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(Cl)C[NH+](C)[C@@H]1CC[N@H+](C)[C@@H](C)C1	ZINC000098018528	538717214	/nfs/dbraw/zinc/71/72/14/538717214.db2.gz	OFHVCSRHKIZOJZ-WDEREUQCSA-N	2	2	216.756	2.153	50	30		BEEALP
C=C(Cl)C[NH+](C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1	ZINC000098018528	538717219	/nfs/dbraw/zinc/71/72/19/538717219.db2.gz	OFHVCSRHKIZOJZ-WDEREUQCSA-N	2	2	216.756	2.153	50	30		BEEALP
C=C(Cl)C[N@@H+](C)[C@@H]1CC[NH+](C)[C@@H](C)C1	ZINC000098018528	538717225	/nfs/dbraw/zinc/71/72/25/538717225.db2.gz	OFHVCSRHKIZOJZ-WDEREUQCSA-N	2	2	216.756	2.153	50	30		BEEALP
C=C(Cl)C[N@H+](C)[C@@H]1CC[NH+](C)[C@@H](C)C1	ZINC000098018528	538717230	/nfs/dbraw/zinc/71/72/30/538717230.db2.gz	OFHVCSRHKIZOJZ-WDEREUQCSA-N	2	2	216.756	2.153	50	30		BEEALP
C=C(Cl)C[NH+]1CC[C@H](C[N@H+](C)CC2CC2)C1	ZINC000096447066	518649553	/nfs/dbraw/zinc/64/95/53/518649553.db2.gz	UHADGZYLTXVIGG-CYBMUJFWSA-N	2	2	242.794	2.403	50	30		BEEALP
C=C(Cl)C[NH+]1CC[C@H](C[N@@H+](C)CC2CC2)C1	ZINC000096447066	518649557	/nfs/dbraw/zinc/64/95/57/518649557.db2.gz	UHADGZYLTXVIGG-CYBMUJFWSA-N	2	2	242.794	2.403	50	30		BEEALP
C=C(Cl)C[N@H+]1CC[C@H](C[NH+](C)CC2CC2)C1	ZINC000096447066	518649565	/nfs/dbraw/zinc/64/95/65/518649565.db2.gz	UHADGZYLTXVIGG-CYBMUJFWSA-N	2	2	242.794	2.403	50	30		BEEALP
C=C(Cl)C[N@@H+]1CC[C@H](C[NH+](C)CC2CC2)C1	ZINC000096447066	518649571	/nfs/dbraw/zinc/64/95/71/518649571.db2.gz	UHADGZYLTXVIGG-CYBMUJFWSA-N	2	2	242.794	2.403	50	30		BEEALP
CC[NH+](CC)CC/[NH+]=C/c1ccccc1	ZINC000114362022	370555286	/nfs/dbraw/zinc/55/52/86/370555286.db2.gz	KNXHVZBUZZDYDF-WYMLVPIESA-N	2	2	204.317	2.447	50	30		BEEALP
C=C(C)C[N@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1	ZINC000095427827	388769236	/nfs/dbraw/zinc/76/92/36/388769236.db2.gz	SGSVPYISZDNOOP-CYBMUJFWSA-N	2	2	233.359	2.251	50	30		BEEALP
C=C(C)C[N@@H+]1CCC[C@H](Cc2[nH+]ccn2C)C1	ZINC000095427827	388769239	/nfs/dbraw/zinc/76/92/39/388769239.db2.gz	SGSVPYISZDNOOP-CYBMUJFWSA-N	2	2	233.359	2.251	50	30		BEEALP
C[C@H](C[NH2+][C@@H]1CCC[C@H](C#N)C1)[NH+]1CCCC1	ZINC000952877777	974057110	/nfs/dbraw/zinc/05/71/10/974057110.db2.gz	VLRGCKHEPJDIDZ-HZSPNIEDSA-N	2	2	235.375	2.143	50	30		BEEALP
C=CCC1([NH2+]Cc2ccco2)CC[NH+](C)CC1	ZINC000000211875	187244511	/nfs/dbraw/zinc/24/45/11/187244511.db2.gz	QJYMSTNDVJLCEE-UHFFFAOYSA-N	2	2	234.343	2.410	50	30		BEEALP
