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](NC(=O)N1CCC[C@H]([NH+]2CCCC2)CC1)C(=O)N1CCCCC1	ZINC000160356604	326962504	/nfs/dbraw/zinc/96/25/04/326962504.db2.gz	SWKMQAKBHKCYRQ-IRXDYDNUSA-N	1	0	350.507	2.047	10	70		FEIERO
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)C(=O)c1cnn(-c2ccccc2)c1	ZINC000160370906	546033729	/nfs/dbraw/zinc/03/37/29/546033729.db2.gz	ATPVFZMQUHJJLM-GOSISDBHSA-N	1	0	354.454	2.292	10	70		FEIERO
CC(C)[C@H](O)CC(=O)Nc1ccc(C(=O)N(C)[C@H]2CCC[N@H+](C)C2)cc1	ZINC000160855769	546079317	/nfs/dbraw/zinc/07/93/17/546079317.db2.gz	IDYBMVSVZHAMOX-ZWKOTPCHSA-N	1	0	361.486	2.198	10	70		FEIERO
O=C(COc1cc(Cl)cc(Cl)c1)NC[C@H](O)C[NH+]1CCCCC1	ZINC000159962820	326948822	/nfs/dbraw/zinc/94/88/22/326948822.db2.gz	DDDLNYSJXFFGGY-AWEZNQCLSA-N	1	0	361.269	2.335	10	70		FEIERO
O=C(NC[C@@H](O)C[NH+]1CCCCC1)c1cc(Oc2ccccc2)ccn1	ZINC000160111777	546009174	/nfs/dbraw/zinc/00/91/74/546009174.db2.gz	QDOPMLMNGZAFIE-MRXNPFEDSA-N	1	0	355.438	2.451	10	70		FEIERO
CC[C@@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)NCc1cn(C)nc1C(F)(F)F	ZINC000160887350	546081089	/nfs/dbraw/zinc/08/10/89/546081089.db2.gz	UPUSFEYGUANIFV-CHWSQXEVSA-N	1	0	359.396	2.207	10	70		FEIERO
COC(=O)c1ccc2[nH]cc(C(=O)CN3C[C@H]4CCC[N@@H+]4C[C@@H]3C)c2c1	ZINC000161111153	546100776	/nfs/dbraw/zinc/10/07/76/546100776.db2.gz	QVAHXYPPJKLNHR-DZGCQCFKSA-N	1	0	355.438	2.306	10	70		FEIERO
C[C@H](NC(=O)[C@H](C)N1CCN(Cc2ccncc2)CC1)c1ccccc1	ZINC000161181825	546107472	/nfs/dbraw/zinc/10/74/72/546107472.db2.gz	KJEICUJBCZOYAC-ROUUACIJSA-N	1	0	352.482	2.465	10	70		FEIERO
CCC[C@H](C(=O)N1CCN(Cc2cc(OC)ccc2OC)CC1)[NH+](C)C	ZINC000161441015	546129495	/nfs/dbraw/zinc/12/94/95/546129495.db2.gz	CDTRWPFRXDRRIC-GOSISDBHSA-N	1	0	363.502	2.078	10	70		FEIERO
Cc1cc(OCC(=O)NC[C@H](O)C[NH+]2CCCCC2)cc(C)c1Cl	ZINC000160577298	546053688	/nfs/dbraw/zinc/05/36/88/546053688.db2.gz	WZEMTLGYHVDIOF-HNNXBMFYSA-N	1	0	354.878	2.299	10	70		FEIERO
O=C(CC[N@@H+]1C[C@@H](O)C[C@H]1c1cccc(C(F)(F)F)c1)N1CCOCC1	ZINC000161061364	546097327	/nfs/dbraw/zinc/09/73/27/546097327.db2.gz	QDAAFIWTWFJXAH-HOTGVXAUSA-N	1	0	372.387	2.062	10	70		FEIERO
CC[NH+](CC)CCN(Cc1ccccc1)C(=O)N[C@H]1CCc2ncnn2C1	ZINC000161082530	546098759	/nfs/dbraw/zinc/09/87/59/546098759.db2.gz	GWZHCZMRYSNLRG-SFHVURJKSA-N	1	0	370.501	2.147	10	70		FEIERO
CCOCC[N@@H+]1CCN(C(=O)N[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)C[C@@H]1CC	ZINC000161157163	546104921	/nfs/dbraw/zinc/10/49/21/546104921.db2.gz	ACRLNJAAMWEBSL-FJIDUMEYSA-N	1	0	365.518	2.086	10	70		FEIERO
CCS(=O)(=O)c1cccc(CC(=O)NC[C@H]2CCC[N@@H+]2CC(C)C)c1	ZINC000161342225	546121413	/nfs/dbraw/zinc/12/14/13/546121413.db2.gz	PVYWMZFQGOHBQM-QGZVFWFLSA-N	1	0	366.527	2.259	10	70		FEIERO
C[NH+](C)C[C@H]1CN(C(=O)c2c[nH]c3cccc(Br)c23)CCO1	ZINC000160445795	326965885	/nfs/dbraw/zinc/96/58/85/326965885.db2.gz	OUQCPSVCTXKXML-NSHDSACASA-N	1	0	366.259	2.333	10	70		FEIERO
O=C(Nc1ccccc1)[C@H](Cc1ccccc1)NC(=O)[C@H]1CCC[NH2+]C1	ZINC000159506909	545959479	/nfs/dbraw/zinc/95/94/79/545959479.db2.gz	IKKHPUUPHWXOPS-HKUYNNGSSA-N	1	0	351.450	2.352	10	70		FEIERO
C[C@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)NCCc1nnc(-c2ccccc2)o1	ZINC000159845189	545985539	/nfs/dbraw/zinc/98/55/39/545985539.db2.gz	NLUQBXNGWRXPBV-GOEBONIOSA-N	1	0	355.442	2.157	10	70		FEIERO
COc1ccccc1[C@H](NC(=O)N1CCO[C@@H](C[NH+](C)C)C1)c1ccco1	ZINC000160658489	546059861	/nfs/dbraw/zinc/05/98/61/546059861.db2.gz	GQJVEEQDEOJUAP-KXBFYZLASA-N	1	0	373.453	2.350	10	70		FEIERO
CC(C)c1nc2n(n1)C[C@H](NC(=O)N1CCC(CC[NH+](C)C)CC1)CC2	ZINC000161416911	546127890	/nfs/dbraw/zinc/12/78/90/546127890.db2.gz	AOQKZNACGSHNTF-MRXNPFEDSA-N	1	0	362.522	2.090	10	70		FEIERO
C[NH+](C)C[C@H](NC(=O)CCCNC(=O)c1cccnc1)c1ccccc1	ZINC000160257532	326959482	/nfs/dbraw/zinc/95/94/82/326959482.db2.gz	KBZPEBZAFAJKTP-SFHVURJKSA-N	1	0	354.454	2.011	10	70		FEIERO
CC(C)c1nc2n(n1)C[C@@H](NC(=O)N[C@@H](CC[NH+](C)C)C(C)(C)C)CC2	ZINC000160220676	546019394	/nfs/dbraw/zinc/01/93/94/546019394.db2.gz	BGBGYIXCUHOQRA-GJZGRUSLSA-N	1	0	364.538	2.382	10	70		FEIERO
Cc1cnn(Cc2cc(C(=O)N[C@H](C[NH+](C)C)c3ccccc3)no2)c1	ZINC000160543500	546050501	/nfs/dbraw/zinc/05/05/01/546050501.db2.gz	KVIFXEDKMONLNF-GOSISDBHSA-N	1	0	353.426	2.261	10	70		FEIERO
