28/35/36/565283536.db2.gz	CLFPIGZHGZMRTP-GXSJLCMTSA-N	1	1	375.332	3.286	10	70		GGIEMO
CCc1ccc(CN2CC[NH+](C[C@H](O)COCc3cccs3)CC2)s1	ZINC000161427686	565284381	/nfs/dbraw/zinc/28/43/81/565284381.db2.gz	JEMNYYJNQQVUEC-INIZCTEOSA-N	1	1	380.579	3.067	10	70		GGIEMO
CCc1ccc(C[NH+]2CCN(C[C@H](O)COCc3cccs3)CC2)s1	ZINC000161427686	565284385	/nfs/dbraw/zinc/28/43/85/565284385.db2.gz	JEMNYYJNQQVUEC-INIZCTEOSA-N	1	1	380.579	3.067	10	70		GGIEMO
NC(=O)C[C@H]1CCCC[N@H+]1Cc1ncc(-c2ccccc2Br)o1	ZINC000159858061	565221030	/nfs/dbraw/zinc/22/10/30/565221030.db2.gz	WMMSUMQHLJOAEP-GFCCVEGCSA-N	1	1	378.270	3.334	10	70		GGIEMO
CC[C@@H]1CN(C(=O)c2c[nH]c3cccc(Br)c23)CC[N@H+]1CCOC	ZINC000160920237	565264412	/nfs/dbraw/zinc/26/44/12/565264412.db2.gz	SISIDCDSRKGKCE-CYBMUJFWSA-N	1	1	394.313	3.113	10	70		GGIEMO
COc1ccc(Br)c(CC(=O)N2CCC[C@@H]2Cn2cc[nH+]c2C)c1	ZINC000160995625	565267590	/nfs/dbraw/zinc/26/75/90/565267590.db2.gz	YJOXFYLCXLDEPB-OAHLLOKOSA-N	1	1	392.297	3.196	10	70		GGIEMO
CC(C)(C)CNC(=O)C(C)(C)[NH2+]Cc1nc2cc(Br)ccc2[nH]1	ZINC000161349522	565282154	/nfs/dbraw/zinc/28/21/54/565282154.db2.gz	IVRBRXOHDIGLJM-UHFFFAOYSA-N	1	1	381.318	3.356	10	70		GGIEMO
CC[N@H+](CCc1nccs1)CC(=O)Nc1cc(OC)c(Cl)cc1OC	ZINC000159366017	565204536	/nfs/dbraw/zinc/20/45/36/565204536.db2.gz	KHSNNOVRHJRYOK-UHFFFAOYSA-N	1	1	383.901	3.317	10	70		GGIEMO
CC[N@@H+](CCc1nccs1)CC(=O)Nc1cc(OC)c(Cl)cc1OC	ZINC000159366017	565204543	/nfs/dbraw/zinc/20/45/43/565204543.db2.gz	KHSNNOVRHJRYOK-UHFFFAOYSA-N	1	1	383.901	3.317	10	70		GGIEMO
CCCOc1c(Br)cc(C[N@H+]2C[C@@H](C(N)=O)CC[C@@H]2C)cc1OC	ZINC000159659148	565213893	/nfs/dbraw/zinc/21/38/93/565213893.db2.gz	DRKJAFVDFHVMHW-JSGCOSHPSA-N	1	1	399.329	3.332	10	70		GGIEMO
CC(C)[N@H+](CCc1nccs1)CC(=O)Nc1ccc(Br)cn1	ZINC000159737815	565216323	/nfs/dbraw/zinc/21/63/23/565216323.db2.gz	UKJOWMZSOCQOLA-UHFFFAOYSA-N	1	1	383.315	3.192	10	70		GGIEMO
CC(C)[N@@H+](CCc1nccs1)CC(=O)Nc1ccc(Br)cn1	ZINC000159737815	565216325	/nfs/dbraw/zinc/21/63/25/565216325.db2.gz	UKJOWMZSOCQOLA-UHFFFAOYSA-N	1	1	383.315	3.192	10	70		GGIEMO