CC[NH+](CC)CC/[NH+]=C/c1ccc(OC)cc1	ZINC000002167577	356365516	/nfs/dbraw/zinc/36/55/16/356365516.db2.gz	JFHZNIWFTKKGNA-NTCAYCPXSA-N	2	2	234.343	2.456	50	30		BEEALP
C[C@H](CC#N)[N@@H+]1CC[C@@H](CNc2cccc[nH+]2)C1	ZINC000222200103	386043836	/nfs/dbraw/zinc/04/38/36/386043836.db2.gz	YYTHCYZDZCZJND-OLZOCXBDSA-N	2	2	244.342	2.118	50	30		BEEALP
C[C@H](CC#N)[N@H+]1CC[C@@H](CNc2cccc[nH+]2)C1	ZINC000222200103	386043843	/nfs/dbraw/zinc/04/38/43/386043843.db2.gz	YYTHCYZDZCZJND-OLZOCXBDSA-N	2	2	244.342	2.118	50	30		BEEALP
C=CC[NH+]1CCC([NH2+]C2CCSCC2)CC1	ZINC000089893978	166351901	/nfs/dbraw/zinc/35/19/01/166351901.db2.gz	JXYNOKRSHNSNBD-UHFFFAOYSA-N	2	2	240.416	2.122	50	30		BEEALP
C=CC[NH2+][C@H]1CC[N@@H+](Cc2ccccn2)C[C@H]1C	ZINC000097103763	491125127	/nfs/dbraw/zinc/12/51/27/491125127.db2.gz	DALGVJGGVHEDMY-HIFRSBDPSA-N	2	2	245.370	2.068	50	30		BEEALP
C=CC[NH2+][C@H]1CC[N@H+](Cc2ccccn2)C[C@H]1C	ZINC000097103763	491125128	/nfs/dbraw/zinc/12/51/28/491125128.db2.gz	DALGVJGGVHEDMY-HIFRSBDPSA-N	2	2	245.370	2.068	50	30		BEEALP
C=C(Cl)C[NH+](C)[C@H]1CC[N@H+](C)[C@H](C)C1	ZINC000098018529	538715654	/nfs/dbraw/zinc/71/56/54/538715654.db2.gz	OFHVCSRHKIZOJZ-MNOVXSKESA-N	2	2	216.756	2.153	50	30		BEEALP
C=C(Cl)C[NH+](C)[C@H]1CC[N@@H+](C)[C@H](C)C1	ZINC000098018529	538715667	/nfs/dbraw/zinc/71/56/67/538715667.db2.gz	OFHVCSRHKIZOJZ-MNOVXSKESA-N	2	2	216.756	2.153	50	30		BEEALP
C=C(Cl)C[N@@H+](C)[C@H]1CC[NH+](C)[C@H](C)C1	ZINC000098018529	538715674	/nfs/dbraw/zinc/71/56/74/538715674.db2.gz	OFHVCSRHKIZOJZ-MNOVXSKESA-N	2	2	216.756	2.153	50	30		BEEALP
C=C(Cl)C[N@H+](C)[C@H]1CC[NH+](C)[C@H](C)C1	ZINC000098018529	538715682	/nfs/dbraw/zinc/71/56/82/538715682.db2.gz	OFHVCSRHKIZOJZ-MNOVXSKESA-N	2	2	216.756	2.153	50	30		BEEALP
N#CC[C@@H](C1CC1)[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1	ZINC000095996066	388801244	/nfs/dbraw/zinc/80/12/44/388801244.db2.gz	WJQXSBRRNZYITM-HIFRSBDPSA-N	2	2	247.386	2.096	50	30		BEEALP
N#CC[C@@H](C1CC1)[N@H+]1CC[C@H](C[NH+]2CCCC2)C1	ZINC000095996066	388801248	/nfs/dbraw/zinc/80/12/48/388801248.db2.gz	WJQXSBRRNZYITM-HIFRSBDPSA-N	2	2	247.386	2.096	50	30		BEEALP
C=C(C)C[N@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1	ZINC000095427828	388768797	/nfs/dbraw/zinc/76/87/97/388768797.db2.gz	SGSVPYISZDNOOP-ZDUSSCGKSA-N	2	2	233.359	2.251	50	30		BEEALP