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)CCc1nc(-c2ccccn2)no1	ZINC000160553758	546051206	/nfs/dbraw/zinc/05/12/06/546051206.db2.gz	VDZMKTWAGOHWDN-OAHLLOKOSA-N	1	0	357.458	2.301	10	70		FEIERO
CC[NH+](CC)CCN(Cc1ccccc1)C(=O)N[C@@H]1CCc2ncnn2C1	ZINC000161082432	546097979	/nfs/dbraw/zinc/09/79/79/546097979.db2.gz	GWZHCZMRYSNLRG-GOSISDBHSA-N	1	0	370.501	2.147	10	70		FEIERO
CC(C)[N@@H+]1C[C@@H](C)[C@@H](NC(=O)[C@@H](c2ccccc2F)N2CCOCC2)C1	ZINC000161176210	546107106	/nfs/dbraw/zinc/10/71/06/546107106.db2.gz	NAAIKEAUUYRQIX-AYOQOUSVSA-N	1	0	363.477	2.044	10	70		FEIERO
O=C(NC[C@H](O)C[NH+]1CCCCC1)c1csc(-c2cccs2)n1	ZINC000160099568	326953253	/nfs/dbraw/zinc/95/32/53/326953253.db2.gz	BQFXWMAXWZPXTO-LBPRGKRZSA-N	1	0	351.497	2.448	10	70		FEIERO
Cc1nc2cc(=O)[nH]n2c(C)c1CCC(=O)N[C@H](CC(C)C)C[NH+](C)C	ZINC000161230567	326992499	/nfs/dbraw/zinc/99/24/99/326992499.db2.gz	ROVFGKICLODNTC-OAHLLOKOSA-N	1	0	361.490	2.077	10	70		FEIERO
Cc1cc(Cl)ccc1O[C@@H](C)C(=O)NC[C@@H](O)C[NH+]1CCCCC1	ZINC000160081124	546005108	/nfs/dbraw/zinc/00/51/08/546005108.db2.gz	GXLKHWARRICKAH-GOEBONIOSA-N	1	0	354.878	2.379	10	70		FEIERO
COC(=O)c1ccccc1N(C)C(=O)C[N@@H+]1CC[C@]2(O)CCCC[C@@H]2C1	ZINC000161051292	546095885	/nfs/dbraw/zinc/09/58/85/546095885.db2.gz	ALZMBXVHLHZUSV-FOIQADDNSA-N	1	0	360.454	2.063	10	70		FEIERO
[NH3+]C[C@H]1CCCN1C(=O)[C@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1	ZINC000160391877	326964022	/nfs/dbraw/zinc/96/40/22/326964022.db2.gz	YMUVCCSODRZFEJ-GXFFZTMASA-N	1	0	356.253	2.296	10	70		FEIERO
CC(C)c1nc2n(n1)C[C@@H](NC(=O)NCCC[NH2+]C1CCCCC1)CC2	ZINC000161377408	326997655	/nfs/dbraw/zinc/99/76/55/326997655.db2.gz	GQDOCKVLAJNHJO-INIZCTEOSA-N	1	0	362.522	2.328	10	70		FEIERO
CCC(=O)Nc1ccc(S(=O)(=O)NC[C@H]2CCC[N@@H+]2CC(C)C)cc1	ZINC000160292044	546026846	/nfs/dbraw/zinc/02/68/46/546026846.db2.gz	AMUALDGNVAVLPN-MRXNPFEDSA-N	1	0	367.515	2.434	10	70		FEIERO
CC[N@@H+]1CCC[C@H](NC(=O)C(=O)Nc2cc(C)ccc2-n2cc(C)cn2)C1	ZINC000160683793	546062198	/nfs/dbraw/zinc/06/21/98/546062198.db2.gz	RMWVWRSQTHCBQO-INIZCTEOSA-N	1	0	369.469	2.028	10	70		FEIERO
CC[N@@H+]1CCC[C@@H](NC(=O)C(=O)Nc2cc(C)ccc2-n2cc(C)cn2)C1	ZINC000160683934	546062464	/nfs/dbraw/zinc/06/24/64/546062464.db2.gz	RMWVWRSQTHCBQO-MRXNPFEDSA-N	1	0	369.469	2.028	10	70		FEIERO
COC(=O)[C@H](CNC(=O)[C@H]1CCC[NH2+]C1)Cc1ccc2ccccc2c1	ZINC000160054776	546003000	/nfs/dbraw/zinc/00/30/00/546003000.db2.gz	GVMNGZSSDONQOD-OALUTQOASA-N	1	0	354.450	2.287	10	70		FEIERO
CC(=O)Nc1cc(S(=O)(=O)NC[C@H]2CCC[N@H+]2CC(C)C)ccc1F	ZINC000160288393	546027482	/nfs/dbraw/zinc/02/74/82/546027482.db2.gz	KPOHABADPLFUTK-CQSZACIVSA-N	1	0	371.478	2.183	10	70		FEIERO
CC[C@@H]1CCCC[N@@H+]1CCNC(=O)N[C@@H]1CCc2nc(C(C)C)nn2C1	ZINC000160438827	546040742	/nfs/dbraw/zinc/04/07/42/546040742.db2.gz	DSXBHCBDSBBAGX-HZPDHXFCSA-N	1	0	362.522	2.280	10	70		FEIERO
CC[N@@H+]1CCC[C@H]1CN(C)[C@H](C(N)=O)c1cccc(Br)c1	ZINC000160466628	546043339	/nfs/dbraw/zinc/04/33/39/546043339.db2.gz	HGFGZGRAQRRIIO-GJZGRUSLSA-N	1	0	354.292	2.392	10	70		FEIERO
CCOc1ccc(C(=O)NCC(=O)NC[C@H]2CCC[N@@H+]2CC(C)C)cc1	ZINC000160512027	546048098	/nfs/dbraw/zinc/04/80/98/546048098.db2.gz	LBWSZIRETIZBRL-QGZVFWFLSA-N	1	0	361.486	2.052	10	70		FEIERO
CC(C)[C@@H](O)CC(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCC[N@H+](C)C2)cc1	ZINC000160855638	546078636	/nfs/dbraw/zinc/07/86/36/546078636.db2.gz	IDYBMVSVZHAMOX-MSOLQXFVSA-N	1	0	361.486	2.198	10	70		FEIERO
O=C(NC1CC[NH+](Cc2ccccn2)CC1)N1CC[C@@]2(O)CCCC[C@H]2C1	ZINC000161037847	546094864	/nfs/dbraw/zinc/09/48/64/546094864.db2.gz	JAEHSTSXIFIGHH-UWJYYQICSA-N	1	0	372.513	2.383	10	70		FEIERO
CCCNC(=O)NC(=O)CN1C[C@H](O)C[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000161145878	546104220	/nfs/dbraw/zinc/10/42/20/546104220.db2.gz	QMWIBFLGWGGSHO-ZIAGYGMSSA-N	1	0	373.375	2.049	10	70		FEIERO
C[C@H](c1ccncc1)[NH+]1CCC(NC(=O)NC[C@@H]2CCCC[C@@H]2O)CC1	ZINC000161247203	546114025	/nfs/dbraw/zinc/11/40/25/546114025.db2.gz	OAVSJWZHHCDTAF-AYBZRNKSSA-N	1	0	360.502	2.457	10	70		FEIERO
CCC[C@@H](C(=O)Nc1cccc(S(=O)(=O)NC(C)(C)C)c1)[NH+](C)C	ZINC000161261501	326993454	/nfs/dbraw/zinc/99/34/54/326993454.db2.gz	KIUBHZSGGSLQBF-HNNXBMFYSA-N	1	0	355.504	2.432	10	70		FEIERO
O=C(NCc1cccc(-c2ccccn2)c1)NC[C@@H](O)C[NH+]1CCCCC1	ZINC000160342459	546031895	/nfs/dbraw/zinc/03/18/95/546031895.db2.gz	DBCHFSCJIXQUEX-LJQANCHMSA-N	1	0	368.481	2.395	10	70		FEIERO