CC[N@H+]1CCCN(C(=O)N[C@@H]2CCOc3ccc(Br)cc32)CC1	ZINC000159739037	565216678	/nfs/dbraw/zinc/21/66/78/565216678.db2.gz	GHCZSKJGPFFWGS-OAHLLOKOSA-N	1	1	382.302	3.010	10	70		GGIEMO
CC(C)[N@@H+](CCc1nccs1)CC(=O)NCCOc1ccc(Cl)cc1	ZINC000159816891	565219324	/nfs/dbraw/zinc/21/93/24/565219324.db2.gz	WXJXCGUNGKLPNC-UHFFFAOYSA-N	1	1	381.929	3.245	10	70		GGIEMO
C[C@@H](CNC(=O)N[C@@H]1CCc2c1ccc(Cl)c2Cl)C[NH+]1CCOCC1	ZINC000159883270	565222993	/nfs/dbraw/zinc/22/29/93/565222993.db2.gz	UZLSTBCZWIZEQV-BLLLJJGKSA-N	1	1	386.323	3.248	10	70		GGIEMO
COc1cc(C(=O)NC[C@H]2CCC[N@H+]2CC(C)C)cc(OC)c1Br	ZINC000160391726	565242539	/nfs/dbraw/zinc/24/25/39/565242539.db2.gz	KERYVHJJNURCFQ-CQSZACIVSA-N	1	1	399.329	3.317	10	70		GGIEMO
C[C@H]([NH2+]CC(=O)NC(=O)NCc1cccs1)c1ccccc1Br	ZINC000160440483	565245735	/nfs/dbraw/zinc/24/57/35/565245735.db2.gz	TVKFCKGDUDZZIE-NSHDSACASA-N	1	1	396.310	3.187	10	70		GGIEMO
Brc1ccc2[nH]c(C[NH+]3CCC(OC[C@H]4CCOC4)CC3)nc2c1	ZINC000161206808	565276157	/nfs/dbraw/zinc/27/61/57/565276157.db2.gz	OAVRBAYRNCJBFK-ZDUSSCGKSA-N	1	1	394.313	3.343	10	70		GGIEMO
Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)Cc1ccc(Br)c(F)c1	ZINC000161360477	565282856	/nfs/dbraw/zinc/28/28/56/565282856.db2.gz	VFYYRAJGYZDVFB-CQSZACIVSA-N	1	1	380.261	3.327	10	70		GGIEMO
O=C(c1ccc(Br)c(C(F)(F)F)c1)N1CC[NH+](C2CC2)CC1	ZINC000159466436	565207095	/nfs/dbraw/zinc/20/70/95/565207095.db2.gz	NJGLXPFMXHWEBK-UHFFFAOYSA-N	1	1	377.204	3.388	10	70		GGIEMO
Cn1cc[nH+]c1CC1CCN(C(=O)Nc2ccc(Br)nc2)CC1	ZINC000159474254	565208255	/nfs/dbraw/zinc/20/82/55/565208255.db2.gz	ZYGYDOAPEQBQNH-UHFFFAOYSA-N	1	1	378.274	3.064	10	70		GGIEMO
C[C@@H]1CC[C@@H](C(N)=O)C[N@@H+]1Cc1ccc(Br)c(Br)c1	ZINC000159576103	565210273	/nfs/dbraw/zinc/21/02/73/565210273.db2.gz	WHTQCMWSTYGYKZ-MWLCHTKSSA-N	1	1	390.119	3.297	10	70		GGIEMO
C[C@@H]1CC[C@@H](C(N)=O)C[N@H+]1Cc1ccc(Br)c(Br)c1	ZINC000159576103	565210276	/nfs/dbraw/zinc/21/02/76/565210276.db2.gz	WHTQCMWSTYGYKZ-MWLCHTKSSA-N	1	1	390.119	3.297	10	70		GGIEMO