C=C(C)C[N@@H+]1CCC[C@@H](Cc2[nH+]ccn2C)C1	ZINC000095427828	388768799	/nfs/dbraw/zinc/76/87/99/388768799.db2.gz	SGSVPYISZDNOOP-ZDUSSCGKSA-N	2	2	233.359	2.251	50	30		BEEALP
C[C@H](C[NH2+][C@H]1CCC[C@@H](C#N)C1)[NH+]1CCCC1	ZINC000952877778	974055383	/nfs/dbraw/zinc/05/53/83/974055383.db2.gz	VLRGCKHEPJDIDZ-MCIONIFRSA-N	2	2	235.375	2.143	50	30		BEEALP
C[C@H](C[NH2+][C@H]1CCC[C@H](C#N)C1)[NH+]1CCCC1	ZINC000952877780	974057645	/nfs/dbraw/zinc/05/76/45/974057645.db2.gz	VLRGCKHEPJDIDZ-RDBSUJKOSA-N	2	2	235.375	2.143	50	30		BEEALP
C=C(Cl)C[NH+](C)[C@@H]1CC[N@H+](C)[C@H](C)C1	ZINC000098018527	538114817	/nfs/dbraw/zinc/11/48/17/538114817.db2.gz	OFHVCSRHKIZOJZ-GHMZBOCLSA-N	2	2	216.756	2.153	50	30		BEEALP
C=C(Cl)C[NH+](C)[C@@H]1CC[N@@H+](C)[C@H](C)C1	ZINC000098018527	538114818	/nfs/dbraw/zinc/11/48/18/538114818.db2.gz	OFHVCSRHKIZOJZ-GHMZBOCLSA-N	2	2	216.756	2.153	50	30		BEEALP
C=C(Cl)C[N@@H+](C)[C@@H]1CC[NH+](C)[C@H](C)C1	ZINC000098018527	538114819	/nfs/dbraw/zinc/11/48/19/538114819.db2.gz	OFHVCSRHKIZOJZ-GHMZBOCLSA-N	2	2	216.756	2.153	50	30		BEEALP
C=C(Cl)C[N@H+](C)[C@@H]1CC[NH+](C)[C@H](C)C1	ZINC000098018527	538114820	/nfs/dbraw/zinc/11/48/20/538114820.db2.gz	OFHVCSRHKIZOJZ-GHMZBOCLSA-N	2	2	216.756	2.153	50	30		BEEALP
C[C@@H](CC#N)[N@@H+]1CC[C@H](CNc2cccc[nH+]2)C1	ZINC000097200709	384705084	/nfs/dbraw/zinc/70/50/84/384705084.db2.gz	YYTHCYZDZCZJND-QWHCGFSZSA-N	2	2	244.342	2.118	50	30		BEEALP
C[C@@H](CC#N)[N@H+]1CC[C@H](CNc2cccc[nH+]2)C1	ZINC000097200709	384705095	/nfs/dbraw/zinc/70/50/95/384705095.db2.gz	YYTHCYZDZCZJND-QWHCGFSZSA-N	2	2	244.342	2.118	50	30		BEEALP
C=CC[NH+]1CCC([NH+]2CCCCC2)CC1	ZINC000052003415	166352555	/nfs/dbraw/zinc/35/25/55/166352555.db2.gz	KXYMUBRXZXKHJX-UHFFFAOYSA-N	2	2	208.349	2.123	50	30		BEEALP
C[C@H](C[NH2+][C@@H]1CCC[C@@H](C#N)C1)[NH+]1CCCC1	ZINC000952877779	974059199	/nfs/dbraw/zinc/05/91/99/974059199.db2.gz	VLRGCKHEPJDIDZ-MGPQQGTHSA-N	2	2	235.375	2.143	50	30		BEEALP
N#CC[C@H](C1CC1)[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1	ZINC000221748169	181046478	/nfs/dbraw/zinc/04/64/78/181046478.db2.gz	WJQXSBRRNZYITM-DZGCQCFKSA-N	2	2	247.386	2.096	50	30		BEEALP
N#CC[C@H](C1CC1)[N@H+]1CC[C@@H](C[NH+]2CCCC2)C1	ZINC000221748169	181046480	/nfs/dbraw/zinc/04/64/80/181046480.db2.gz	WJQXSBRRNZYITM-DZGCQCFKSA-N	2	2	247.386	2.096	50	30		BEEALP