CCOCc1ccc(CNC(=O)C[N@@H+]2CC[C@]3(O)CCCC[C@@H]3C2)cc1	ZINC000160496717	546047195	/nfs/dbraw/zinc/04/71/95/546047195.db2.gz	HQGOYBKGQVHXIS-TZIWHRDSSA-N	1	0	360.498	2.466	10	70		FEIERO
O=C(CCc1ccc(OC(F)(F)F)cc1)NC[C@@H](O)C[NH+]1CCCCC1	ZINC000160562295	546052331	/nfs/dbraw/zinc/05/23/31/546052331.db2.gz	ZEVQZLRCPSPJNB-OAHLLOKOSA-N	1	0	374.403	2.481	10	70		FEIERO
CC[NH2+]CC1CCN(C(=O)[C@@H](NC(=O)c2ccccc2F)C(C)C)CC1	ZINC000161034806	546094935	/nfs/dbraw/zinc/09/49/35/546094935.db2.gz	NIVSPURGEZSQLH-SFHVURJKSA-N	1	0	363.477	2.428	10	70		FEIERO
O=C(NC1CC[NH+](Cc2ccccn2)CC1)N1CC[C@]2(O)CCCC[C@@H]2C1	ZINC000161037469	546095198	/nfs/dbraw/zinc/09/51/98/546095198.db2.gz	JAEHSTSXIFIGHH-DYESRHJHSA-N	1	0	372.513	2.383	10	70		FEIERO
CC(C)c1nc2n(n1)C[C@@H](NC(=O)N1CCC(CC[NH+](C)C)CC1)CC2	ZINC000161417010	546128321	/nfs/dbraw/zinc/12/83/21/546128321.db2.gz	AOQKZNACGSHNTF-INIZCTEOSA-N	1	0	362.522	2.090	10	70		FEIERO
COC(=O)c1c(F)cccc1S(=O)(=O)NC[C@H]1CCC[N@@H+]1CC(C)C	ZINC000160295401	546026634	/nfs/dbraw/zinc/02/66/34/546026634.db2.gz	BECOCFHKCIFEDP-CYBMUJFWSA-N	1	0	372.462	2.011	10	70		FEIERO
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)COc1cccc(N2CCCC2=O)c1	ZINC000160478534	546044632	/nfs/dbraw/zinc/04/46/32/546044632.db2.gz	HQNISCKCLWZJMG-GOSISDBHSA-N	1	0	373.497	2.429	10	70		FEIERO
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)Cc1csc(N2CCCC2=O)n1	ZINC000160562218	546051985	/nfs/dbraw/zinc/05/19/85/546051985.db2.gz	OORUUNFIAXCYFM-OAHLLOKOSA-N	1	0	364.515	2.049	10	70		FEIERO
Cn1nccc1C1CC[NH+](CCC(=O)NC(=O)Nc2ccccc2)CC1	ZINC000160624449	546057752	/nfs/dbraw/zinc/05/77/52/546057752.db2.gz	WFXAHBZULGJZHX-UHFFFAOYSA-N	1	0	355.442	2.338	10	70		FEIERO
CC(C)[C@@H](O)CC(=O)Nc1ccc(C(=O)N(C)[C@H]2CCC[N@H+](C)C2)cc1	ZINC000160855883	546078610	/nfs/dbraw/zinc/07/86/10/546078610.db2.gz	IDYBMVSVZHAMOX-ROUUACIJSA-N	1	0	361.486	2.198	10	70		FEIERO
CC(C)c1nn(C)c(N2CCOCC2)c1C[NH2+][C@@H]1CCOC(C)(C)C1	ZINC000160480658	326967267	/nfs/dbraw/zinc/96/72/67/326967267.db2.gz	RWMANVIMOUEXTI-OAHLLOKOSA-N	1	0	350.507	2.427	10	70		FEIERO
Cc1ccccc1[C@H](C)[NH2+][C@@H](C)C(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000159420405	545951916	/nfs/dbraw/zinc/95/19/16/545951916.db2.gz	VQLGXHTTZYSRCU-KBPBESRZSA-N	1	0	361.467	2.320	10	70		FEIERO
Cc1ccccc1[C@@H](C)[NH2+][C@H](C)C(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000159420542	545952335	/nfs/dbraw/zinc/95/23/35/545952335.db2.gz	VQLGXHTTZYSRCU-ZIAGYGMSSA-N	1	0	361.467	2.320	10	70		FEIERO
CC(=O)NC1CCC([NH2+]C[C@@H](c2ccc(C)s2)N2CCOCC2)CC1	ZINC000161441774	546129894	/nfs/dbraw/zinc/12/98/94/546129894.db2.gz	LZRSORVERKJKJL-ABHNRTSZSA-N	1	0	365.543	2.467	10	70		FEIERO
O=C(NC[C@H](O)C[NH+]1CCCCC1)c1ccnc(OCc2ccccc2)c1	ZINC000160640843	326972381	/nfs/dbraw/zinc/97/23/81/326972381.db2.gz	GMKYCJTVDHZADU-IBGZPJMESA-N	1	0	369.465	2.237	10	70		FEIERO
O=C(COc1ccc(Cl)c(Cl)c1)NC[C@@H](O)C[NH+]1CCCCC1	ZINC000160396705	546036077	/nfs/dbraw/zinc/03/60/77/546036077.db2.gz	ZJVALNXCEUEFBJ-GFCCVEGCSA-N	1	0	361.269	2.335	10	70		FEIERO
[NH3+]C[C@@H]1CCCN1C(=O)[C@@H]1CC(=O)N(c2cc(Cl)cc(Cl)c2)C1	ZINC000160392013	326963972	/nfs/dbraw/zinc/96/39/72/326963972.db2.gz	YMUVCCSODRZFEJ-MFKMUULPSA-N	1	0	356.253	2.296	10	70		FEIERO
Cn1cnc2cc(C(=O)NCC3([NH+]4CCSCC4)CCCCC3)cnc21	ZINC000160483664	326967195	/nfs/dbraw/zinc/96/71/95/326967195.db2.gz	IAHCEKCIHKYELI-UHFFFAOYSA-N	1	0	373.526	2.450	10	70		FEIERO
C[N@H+](CCN1CCn2c(nnc2C(F)(F)F)C1)Cc1ccc(F)cc1	ZINC000159786569	545980620	/nfs/dbraw/zinc/98/06/20/545980620.db2.gz	VFUDWSRRGSPFOF-UHFFFAOYSA-N	1	0	357.355	2.384	10	70		FEIERO
Cc1ccc(CNC(=O)NCC(=O)NC[C@H]2CCC[N@H+]2CC(C)C)cc1	ZINC000160412104	546038297	/nfs/dbraw/zinc/03/82/97/546038297.db2.gz	OLUPISHRXIMCOK-GOSISDBHSA-N	1	0	360.502	2.031	10	70		FEIERO
COC(=O)[C@@H](CNC(=O)[C@H]1CCC[NH2+]C1)Cc1ccc2ccccc2c1	ZINC000160054887	326951706	/nfs/dbraw/zinc/95/17/06/326951706.db2.gz	GVMNGZSSDONQOD-RBUKOAKNSA-N	1	0	354.450	2.287	10	70		FEIERO
Cc1ccc(C(=O)NC[C@@H](O)C[NH+]2CCCCC2)cc1Br	ZINC000160347483	326962380	/nfs/dbraw/zinc/96/23/80/326962380.db2.gz	QCTRFWFKVORUQD-CQSZACIVSA-N	1	0	355.276	2.334	10	70		FEIERO