CC[N@H+]1CCCN(C(=O)N[C@H]2CCOc3ccc(Br)cc32)CC1	ZINC000159739191	565217001	/nfs/dbraw/zinc/21/70/01/565217001.db2.gz	GHCZSKJGPFFWGS-HNNXBMFYSA-N	1	1	382.302	3.010	10	70		GGIEMO
C[C@H](CNC(=O)N[C@H]1CCc2c1ccc(Cl)c2Cl)C[NH+]1CCOCC1	ZINC000159883663	565222860	/nfs/dbraw/zinc/22/28/60/565222860.db2.gz	UZLSTBCZWIZEQV-WBMJQRKESA-N	1	1	386.323	3.248	10	70		GGIEMO
C[C@@H]1CC[C@@H](C(N)=O)C[N@H+]1Cc1ncc(-c2ccccc2Br)o1	ZINC000160530264	565249225	/nfs/dbraw/zinc/24/92/25/565249225.db2.gz	XYMLLSTXVWOHKB-VXGBXAGGSA-N	1	1	378.270	3.190	10	70		GGIEMO
O=C(CC[NH+]1CCC(c2ccn[nH]2)CC1)Nc1ccc(Br)cc1	ZINC000160653104	565254136	/nfs/dbraw/zinc/25/41/36/565254136.db2.gz	JUPLSVZULKJPBA-UHFFFAOYSA-N	1	1	377.286	3.380	10	70		GGIEMO
O=C(NCCC[NH+]1CCOCC1)NC[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl	ZINC000160642951	565254322	/nfs/dbraw/zinc/25/43/22/565254322.db2.gz	XSWUDBKZJJULCH-XJKSGUPXSA-N	1	1	386.323	3.118	10	70		GGIEMO
COc1ccc(Br)c(CC(=O)N2CCC[C@H]2Cn2cc[nH+]c2C)c1	ZINC000160995505	565267836	/nfs/dbraw/zinc/26/78/36/565267836.db2.gz	YJOXFYLCXLDEPB-HNNXBMFYSA-N	1	1	392.297	3.196	10	70		GGIEMO
Brc1ccc2[nH]c(C[NH+]3CCC(OC[C@@H]4CCOC4)CC3)nc2c1	ZINC000161206700	565276457	/nfs/dbraw/zinc/27/64/57/565276457.db2.gz	OAVRBAYRNCJBFK-CYBMUJFWSA-N	1	1	394.313	3.343	10	70		GGIEMO
CCc1ccc(CN2CC[NH+](C[C@@H](O)COCc3cccs3)CC2)s1	ZINC000161427814	565283899	/nfs/dbraw/zinc/28/38/99/565283899.db2.gz	JEMNYYJNQQVUEC-MRXNPFEDSA-N	1	1	380.579	3.067	10	70		GGIEMO
CCc1ccc(C[NH+]2CCN(C[C@@H](O)COCc3cccs3)CC2)s1	ZINC000161427814	565283905	/nfs/dbraw/zinc/28/39/05/565283905.db2.gz	JEMNYYJNQQVUEC-MRXNPFEDSA-N	1	1	380.579	3.067	10	70		GGIEMO
C[C@H]1CC[C@H](C(N)=O)C[N@@H+]1Cc1ccc(Br)c(Br)c1	ZINC000159576031	565209960	/nfs/dbraw/zinc/20/99/60/565209960.db2.gz	WHTQCMWSTYGYKZ-ONGXEEELSA-N	1	1	390.119	3.297	10	70		GGIEMO
C[C@H]1CC[C@H](C(N)=O)C[N@H+]1Cc1ccc(Br)c(Br)c1	ZINC000159576031	565209965	/nfs/dbraw/zinc/20/99/65/565209965.db2.gz	WHTQCMWSTYGYKZ-ONGXEEELSA-N	1	1	390.119	3.297	10	70		GGIEMO