C=C(Cl)C[NH+](C)[C@H]1CC[N@H+](C)[C@@H](C)C1	ZINC000098018530	538715966	/nfs/dbraw/zinc/71/59/66/538715966.db2.gz	OFHVCSRHKIZOJZ-QWRGUYRKSA-N	2	2	216.756	2.153	50	30		BEEALP
C=C(Cl)C[NH+](C)[C@H]1CC[N@@H+](C)[C@@H](C)C1	ZINC000098018530	538715974	/nfs/dbraw/zinc/71/59/74/538715974.db2.gz	OFHVCSRHKIZOJZ-QWRGUYRKSA-N	2	2	216.756	2.153	50	30		BEEALP
C=C(Cl)C[N@@H+](C)[C@H]1CC[NH+](C)[C@@H](C)C1	ZINC000098018530	538715979	/nfs/dbraw/zinc/71/59/79/538715979.db2.gz	OFHVCSRHKIZOJZ-QWRGUYRKSA-N	2	2	216.756	2.153	50	30		BEEALP
C=C(Cl)C[N@H+](C)[C@H]1CC[NH+](C)[C@@H](C)C1	ZINC000098018530	538715982	/nfs/dbraw/zinc/71/59/82/538715982.db2.gz	OFHVCSRHKIZOJZ-QWRGUYRKSA-N	2	2	216.756	2.153	50	30		BEEALP
CC[NH+]1CCC([NH2+]Cc2cccc(C#N)c2)CC1	ZINC000037979041	360878640	/nfs/dbraw/zinc/87/86/40/360878640.db2.gz	JWEVRCHDJUNXQU-UHFFFAOYSA-N	2	2	243.354	2.132	50	30		BEEALP
C=CC[NH2+][C@@H]1CC[N@@H+](Cc2ccccn2)C[C@@H]1C	ZINC000195572768	347647792	/nfs/dbraw/zinc/64/77/92/347647792.db2.gz	DALGVJGGVHEDMY-DZGCQCFKSA-N	2	2	245.370	2.068	50	30		BEEALP
C=CC[NH2+][C@@H]1CC[N@H+](Cc2ccccn2)C[C@@H]1C	ZINC000195572768	347647797	/nfs/dbraw/zinc/64/77/97/347647797.db2.gz	DALGVJGGVHEDMY-DZGCQCFKSA-N	2	2	245.370	2.068	50	30		BEEALP
C=C(Cl)C[NH+]1CC[C@H](C[N@@H+](C)CCC)C1	ZINC000096452801	188188325	/nfs/dbraw/zinc/18/83/25/188188325.db2.gz	UZZROWZDMFPBLE-GFCCVEGCSA-N	2	2	230.783	2.403	50	30		BEEALP
C=C(Cl)C[NH+]1CC[C@H](C[N@H+](C)CCC)C1	ZINC000096452801	188188327	/nfs/dbraw/zinc/18/83/27/188188327.db2.gz	UZZROWZDMFPBLE-GFCCVEGCSA-N	2	2	230.783	2.403	50	30		BEEALP
C=C(Cl)C[N@H+]1CC[C@H](C[NH+](C)CCC)C1	ZINC000096452801	188188328	/nfs/dbraw/zinc/18/83/28/188188328.db2.gz	UZZROWZDMFPBLE-GFCCVEGCSA-N	2	2	230.783	2.403	50	30		BEEALP
C=C(Cl)C[N@@H+]1CC[C@H](C[NH+](C)CCC)C1	ZINC000096452801	188188330	/nfs/dbraw/zinc/18/83/30/188188330.db2.gz	UZZROWZDMFPBLE-GFCCVEGCSA-N	2	2	230.783	2.403	50	30		BEEALP
C=C(Cl)C[NH+]1CC[C@@H](C[N@H+](C)CC2CC2)C1	ZINC000096447065	518649011	/nfs/dbraw/zinc/64/90/11/518649011.db2.gz	UHADGZYLTXVIGG-ZDUSSCGKSA-N	2	2	242.794	2.403	50	30		BEEALP
C=C(Cl)C[NH+]1CC[C@@H](C[N@@H+](C)CC2CC2)C1	ZINC000096447065	518649018	/nfs/dbraw/zinc/64/90/18/518649018.db2.gz	UHADGZYLTXVIGG-ZDUSSCGKSA-N	2	2	242.794	2.403	50	30		BEEALP