Cc1cc(O[C@H](C)C(=O)NC[C@H](O)C[NH+]2CCCCC2)ccc1Cl	ZINC000160371079	546034451	/nfs/dbraw/zinc/03/44/51/546034451.db2.gz	VDTKAWDFXGRJBY-CABCVRRESA-N	1	0	354.878	2.379	10	70		FEIERO
CCOCC[N@@H+]1CCN(C(=O)N[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)C[C@H]1CC	ZINC000161157021	546104934	/nfs/dbraw/zinc/10/49/34/546104934.db2.gz	ACRLNJAAMWEBSL-XDNAFOTISA-N	1	0	365.518	2.086	10	70		FEIERO
O=C(NC[C@@H](O)C[NH+]1CCCCC1)c1cc(-c2ccccc2Cl)n[nH]1	ZINC000160378309	326963365	/nfs/dbraw/zinc/96/33/65/326963365.db2.gz	SSNCTJGUBNITLV-CYBMUJFWSA-N	1	0	362.861	2.307	10	70		FEIERO
C[NH+](C)C[C@@H](NC(=O)CCCNC(=O)c1cccnc1)c1ccccc1	ZINC000160257650	546022892	/nfs/dbraw/zinc/02/28/92/546022892.db2.gz	KBZPEBZAFAJKTP-GOSISDBHSA-N	1	0	354.454	2.011	10	70		FEIERO
COC(=O)c1ccccc1N(C)C(=O)C[N@@H+]1CC[C@@]2(O)CCCC[C@@H]2C1	ZINC000161051422	546095722	/nfs/dbraw/zinc/09/57/22/546095722.db2.gz	ALZMBXVHLHZUSV-QRWLVFNGSA-N	1	0	360.454	2.063	10	70		FEIERO
CCC[C@H](C(=O)NC[C@H](c1ccc(F)cc1)N1CCOCC1)[NH+](C)C	ZINC000161229673	546111639	/nfs/dbraw/zinc/11/16/39/546111639.db2.gz	OLUPSBQVGGZKNW-QZTJIDSGSA-N	1	0	351.466	2.046	10	70		FEIERO
CCC[C@@H](C(=O)NC[C@@H](c1ccc(F)cc1)N1CCOCC1)[NH+](C)C	ZINC000161229316	326992529	/nfs/dbraw/zinc/99/25/29/326992529.db2.gz	OLUPSBQVGGZKNW-ROUUACIJSA-N	1	0	351.466	2.046	10	70		FEIERO
O=C(N[C@@H]1CCCn2ncnc21)N1CCC(CCC[NH+]2CCCC2)CC1	ZINC000159539005	545961175	/nfs/dbraw/zinc/96/11/75/545961175.db2.gz	PBIJPLJZXFIBHA-QGZVFWFLSA-N	1	0	360.506	2.411	10	70		FEIERO
CC(C)n1cc(Br)cc1C(=O)NC[C@@H](O)C[NH+]1CCCCC1	ZINC000160060045	546004733	/nfs/dbraw/zinc/00/47/33/546004733.db2.gz	GIHBXDVKDMJFTP-CQSZACIVSA-N	1	0	372.307	2.408	10	70		FEIERO
CC[NH+](CC)[C@@H](C)CNC(=O)C(=O)Nc1cc(C)ccc1-n1cc(C)cn1	ZINC000160169746	546013575	/nfs/dbraw/zinc/01/35/75/546013575.db2.gz	WZVXEJKYAYOLFX-INIZCTEOSA-N	1	0	371.485	2.274	10	70		FEIERO
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)CCn1cnc2sccc2c1=O	ZINC000160421910	546039561	/nfs/dbraw/zinc/03/95/61/546039561.db2.gz	XTMSEDFVIOBLGD-CQSZACIVSA-N	1	0	362.499	2.085	10	70		FEIERO
C[NH+](C)[C@H]1CCN(C(=O)C(=O)Nc2ccc(Sc3ccncc3)cc2)C1	ZINC000161013108	546092402	/nfs/dbraw/zinc/09/24/02/546092402.db2.gz	UKKSWLJZDPUVAL-HNNXBMFYSA-N	1	0	370.478	2.334	10	70		FEIERO
CNC(=O)C[NH+]1CCC(CN(C)c2ccnc3c(F)cc(F)cc23)CC1	ZINC000159578723	326935613	/nfs/dbraw/zinc/93/56/13/326935613.db2.gz	VYOMPVJTXPLSBN-UHFFFAOYSA-N	1	0	362.424	2.407	10	70		FEIERO
C[NH+](C)C[C@@H]1CN(C(=O)c2c[nH]c3cccc(Br)c23)CCO1	ZINC000160445661	326965942	/nfs/dbraw/zinc/96/59/42/326965942.db2.gz	OUQCPSVCTXKXML-LLVKDONJSA-N	1	0	366.259	2.333	10	70		FEIERO
CCC[C@@H](C(=O)N1CCN(Cc2ccc(OC)c(F)c2)CC1)[NH+](C)C	ZINC000161267024	326993716	/nfs/dbraw/zinc/99/37/16/326993716.db2.gz	CWPAHMBTVYVOBR-KRWDZBQOSA-N	1	0	351.466	2.209	10	70		FEIERO
CC(C)[N@H+]1C[C@H](NC(=O)NCCc2nnc(-c3ccccc3)o2)[C@@H](C)C1	ZINC000159595468	545965368	/nfs/dbraw/zinc/96/53/68/545965368.db2.gz	YIPDONVOFDVTOO-HOCLYGCPSA-N	1	0	357.458	2.307	10	70		FEIERO
C[C@H](NC(=O)NCc1cccc(C[NH+](C)C)c1)c1nnc2n1CCCC2	ZINC000159903431	545990290	/nfs/dbraw/zinc/99/02/90/545990290.db2.gz	AOYXUMJLNBXXQD-AWEZNQCLSA-N	1	0	356.474	2.236	10	70		FEIERO
NC(=O)[C@@H]1CCC[N@@H+]1C1CCN(c2ccnc3c(F)cc(F)cc23)CC1	ZINC000160062485	546004239	/nfs/dbraw/zinc/00/42/39/546004239.db2.gz	PBDPFZRGJNLOLQ-KRWDZBQOSA-N	1	0	360.408	2.432	10	70		FEIERO
Cc1cc(OCC(=O)NC[C@@H](O)C[NH+]2CCCCC2)cc(C)c1Cl	ZINC000160577449	326970190	/nfs/dbraw/zinc/97/01/90/326970190.db2.gz	WZEMTLGYHVDIOF-OAHLLOKOSA-N	1	0	354.878	2.299	10	70		FEIERO
Cc1ccc(C)c(CC(=O)NC[C@H](O)C[N@@H+]2CCc3ccccc3C2)c1	ZINC000159375441	545948067	/nfs/dbraw/zinc/94/80/67/545948067.db2.gz	MQFIZJYJKAXUEN-NRFANRHFSA-N	1	0	352.478	2.381	10	70		FEIERO
CCN(C(=O)NCCn1cc(C)cn1)[C@@H]1CC[N@H+](Cc2ccccc2)C1	ZINC000160275884	546026000	/nfs/dbraw/zinc/02/60/00/546026000.db2.gz	HWKGDZOJRRQYKQ-LJQANCHMSA-N	1	0	355.486	2.498	10	70		FEIERO
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)CN1C(=O)CSc2ccccc21	ZINC000160530023	546048989	/nfs/dbraw/zinc/04/89/89/546048989.db2.gz	AXPCMAVPCYSZPS-OAHLLOKOSA-N	1	0	361.511	2.362	10	70		FEIERO
Cc1ccc(-n2cnnn2)cc1NC(=O)NC[C@H]1CCC[N@H+]1CC(C)C	ZINC000159926551	545992582	/nfs/dbraw/zinc/99/25/82/545992582.db2.gz	QPBVNNFTKNWJRO-MRXNPFEDSA-N	1	0	357.462	2.213	10	70		FEIERO