C[C@H]1CC[C@@H](C(N)=O)C[N@@H+]1Cc1ccc(Br)c(Br)c1	ZINC000159576230	565210603	/nfs/dbraw/zinc/21/06/03/565210603.db2.gz	WHTQCMWSTYGYKZ-GXSJLCMTSA-N	1	1	390.119	3.297	10	70		GGIEMO
C[C@H]1CC[C@@H](C(N)=O)C[N@H+]1Cc1ccc(Br)c(Br)c1	ZINC000159576230	565210606	/nfs/dbraw/zinc/21/06/06/565210606.db2.gz	WHTQCMWSTYGYKZ-GXSJLCMTSA-N	1	1	390.119	3.297	10	70		GGIEMO
C[C@H](CNC(=O)N[C@@H]1CCc2c1ccc(Cl)c2Cl)C[NH+]1CCOCC1	ZINC000159883402	565222881	/nfs/dbraw/zinc/22/28/81/565222881.db2.gz	UZLSTBCZWIZEQV-MLGOLLRUSA-N	1	1	386.323	3.248	10	70		GGIEMO
C[C@H]1CC[C@H](C(N)=O)C[N@H+]1Cc1ncc(-c2ccccc2Br)o1	ZINC000160530128	565249801	/nfs/dbraw/zinc/24/98/01/565249801.db2.gz	XYMLLSTXVWOHKB-RYUDHWBXSA-N	1	1	378.270	3.190	10	70		GGIEMO
OCCn1nccc1C1CC[NH+](Cc2ccc(F)c(Br)c2)CC1	ZINC000160561189	565250252	/nfs/dbraw/zinc/25/02/52/565250252.db2.gz	OOARADSLVYBMHB-UHFFFAOYSA-N	1	1	382.277	3.157	10	70		GGIEMO
COc1ccc(Br)c(CC(=O)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1	ZINC000160752838	565258351	/nfs/dbraw/zinc/25/83/51/565258351.db2.gz	HGHLODOBOXNEBP-GOOCMWNKSA-N	1	1	381.314	3.132	10	70		GGIEMO
Cc1ccc(NC(=O)N2CCC(Cc3[nH+]ccn3C)CC2)c(Br)n1	ZINC000159516326	565209260	/nfs/dbraw/zinc/20/92/60/565209260.db2.gz	GQNNTVHEMKEQOI-UHFFFAOYSA-N	1	1	392.301	3.373	10	70		GGIEMO
CCOC(=O)c1ccsc1NC(=O)C[N@H+](CCc1nccs1)C(C)C	ZINC000159733531	565216578	/nfs/dbraw/zinc/21/65/78/565216578.db2.gz	JQPSJMPTMNOHML-UHFFFAOYSA-N	1	1	381.523	3.273	10	70		GGIEMO
CCOC(=O)c1ccsc1NC(=O)C[N@@H+](CCc1nccs1)C(C)C	ZINC000159733531	565216583	/nfs/dbraw/zinc/21/65/83/565216583.db2.gz	JQPSJMPTMNOHML-UHFFFAOYSA-N	1	1	381.523	3.273	10	70		GGIEMO
COCCCOC1CC[NH+](Cc2nc3cc(Br)ccc3[nH]2)CC1	ZINC000159802433	565219395	/nfs/dbraw/zinc/21/93/95/565219395.db2.gz	UZRZKGDKEGMZGJ-UHFFFAOYSA-N	1	1	382.302	3.343	10	70		GGIEMO
NC(=O)C[C@@H]1CCCC[N@H+]1Cc1ncc(-c2ccccc2Br)o1	ZINC000159858192	565220972	/nfs/dbraw/zinc/22/09/72/565220972.db2.gz	WMMSUMQHLJOAEP-LBPRGKRZSA-N	1	1	378.270	3.334	10	70		GGIEMO