C=C(Cl)C[N@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1	ZINC000096447065	518649026	/nfs/dbraw/zinc/64/90/26/518649026.db2.gz	UHADGZYLTXVIGG-ZDUSSCGKSA-N	2	2	242.794	2.403	50	30		BEEALP
C=C(Cl)C[N@@H+]1CC[C@@H](C[NH+](C)CC2CC2)C1	ZINC000096447065	518649030	/nfs/dbraw/zinc/64/90/30/518649030.db2.gz	UHADGZYLTXVIGG-ZDUSSCGKSA-N	2	2	242.794	2.403	50	30		BEEALP
N#CC[C@H](C1CC1)[N@@H+]1CC[C@H](C[NH+]2CCCC2)C1	ZINC000108331673	411144394	/nfs/dbraw/zinc/14/43/94/411144394.db2.gz	WJQXSBRRNZYITM-UKRRQHHQSA-N	2	2	247.386	2.096	50	30		BEEALP
N#CC[C@H](C1CC1)[N@H+]1CC[C@H](C[NH+]2CCCC2)C1	ZINC000108331673	411144395	/nfs/dbraw/zinc/14/43/95/411144395.db2.gz	WJQXSBRRNZYITM-UKRRQHHQSA-N	2	2	247.386	2.096	50	30		BEEALP
C=CCOc1ccc(C[N@@H+](C)[C@H](C)C[NH3+])cc1	ZINC000097162645	188224455	/nfs/dbraw/zinc/22/44/55/188224455.db2.gz	VQVYZGKSYHFDEC-GFCCVEGCSA-N	2	2	234.343	2.030	50	30		BEEALP
C=CCOc1ccc(C[N@H+](C)[C@H](C)C[NH3+])cc1	ZINC000097162645	188224458	/nfs/dbraw/zinc/22/44/58/188224458.db2.gz	VQVYZGKSYHFDEC-GFCCVEGCSA-N	2	2	234.343	2.030	50	30		BEEALP
C[C@@H](CC#N)[N@@H+]1CC[C@@H](CNc2cccc[nH+]2)C1	ZINC000222200037	386044719	/nfs/dbraw/zinc/04/47/19/386044719.db2.gz	YYTHCYZDZCZJND-STQMWFEESA-N	2	2	244.342	2.118	50	30		BEEALP
C[C@@H](CC#N)[N@H+]1CC[C@@H](CNc2cccc[nH+]2)C1	ZINC000222200037	386044726	/nfs/dbraw/zinc/04/47/26/386044726.db2.gz	YYTHCYZDZCZJND-STQMWFEESA-N	2	2	244.342	2.118	50	30		BEEALP
C=CC[NH2+][C@H]1CC[N@@H+](Cc2ccccn2)C[C@@H]1C	ZINC000097103764	491125121	/nfs/dbraw/zinc/12/51/21/491125121.db2.gz	DALGVJGGVHEDMY-ZFWWWQNUSA-N	2	2	245.370	2.068	50	30		BEEALP
C=CC[NH2+][C@H]1CC[N@H+](Cc2ccccn2)C[C@@H]1C	ZINC000097103764	491125122	/nfs/dbraw/zinc/12/51/22/491125122.db2.gz	DALGVJGGVHEDMY-ZFWWWQNUSA-N	2	2	245.370	2.068	50	30		BEEALP
[NH2+]=C1NC(=[NH+]c2ccccc2)c2ccccc21	ZINC000013114112	181337682	/nfs/dbraw/zinc/33/76/82/181337682.db2.gz	LTBKHBIPKHIHLF-UHFFFAOYSA-N	2	2	221.263	2.484	50	30		BEEALP
N#CC[C@@H](C1CC1)[N@@H+]1CC[C@@H](C[NH+]2CCCC2)C1	ZINC000095996065	388802151	/nfs/dbraw/zinc/80/21/51/388802151.db2.gz	WJQXSBRRNZYITM-ZFWWWQNUSA-N	2	2	247.386	2.096	50	30		BEEALP
N#CC[C@@H](C1CC1)[N@H+]1CC[C@@H](C[NH+]2CCCC2)C1	ZINC000095996065	388802155	/nfs/dbraw/zinc/80/21/55/388802155.db2.gz	WJQXSBRRNZYITM-ZFWWWQNUSA-N	2	2	247.386	2.096	50	30		BEEALP