O=C(COc1cc(Cl)cc(Cl)c1)NC[C@@H](O)C[NH+]1CCCCC1	ZINC000159962937	545996315	/nfs/dbraw/zinc/99/63/15/545996315.db2.gz	DDDLNYSJXFFGGY-CQSZACIVSA-N	1	0	361.269	2.335	10	70		FEIERO
C[N@@H+]1CCC[C@H]1C(=O)N1CCN(c2ccnc3c(F)cc(F)cc23)CC1	ZINC000160001677	545999984	/nfs/dbraw/zinc/99/99/84/545999984.db2.gz	MGNIBPRGDWOAPE-KRWDZBQOSA-N	1	0	360.408	2.256	10	70		FEIERO
C[C@@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)c1ccccc1CSc1nc[nH]n1	ZINC000160265305	546024989	/nfs/dbraw/zinc/02/49/89/546024989.db2.gz	QUOYCOMQIQVLAD-UKRRQHHQSA-N	1	0	357.483	2.406	10	70		FEIERO
O=C(C[N@@H+]1CC[C@]2(O)CCCC[C@@H]2C1)NCCCOC1CCCCC1	ZINC000161152340	546105326	/nfs/dbraw/zinc/10/53/26/546105326.db2.gz	ZAMBINSUXCYJGO-YLJYHZDGSA-N	1	0	352.519	2.469	10	70		FEIERO
CC(C)(Oc1ccc(Cl)cc1)C(=O)NC[C@@H](O)C[NH+]1CCCCC1	ZINC000160053447	326951600	/nfs/dbraw/zinc/95/16/00/326951600.db2.gz	WQSHBXMMXKLZFV-OAHLLOKOSA-N	1	0	354.878	2.460	10	70		FEIERO
CC(C)c1nn(C)c(N2CCOCC2)c1C[NH2+][C@H]1CCOC(C)(C)C1	ZINC000160480774	546045291	/nfs/dbraw/zinc/04/52/91/546045291.db2.gz	RWMANVIMOUEXTI-HNNXBMFYSA-N	1	0	350.507	2.427	10	70		FEIERO
CCC[C@H](C(=O)N1CCN(Cc2ccc(OC)c(F)c2)CC1)[NH+](C)C	ZINC000161267146	546115483	/nfs/dbraw/zinc/11/54/83/546115483.db2.gz	CWPAHMBTVYVOBR-QGZVFWFLSA-N	1	0	351.466	2.209	10	70		FEIERO
Cc1ccccc1[C@@H](C)[NH2+][C@@H](C)C(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000159420268	545952166	/nfs/dbraw/zinc/95/21/66/545952166.db2.gz	VQLGXHTTZYSRCU-KGLIPLIRSA-N	1	0	361.467	2.320	10	70		FEIERO
C[C@@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)NCCc1nnc(-c2ccccc2)o1	ZINC000159845074	545984924	/nfs/dbraw/zinc/98/49/24/545984924.db2.gz	NLUQBXNGWRXPBV-GDBMZVCRSA-N	1	0	355.442	2.157	10	70		FEIERO
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)[C@@H]1CCCN(C(=O)c2ccncc2)C1	ZINC000160377740	546034811	/nfs/dbraw/zinc/03/48/11/546034811.db2.gz	YLBSFSZEHCRDPB-RTBURBONSA-N	1	0	372.513	2.170	10	70		FEIERO
COc1ccc(S(=O)(=O)NC[C@H]2CCC[N@@H+]2CC(C)C)cc1OC	ZINC000160277995	546026170	/nfs/dbraw/zinc/02/61/70/546026170.db2.gz	GVICGLAWOCETNG-CQSZACIVSA-N	1	0	356.488	2.103	10	70		FEIERO
O=C(NC[C@H](O)C[NH+]1CCCCC1)c1cc(-c2ccccc2Cl)n[nH]1	ZINC000160378212	546035658	/nfs/dbraw/zinc/03/56/58/546035658.db2.gz	SSNCTJGUBNITLV-ZDUSSCGKSA-N	1	0	362.861	2.307	10	70		FEIERO
Cc1ccccc1[C@H](C)[NH2+][C@H](C)C(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000159420676	326930947	/nfs/dbraw/zinc/93/09/47/326930947.db2.gz	VQLGXHTTZYSRCU-UONOGXRCSA-N	1	0	361.467	2.320	10	70		FEIERO
CC(C)(Oc1cccc(Cl)c1)C(=O)NC[C@H](O)C[NH+]1CCCCC1	ZINC000160514004	326968029	/nfs/dbraw/zinc/96/80/29/326968029.db2.gz	AWELHBBCKGZKIO-HNNXBMFYSA-N	1	0	354.878	2.460	10	70		FEIERO
CCC[C@@H](C(=O)NCc1ccc(S(=O)(=O)N(CC)CC)cc1)[NH+](C)C	ZINC000161272447	326994128	/nfs/dbraw/zinc/99/41/28/326994128.db2.gz	SDPNMSKNTAPPFK-KRWDZBQOSA-N	1	0	369.531	2.064	10	70		FEIERO
O=C(CCc1cccc(F)c1F)NC[C@H](O)C[N@@H+]1CCc2ccccc2C1	ZINC000159373504	545947485	/nfs/dbraw/zinc/94/74/85/545947485.db2.gz	HBZLHMTUYHZDLW-SFHVURJKSA-N	1	0	374.431	2.433	10	70		FEIERO
O=C(N[C@H]1CCCn2ncnc21)N1CCC(CCC[NH+]2CCCC2)CC1	ZINC000159538920	545961709	/nfs/dbraw/zinc/96/17/09/545961709.db2.gz	PBIJPLJZXFIBHA-KRWDZBQOSA-N	1	0	360.506	2.411	10	70		FEIERO
CCN(CC)C(=O)C(=O)Nc1ccnn1[C@@H]1CC[N@H+](Cc2ccccc2)C1	ZINC000160302591	546028884	/nfs/dbraw/zinc/02/88/84/546028884.db2.gz	SCPZPFHEKHPGBA-QGZVFWFLSA-N	1	0	369.469	2.137	10	70		FEIERO
O=C(NC[C@H](O)C[NH+]1CCCCC1)c1ccccc1C(=O)c1ccccc1	ZINC000160597916	546056133	/nfs/dbraw/zinc/05/61/33/546056133.db2.gz	NNORAVOHUIASQE-SFHVURJKSA-N	1	0	366.461	2.494	10	70		FEIERO
CCC[C@H](C(=O)NC[C@@H](c1ccc(F)cc1)N1CCOCC1)[NH+](C)C	ZINC000161229439	326992377	/nfs/dbraw/zinc/99/23/77/326992377.db2.gz	OLUPSBQVGGZKNW-MSOLQXFVSA-N	1	0	351.466	2.046	10	70		FEIERO
COc1cc(F)c(S(=O)(=O)NC[C@H]2CCC[N@@H+]2CC(C)C)cc1OC	ZINC000160312425	546028785	/nfs/dbraw/zinc/02/87/85/546028785.db2.gz	JMPGPVHNMUMLRH-CYBMUJFWSA-N	1	0	374.478	2.242	10	70		FEIERO
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)[C@H](C)n1nnc(-c2ccccc2)n1	ZINC000160376922	546035065	/nfs/dbraw/zinc/03/50/65/546035065.db2.gz	IYFSHSZLIBPPLQ-DOTOQJQBSA-N	1	0	356.474	2.138	10	70		FEIERO
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1	ZINC000160600848	546055567	/nfs/dbraw/zinc/05/55/67/546055567.db2.gz	WEFPCYSAHYYBJN-RTBURBONSA-N	1	0	357.498	2.272	10	70		FEIERO