C[C@H]1CC[C@@H](C(N)=O)C[N@H+]1Cc1ncc(-c2ccccc2Br)o1	ZINC000160530440	565248936	/nfs/dbraw/zinc/24/89/36/565248936.db2.gz	XYMLLSTXVWOHKB-NWDGAFQWSA-N	1	1	378.270	3.190	10	70		GGIEMO
OCCn1nccc1C1CC[NH+](Cc2cc(Br)ccc2F)CC1	ZINC000160559928	565250898	/nfs/dbraw/zinc/25/08/98/565250898.db2.gz	WFDIDNAJYWGSFS-UHFFFAOYSA-N	1	1	382.277	3.157	10	70		GGIEMO
COc1c(Br)c(C)sc1C(=O)N[C@H]1C[N@H+](C(C)C)C[C@@H]1C	ZINC000161393613	565284222	/nfs/dbraw/zinc/28/42/22/565284222.db2.gz	CLFPIGZHGZMRTP-ONGXEEELSA-N	1	1	375.332	3.286	10	70		GGIEMO
Cn1cc[nH+]c1CC1CCN(C(=O)Nc2cccnc2Br)CC1	ZINC000159505404	565208377	/nfs/dbraw/zinc/20/83/77/565208377.db2.gz	AIVUUURQXYCKMC-UHFFFAOYSA-N	1	1	378.274	3.064	10	70		GGIEMO
Cc1nn(-c2ccc(Br)cc2)cc1C[N@@H+]1C[C@@H](C(N)=O)CC[C@@H]1C	ZINC000159528192	565208995	/nfs/dbraw/zinc/20/89/95/565208995.db2.gz	ZBYXTUSANXAXOJ-JSGCOSHPSA-N	1	1	391.313	3.029	10	70		GGIEMO
Cc1nn(-c2ccc(Br)cc2)cc1C[N@@H+]1C[C@H](C(N)=O)CC[C@@H]1C	ZINC000159528056	565209539	/nfs/dbraw/zinc/20/95/39/565209539.db2.gz	ZBYXTUSANXAXOJ-GXTWGEPZSA-N	1	1	391.313	3.029	10	70		GGIEMO
C[C@@H]1CC[C@H](C(N)=O)C[N@@H+]1Cc1ccc(Br)c(Br)c1	ZINC000159575937	565210570	/nfs/dbraw/zinc/21/05/70/565210570.db2.gz	WHTQCMWSTYGYKZ-KOLCDFICSA-N	1	1	390.119	3.297	10	70		GGIEMO
C[C@@H]1CC[C@H](C(N)=O)C[N@H+]1Cc1ccc(Br)c(Br)c1	ZINC000159575937	565210573	/nfs/dbraw/zinc/21/05/73/565210573.db2.gz	WHTQCMWSTYGYKZ-KOLCDFICSA-N	1	1	390.119	3.297	10	70		GGIEMO
CC(C)[N@@H+](CCCOc1ccc(S(C)(=O)=O)cc1)CCc1nccs1	ZINC000159858698	565221497	/nfs/dbraw/zinc/22/14/97/565221497.db2.gz	RKORSDKCTZVIQJ-UHFFFAOYSA-N	1	1	382.551	3.269	10	70		GGIEMO
COc1ccc(Cl)cc1CNC(=O)C[N@@H+](CCc1nccs1)C(C)C	ZINC000159903611	565223642	/nfs/dbraw/zinc/22/36/42/565223642.db2.gz	BEAZSSWBDCFGDU-UHFFFAOYSA-N	1	1	381.929	3.374	10	70		GGIEMO
CCOCC[N@@H+]1CCN(C(=O)c2c[nH]c3cccc(Br)c23)C[C@H]1C	ZINC000160881686	565262957	/nfs/dbraw/zinc/26/29/57/565262957.db2.gz	UHTNRKNVHJWFGO-CYBMUJFWSA-N	1	1	394.313	3.113	10	70		GGIEMO