C=CC[NH2+][C@@H]1CC[N@@H+](Cc2ccccn2)C[C@H]1C	ZINC000249173714	345467235	/nfs/dbraw/zinc/46/72/35/345467235.db2.gz	DALGVJGGVHEDMY-UKRRQHHQSA-N	2	2	245.370	2.068	50	30		BEEALP
C=CC[NH2+][C@@H]1CC[N@H+](Cc2ccccn2)C[C@H]1C	ZINC000249173714	345467238	/nfs/dbraw/zinc/46/72/38/345467238.db2.gz	DALGVJGGVHEDMY-UKRRQHHQSA-N	2	2	245.370	2.068	50	30		BEEALP
C=CC[NH+]1CCC([NH2+][C@H](C)c2cccnc2)CC1	ZINC000092746976	166352768	/nfs/dbraw/zinc/35/27/68/166352768.db2.gz	GFBUJNLXZPKGQI-CYBMUJFWSA-N	2	2	245.370	2.383	50	30		BEEALP
C=CC[NH+]1CCC([NH2+][C@@H](C)c2cccnc2)CC1	ZINC000092746971	166353388	/nfs/dbraw/zinc/35/33/88/166353388.db2.gz	GFBUJNLXZPKGQI-ZDUSSCGKSA-N	2	2	245.370	2.383	50	30		BEEALP
C=CCOc1ccc(C[N@@H+](C)[C@@H](C)C[NH3+])cc1	ZINC000097162644	490326057	/nfs/dbraw/zinc/32/60/57/490326057.db2.gz	VQVYZGKSYHFDEC-LBPRGKRZSA-N	2	2	234.343	2.030	50	30		BEEALP
C=CCOc1ccc(C[N@H+](C)[C@@H](C)C[NH3+])cc1	ZINC000097162644	490326060	/nfs/dbraw/zinc/32/60/60/490326060.db2.gz	VQVYZGKSYHFDEC-LBPRGKRZSA-N	2	2	234.343	2.030	50	30		BEEALP
C=C(Cl)C[NH+]1CC[C@@H](C[N@@H+](C)CCC)C1	ZINC000096452800	385175412	/nfs/dbraw/zinc/17/54/12/385175412.db2.gz	UZZROWZDMFPBLE-LBPRGKRZSA-N	2	2	230.783	2.403	50	30		BEEALP
C=C(Cl)C[NH+]1CC[C@@H](C[N@H+](C)CCC)C1	ZINC000096452800	385175415	/nfs/dbraw/zinc/17/54/15/385175415.db2.gz	UZZROWZDMFPBLE-LBPRGKRZSA-N	2	2	230.783	2.403	50	30		BEEALP
C=C(Cl)C[N@H+]1CC[C@@H](C[NH+](C)CCC)C1	ZINC000096452800	385175419	/nfs/dbraw/zinc/17/54/19/385175419.db2.gz	UZZROWZDMFPBLE-LBPRGKRZSA-N	2	2	230.783	2.403	50	30		BEEALP
C=C(Cl)C[N@@H+]1CC[C@@H](C[NH+](C)CCC)C1	ZINC000096452800	385175423	/nfs/dbraw/zinc/17/54/23/385175423.db2.gz	UZZROWZDMFPBLE-LBPRGKRZSA-N	2	2	230.783	2.403	50	30		BEEALP
C[C@H](CC#N)[N@@H+]1CC[C@H](CNc2cccc[nH+]2)C1	ZINC000097200710	384705267	/nfs/dbraw/zinc/70/52/67/384705267.db2.gz	YYTHCYZDZCZJND-CHWSQXEVSA-N	2	2	244.342	2.118	50	30		BEEALP
C[C@H](CC#N)[N@H+]1CC[C@H](CNc2cccc[nH+]2)C1	ZINC000097200710	384705273	/nfs/dbraw/zinc/70/52/73/384705273.db2.gz	YYTHCYZDZCZJND-CHWSQXEVSA-N	2	2	244.342	2.118	50	30		BEEALP
C/C(=[NH+]\CCCn1cc[nH+]c1)c1ccccc1O	ZINC000146786914	518457170	/nfs/dbraw/zinc/45/71/70/518457170.db2.gz	BGTHDSHMCWHVSX-FOWTUZBSSA-N	2	2	243.310	2.488	50	30		BEEALP