O=C(CCC(=O)c1ccc2c(c1)CCCC2)NC[C@H](O)C[NH+]1CCCCC1	ZINC000160034418	326951062	/nfs/dbraw/zinc/95/10/62/326951062.db2.gz	YMMYWPYIYWMULN-FQEVSTJZSA-N	1	0	372.509	2.491	10	70		FEIERO
COCCN1CCN(C(=O)N[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)C[C@H]1C	ZINC000160330570	546030445	/nfs/dbraw/zinc/03/04/45/546030445.db2.gz	HBHXTXWRDMQCJW-QWFCFKBJSA-N	1	0	374.529	2.012	10	70		FEIERO
CCOCC[N@@H+]1CCN(C(=O)C[C@@H](C)c2c(C)n[nH]c2C)C[C@H]1CC	ZINC000160433668	546040520	/nfs/dbraw/zinc/04/05/20/546040520.db2.gz	PQCMIJYIOBTSRO-RHSMWYFYSA-N	1	0	350.507	2.479	10	70		FEIERO
CN(CC[NH+]1CCC([C@H](O)c2nccn2C)CC1)Cc1ccc(F)cc1	ZINC000160917814	546084333	/nfs/dbraw/zinc/08/43/33/546084333.db2.gz	MQHKZRPCXDBKSD-IBGZPJMESA-N	1	0	360.477	2.437	10	70		FEIERO
CS(=O)(=O)c1ccc(OCCC[N@@H+]2CC[C@@]3(O)CCCC[C@@H]3C2)cc1	ZINC000161017961	546093002	/nfs/dbraw/zinc/09/30/02/546093002.db2.gz	AUUCHQCHDIFKOL-APWZRJJASA-N	1	0	367.511	2.486	10	70		FEIERO
O=C(CC[N@@H+]1C[C@H](O)C[C@@H]1c1cccc(C(F)(F)F)c1)N1CCOCC1	ZINC000161061725	546097316	/nfs/dbraw/zinc/09/73/16/546097316.db2.gz	QDAAFIWTWFJXAH-HZPDHXFCSA-N	1	0	372.387	2.062	10	70		FEIERO
Cc1nn(C)c(C)c1CN1CCN(CC[N@H+](C)Cc2ccc(F)cc2)CC1	ZINC000159384560	545948784	/nfs/dbraw/zinc/94/87/84/545948784.db2.gz	RGDAZVQTYRVLLT-UHFFFAOYSA-N	1	0	373.520	2.426	10	70		FEIERO
O=C(NCCc1nnc(-c2ccccc2)o1)N1CC[N@@H+]2CCCC[C@H]2C1	ZINC000159846756	545985835	/nfs/dbraw/zinc/98/58/35/545985835.db2.gz	JSCYIEIFLKDEPY-INIZCTEOSA-N	1	0	355.442	2.159	10	70		FEIERO
CCCOc1ccc(C(=O)NC[C@H](O)C[NH+]2CCCCC2)cc1OCC	ZINC000160153673	326955348	/nfs/dbraw/zinc/95/53/48/326955348.db2.gz	HWGYZSLWGWQMAR-KRWDZBQOSA-N	1	0	364.486	2.451	10	70		FEIERO
O=C(NCCc1nnc(-c2ccccc2)o1)N1CC[N@@H+]2CCCC[C@@H]2C1	ZINC000159846583	545986436	/nfs/dbraw/zinc/98/64/36/545986436.db2.gz	JSCYIEIFLKDEPY-MRXNPFEDSA-N	1	0	355.442	2.159	10	70		FEIERO
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)c1cccc(N2C(=O)CCC2=O)c1	ZINC000160567822	546051937	/nfs/dbraw/zinc/05/19/37/546051937.db2.gz	WSLKMDQSZCGLMX-QGZVFWFLSA-N	1	0	357.454	2.190	10	70		FEIERO
CCn1cc(C2CC[NH+]([C@H]3CCCN(c4cnn(C)c4)C3=O)CC2)cn1	ZINC000160058894	326952100	/nfs/dbraw/zinc/95/21/00/326952100.db2.gz	NOPVEJHZJDSUIA-SFHVURJKSA-N	1	0	356.474	2.012	10	70		FEIERO
CC[C@@H](CS(=O)(=O)c1ccccc1)NC(=O)NC[C@H](C)[NH+](CC)CC	ZINC000159597186	545965577	/nfs/dbraw/zinc/96/55/77/545965577.db2.gz	YMSXEWWVIRDEOF-HOTGVXAUSA-N	1	0	369.531	2.268	10	70		FEIERO
C[NH+](C)C[C@@H]1CN(C(=O)NCc2cccc(-c3ccccn3)c2)CCO1	ZINC000160300852	546027406	/nfs/dbraw/zinc/02/74/06/546027406.db2.gz	NVGSWOXVJPBAQX-GOSISDBHSA-N	1	0	354.454	2.221	10	70		FEIERO
CC[C@H](CO)[NH+]1CCN(C[C@H]2CC(c3ccc(Cl)cc3)=NO2)CC1	ZINC000159855516	326944293	/nfs/dbraw/zinc/94/42/93/326944293.db2.gz	LLIVBBJKMIURBQ-IAGOWNOFSA-N	1	0	351.878	2.222	10	70		FEIERO
C[C@@H](O)C[NH+]1CCC(CN(C)C(=O)c2ccncc2Br)CC1	ZINC000159870286	326945154	/nfs/dbraw/zinc/94/51/54/326945154.db2.gz	MVDAEFSWMRCZMU-GFCCVEGCSA-N	1	0	370.291	2.009	10	70		FEIERO
COC(=O)[C@@H](c1cccnc1)N1CCN(Cc2cnn(C(C)(C)C)c2)CC1	ZINC000159951638	545995216	/nfs/dbraw/zinc/99/52/16/545995216.db2.gz	HLMXDUCJWIBCDZ-GOSISDBHSA-N	1	0	371.485	2.065	10	70		FEIERO
COc1cccc(C2(C(=O)NC[C@@H](O)C[NH+]3CCCCC3)CCCC2)c1	ZINC000160242800	546021380	/nfs/dbraw/zinc/02/13/80/546021380.db2.gz	BWCOWZKLGMVEQB-GOSISDBHSA-N	1	0	360.498	2.470	10	70		FEIERO
Cc1cccc2c1ncn(CCC(=O)NC[C@H]1CCC[N@H+]1CC(C)C)c2=O	ZINC000160444873	546042042	/nfs/dbraw/zinc/04/20/42/546042042.db2.gz	BLRRPBDSRVJXKM-QGZVFWFLSA-N	1	0	370.497	2.332	10	70		FEIERO
CC(C)[N@@H+]1C[C@@H](C)[C@@H](NC(=O)C[C@@H]2CN(Cc3ccccc3)CCO2)C1	ZINC000161380425	546124350	/nfs/dbraw/zinc/12/43/50/546124350.db2.gz	DCAWSBTUNCAWJB-RLLQIKCJSA-N	1	0	359.514	2.122	10	70		FEIERO
C[NH+](C)C[C@H]1CN(C(=O)NCc2cccc(-c3ccccn3)c2)CCO1	ZINC000160300982	326961007	/nfs/dbraw/zinc/96/10/07/326961007.db2.gz	NVGSWOXVJPBAQX-SFHVURJKSA-N	1	0	354.454	2.221	10	70		FEIERO
CC(C)[N@@H+]1C[C@@H](C)[C@@H](NC(=O)NCCc2nnc(-c3ccccc3)o2)C1	ZINC000159595338	545965153	/nfs/dbraw/zinc/96/51/53/545965153.db2.gz	YIPDONVOFDVTOO-ZBFHGGJFSA-N	1	0	357.458	2.307	10	70		FEIERO
O=C(NC[C@H](O)C[NH+]1CCCCC1)c1csc(Cc2ccccc2)n1	ZINC000160442909	546041144	/nfs/dbraw/zinc/04/11/44/546041144.db2.gz	INGJCZIULONBCT-INIZCTEOSA-N	1	0	359.495	2.311	10	70		FEIERO