CCOCC[N@H+]1CCN(C(=O)c2c[nH]c3cccc(Br)c23)C[C@H]1C	ZINC000160881686	565262961	/nfs/dbraw/zinc/26/29/61/565262961.db2.gz	UHTNRKNVHJWFGO-CYBMUJFWSA-N	1	1	394.313	3.113	10	70		GGIEMO
CCCOc1c(Br)cc(C[N@H+]2C[C@H](C(N)=O)CC[C@@H]2C)cc1OC	ZINC000159659025	565213966	/nfs/dbraw/zinc/21/39/66/565213966.db2.gz	DRKJAFVDFHVMHW-GXTWGEPZSA-N	1	1	399.329	3.332	10	70		GGIEMO
CC(C)[N@@H+](CCc1nccs1)CC(=O)NCCOc1cccc(Cl)c1	ZINC000159800252	565219508	/nfs/dbraw/zinc/21/95/08/565219508.db2.gz	VJHDAMCIUSLQET-UHFFFAOYSA-N	1	1	381.929	3.245	10	70		GGIEMO
C[C@@H](CNC(=O)N[C@H]1CCc2c1ccc(Cl)c2Cl)C[NH+]1CCOCC1	ZINC000159883535	565222156	/nfs/dbraw/zinc/22/21/56/565222156.db2.gz	UZLSTBCZWIZEQV-LRDDRELGSA-N	1	1	386.323	3.248	10	70		GGIEMO
COc1ccc(Br)cc1C[NH+]1CCC(c2ccnn2CCO)CC1	ZINC000160555741	565250494	/nfs/dbraw/zinc/25/04/94/565250494.db2.gz	MAJMYDNMHZBEFR-UHFFFAOYSA-N	1	1	394.313	3.026	10	70		GGIEMO
OCCn1nccc1C1CC[NH+](Cc2ccc(Br)cc2F)CC1	ZINC000160558378	565250750	/nfs/dbraw/zinc/25/07/50/565250750.db2.gz	VARSNLSHHAZFJS-UHFFFAOYSA-N	1	1	382.277	3.157	10	70		GGIEMO
C[C@H](C(=O)Nc1cccc(Br)c1)[N@H+]1CC[C@]2(O)CCCC[C@@H]2C1	ZINC000160637215	565254648	/nfs/dbraw/zinc/25/46/48/565254648.db2.gz	XUPYBKYLZOYUFF-HBUWYVDXSA-N	1	1	381.314	3.403	10	70		GGIEMO
CCOCC[N@@H+]1CCN(C(=O)c2c[nH]c3cccc(Br)c23)C[C@@H]1C	ZINC000160881540	565263189	/nfs/dbraw/zinc/26/31/89/565263189.db2.gz	UHTNRKNVHJWFGO-ZDUSSCGKSA-N	1	1	394.313	3.113	10	70		GGIEMO
CCOCC[N@H+]1CCN(C(=O)c2c[nH]c3cccc(Br)c23)C[C@@H]1C	ZINC000160881540	565263194	/nfs/dbraw/zinc/26/31/94/565263194.db2.gz	UHTNRKNVHJWFGO-ZDUSSCGKSA-N	1	1	394.313	3.113	10	70		GGIEMO
COCC[N@@H+]1CCN(C(=O)Nc2ccc(Br)c(Cl)c2)C[C@H]1C	ZINC000161236203	565278129	/nfs/dbraw/zinc/27/81/29/565278129.db2.gz	IPUGFQFKQFMGIZ-LLVKDONJSA-N	1	1	390.709	3.287	10	70		GGIEMO
COCC[N@H+]1CCN(C(=O)Nc2ccc(Br)c(Cl)c2)C[C@H]1C	ZINC000161236203	565278135	/nfs/dbraw/zinc/27/81/35/565278135.db2.gz	IPUGFQFKQFMGIZ-LLVKDONJSA-N	1	1	390.709	3.287	10	70		GGIEMO