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)[C@H]1CC(=O)N(Cc2ccccc2)C1	ZINC000160601003	546056125	/nfs/dbraw/zinc/05/61/25/546056125.db2.gz	WEFPCYSAHYYBJN-RBUKOAKNSA-N	1	0	357.498	2.272	10	70		FEIERO
CCOC(=O)CN(C(=O)C[N@@H+]1CC[C@]2(O)CCCC[C@@H]2C1)c1ccccc1	ZINC000160984005	546090024	/nfs/dbraw/zinc/09/00/24/546090024.db2.gz	VDVCGMLKOBJVPU-DYESRHJHSA-N	1	0	374.481	2.210	10	70		FEIERO
CC[N@@H+]1CCC[C@@H]1CN(C)[C@H](C(N)=O)c1cccc(Br)c1	ZINC000160466485	546043059	/nfs/dbraw/zinc/04/30/59/546043059.db2.gz	HGFGZGRAQRRIIO-CABCVRRESA-N	1	0	354.292	2.392	10	70		FEIERO
CC(=O)Nc1ccc(OC[C@H](O)C[N@@H+]2CC[C@]3(O)CCCC[C@@H]3C2)cc1	ZINC000160774264	546071711	/nfs/dbraw/zinc/07/17/11/546071711.db2.gz	SLOABCGCXMPQDU-YVWKXTFCSA-N	1	0	362.470	2.012	10	70		FEIERO
CCCc1ccc(S(=O)(=O)N(C)CC2CC[NH+](C[C@H](C)O)CC2)cc1	ZINC000161438075	546129915	/nfs/dbraw/zinc/12/99/15/546129915.db2.gz	PHLZIENXEYSSAI-INIZCTEOSA-N	1	0	368.543	2.352	10	70		FEIERO
CCCOc1ccc(C(=O)NC[C@@H](O)C[NH+]2CCCCC2)cc1OCC	ZINC000160153781	326955362	/nfs/dbraw/zinc/95/53/62/326955362.db2.gz	HWGYZSLWGWQMAR-QGZVFWFLSA-N	1	0	364.486	2.451	10	70		FEIERO
CCC[C@@H](C(=O)NC[C@H](c1ccc(F)cc1)N1CCOCC1)[NH+](C)C	ZINC000161229558	326992536	/nfs/dbraw/zinc/99/25/36/326992536.db2.gz	OLUPSBQVGGZKNW-ZWKOTPCHSA-N	1	0	351.466	2.046	10	70		FEIERO
CC[C@H](CO)[NH+]1CCN(C[C@@H]2CC(c3ccc(Cl)cc3)=NO2)CC1	ZINC000159855318	545986424	/nfs/dbraw/zinc/98/64/24/545986424.db2.gz	LLIVBBJKMIURBQ-SJORKVTESA-N	1	0	351.878	2.222	10	70		FEIERO
C[C@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)c1ccccc1CSc1nc[nH]n1	ZINC000160265438	546024348	/nfs/dbraw/zinc/02/43/48/546024348.db2.gz	QUOYCOMQIQVLAD-DZGCQCFKSA-N	1	0	357.483	2.406	10	70		FEIERO
COCCOc1ccc(S(=O)(=O)NC[C@H]2CCC[N@@H+]2CC(C)C)cc1	ZINC000160308504	546028757	/nfs/dbraw/zinc/02/87/57/546028757.db2.gz	WSBPNWQAAKAAEW-MRXNPFEDSA-N	1	0	370.515	2.111	10	70		FEIERO
Cc1ccc(Cl)c(O[C@@H](C)C(=O)NC[C@H](O)C[NH+]2CCCCC2)c1	ZINC000160491470	546045757	/nfs/dbraw/zinc/04/57/57/546045757.db2.gz	YQYKLMDETQKWCD-GJZGRUSLSA-N	1	0	354.878	2.379	10	70		FEIERO
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)CCCNC(=O)c1ccsc1	ZINC000160591846	546054614	/nfs/dbraw/zinc/05/46/14/546054614.db2.gz	AFKOLVGKKVIIPD-MRXNPFEDSA-N	1	0	351.516	2.495	10	70		FEIERO
O=C(C[N@@H+]1CC[C@@]2(O)CCCC[C@@H]2C1)Nc1cccc(N2CCCC2=O)c1	ZINC000161126086	546103098	/nfs/dbraw/zinc/10/30/98/546103098.db2.gz	AQEQVGNLOMXPFF-IERDGZPVSA-N	1	0	371.481	2.379	10	70		FEIERO
CC(C)n1ncc2cc(C=CC(=O)N[C@H]3C[N@@H+](C(C)C)C[C@H]3C)c(=O)[nH]c21	ZINC000161207230	546109576	/nfs/dbraw/zinc/10/95/76/546109576.db2.gz	CSQNNAXLYULVEZ-PALPZSCYSA-N	1	0	371.485	2.164	10	70		FEIERO
CC(C)[C@H](C(=O)N[C@H]1C[N@@H+](C(C)C)C[C@@H]1C)N1C(=O)c2ccccc2C1=O	ZINC000161393918	546126581	/nfs/dbraw/zinc/12/65/81/546126581.db2.gz	FDRKJBZDMVLGOS-JCGIZDLHSA-N	1	0	371.481	2.152	10	70		FEIERO
O=C(COc1cc(Cl)ccc1Cl)NC[C@@H](O)C[NH+]1CCCCC1	ZINC000160172605	546013285	/nfs/dbraw/zinc/01/32/85/546013285.db2.gz	PYLOIYYDYOGAOI-CYBMUJFWSA-N	1	0	361.269	2.335	10	70		FEIERO
CC(=O)Nc1ccc(S(=O)(=O)NC[C@H]2CCC[N@H+]2CC(C)C)cc1	ZINC000160307082	546028011	/nfs/dbraw/zinc/02/80/11/546028011.db2.gz	UPAKMEAXEBFZIP-MRXNPFEDSA-N	1	0	353.488	2.044	10	70		FEIERO
O=C(CCc1ccccc1OC(F)(F)F)NC[C@@H](O)C[NH+]1CCCCC1	ZINC000160384818	546035297	/nfs/dbraw/zinc/03/52/97/546035297.db2.gz	OPDJTKTUGDLKNJ-OAHLLOKOSA-N	1	0	374.403	2.481	10	70		FEIERO
CCn1c2ccccc2n(CC(=O)NC[C@H]2CCC[N@@H+]2CC(C)C)c1=O	ZINC000160398908	546037084	/nfs/dbraw/zinc/03/70/84/546037084.db2.gz	XPXYYINCJXADJB-MRXNPFEDSA-N	1	0	358.486	2.060	10	70		FEIERO
O=C(N[C@H](Cc1ccccc1)C(=O)N1CC[NH2+]CC1)c1ccc(Cl)cc1	ZINC000159396469	326930238	/nfs/dbraw/zinc/93/02/38/326930238.db2.gz	NJJWYEDJJJQDGM-GOSISDBHSA-N	1	0	371.868	2.113	10	70		FEIERO
O=C(CCCOc1ccccc1Cl)NC[C@H](O)C[NH+]1CCCCC1	ZINC000160239046	326958385	/nfs/dbraw/zinc/95/83/85/326958385.db2.gz	KYMWRTXMNVNWMZ-HNNXBMFYSA-N	1	0	354.878	2.462	10	70		FEIERO
CCC[C@H](C(=O)Nc1cccc(S(=O)(=O)NC(C)(C)C)c1)[NH+](C)C	ZINC000161261628	326993594	/nfs/dbraw/zinc/99/35/94/326993594.db2.gz	KIUBHZSGGSLQBF-OAHLLOKOSA-N	1	0	355.504	2.432	10	70		FEIERO
CC(C)n1cc(Br)cc1C(=O)NC[C@H](O)C[NH+]1CCCCC1	ZINC000160059897	546003908	/nfs/dbraw/zinc/00/39/08/546003908.db2.gz	GIHBXDVKDMJFTP-AWEZNQCLSA-N	1	0	372.307	2.408	10	70		FEIERO
CCN(C(=O)NCCn1cc(C)cn1)[C@H]1CC[N@H+](Cc2ccccc2)C1	ZINC000160276021	546026037	/nfs/dbraw/zinc/02/60/37/546026037.db2.gz	HWKGDZOJRRQYKQ-IBGZPJMESA-N	1	0	355.486	2.498	10	70		FEIERO
O=C(CCCOc1ccc(Cl)cc1)NC[C@@H](O)C[NH+]1CCCCC1	ZINC000160371565	546034282	/nfs/dbraw/zinc/03/42/82/546034282.db2.gz	WVRLDIVFKMTUKZ-MRXNPFEDSA-N	1	0	354.878	2.462	10	70		FEIERO
Cc1ccc(CCC(=O)NCC(=O)NC[C@H]2CCC[N@H+]2CC(C)C)cc1	ZINC000160464632	546043052	/nfs/dbraw/zinc/04/30/52/546043052.db2.gz	NXLRXZMSMWXEMK-LJQANCHMSA-N	1	0	359.514	2.280	10	70		FEIERO
O=C(NC[C@@H](O)C[NH+]1CCCCC1)c1ccccc1C(=O)c1ccccc1	ZINC000160597982	326970972	/nfs/dbraw/zinc/97/09/72/326970972.db2.gz	NNORAVOHUIASQE-GOSISDBHSA-N	1	0	366.461	2.494	10	70		FEIERO
CC[NH2+]CC1CCN(C(=O)C[C@H](C)S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000161026457	326985399	/nfs/dbraw/zinc/98/53/99/326985399.db2.gz	TVKBPEHVHWADFA-AWEZNQCLSA-N	1	0	370.490	2.226	10	70		FEIERO
Cc1cc(Cl)ccc1O[C@@H](C)C(=O)NC[C@H](O)C[NH+]1CCCCC1	ZINC000160080866	546005391	/nfs/dbraw/zinc/00/53/91/546005391.db2.gz	GXLKHWARRICKAH-HOCLYGCPSA-N	1	0	354.878	2.379	10	70		FEIERO
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)N[C@H]1CCN(c2ncccc2F)C1	ZINC000160150034	546012305	/nfs/dbraw/zinc/01/23/05/546012305.db2.gz	NNRDFFHZTJBGSW-JKSUJKDBSA-N	1	0	363.481	2.219	10	70		FEIERO
CC[C@H]1CCCC[N@@H+]1CCNC(=O)N[C@@H]1CCc2nc(C(C)C)nn2C1	ZINC000160438961	546040947	/nfs/dbraw/zinc/04/09/47/546040947.db2.gz	DSXBHCBDSBBAGX-CVEARBPZSA-N	1	0	362.522	2.280	10	70		FEIERO
CCCc1ccc(S(=O)(=O)N(C)CC2CC[NH+](C[C@@H](C)O)CC2)cc1	ZINC000161437952	546129724	/nfs/dbraw/zinc/12/97/24/546129724.db2.gz	PHLZIENXEYSSAI-MRXNPFEDSA-N	1	0	368.543	2.352	10	70		FEIERO
C[NH+](C)[C@@H]1CCN(C(=O)C(=O)Nc2ccc(Sc3ccncc3)cc2)C1	ZINC000161012991	326985124	/nfs/dbraw/zinc/98/51/24/326985124.db2.gz	UKKSWLJZDPUVAL-OAHLLOKOSA-N	1	0	370.478	2.334	10	70		FEIERO
CSc1ccc(S(=O)(=O)N(C)CC2CC[NH+](C[C@@H](C)O)CC2)cc1	ZINC000161428226	326999007	/nfs/dbraw/zinc/99/90/07/326999007.db2.gz	LJAFRKFMBAEVPH-CQSZACIVSA-N	1	0	372.556	2.122	10	70		FEIERO
CC[C@@H]1CN(C(=O)Nc2ccc(-c3ncn(C)n3)cc2)CC[N@@H+]1CCOC	ZINC000160748175	546069527	/nfs/dbraw/zinc/06/95/27/546069527.db2.gz	MTJITGFMSCBJNC-QGZVFWFLSA-N	1	0	372.473	2.057	10	70		FEIERO
O=C(CC[N@@H+]1C[C@H](O)C[C@H]1c1cccc(C(F)(F)F)c1)N1CCOCC1	ZINC000161061607	546097399	/nfs/dbraw/zinc/09/73/99/546097399.db2.gz	QDAAFIWTWFJXAH-CVEARBPZSA-N	1	0	372.387	2.062	10	70		FEIERO
CC(C)[N@@H+]1C[C@@H](C)[C@@H](NC(=O)c2ccc(CS(=O)(=O)C(F)F)cc2)C1	ZINC000161400628	546127467	/nfs/dbraw/zinc/12/74/67/546127467.db2.gz	WAHFQCAQZFUAQZ-DOMZBBRYSA-N	1	0	374.453	2.283	10	70		FEIERO
Cc1ccc(Cl)c(O[C@H](C)C(=O)NC[C@H](O)C[NH+]2CCCCC2)c1	ZINC000160491593	326967479	/nfs/dbraw/zinc/96/74/79/326967479.db2.gz	YQYKLMDETQKWCD-CABCVRRESA-N	1	0	354.878	2.379	10	70		FEIERO
O=C(CCc1ccc(OC(F)(F)F)cc1)NC[C@H](O)C[NH+]1CCCCC1	ZINC000160562179	326969684	/nfs/dbraw/zinc/96/96/84/326969684.db2.gz	ZEVQZLRCPSPJNB-HNNXBMFYSA-N	1	0	374.403	2.481	10	70		FEIERO
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)[C@@H](C)n1nnc(-c2ccccc2)n1	ZINC000160376758	546035669	/nfs/dbraw/zinc/03/56/69/546035669.db2.gz	IYFSHSZLIBPPLQ-NVXWUHKLSA-N	1	0	356.474	2.138	10	70		FEIERO
COc1ccccc1[C@@H](NC(=O)N1CCO[C@H](C[NH+](C)C)C1)c1ccco1	ZINC000160658617	546060417	/nfs/dbraw/zinc/06/04/17/546060417.db2.gz	GQJVEEQDEOJUAP-DNVCBOLYSA-N	1	0	373.453	2.350	10	70		FEIERO
C[C@@H](Oc1ccccc1C(F)(F)F)C(=O)NC[C@H](O)C[NH+]1CCCCC1	ZINC000160685541	326973655	/nfs/dbraw/zinc/97/36/55/326973655.db2.gz	ROEJDUMPFHSZGE-KGLIPLIRSA-N	1	0	374.403	2.436	10	70		FEIERO
C[N@H+](CCN1CCN(C(=O)c2ccccn2)CC1)Cc1ccc(F)cc1	ZINC000160346194	546031870	/nfs/dbraw/zinc/03/18/70/546031870.db2.gz	JMHGTDRDCONQQU-UHFFFAOYSA-N	1	0	356.445	2.111	10	70		FEIERO
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)CCc1nc(-c2ccncc2)no1	ZINC000160448350	546042566	/nfs/dbraw/zinc/04/25/66/546042566.db2.gz	YGTXCBPAOLLDJB-MRXNPFEDSA-N	1	0	357.458	2.301	10	70		FEIERO
CC[C@H]1CN(C(=O)Nc2ccc(-c3ncn(C)n3)cc2)CC[N@@H+]1CCOC	ZINC000160748312	546068886	/nfs/dbraw/zinc/06/88/86/546068886.db2.gz	MTJITGFMSCBJNC-KRWDZBQOSA-N	1	0	372.473	2.057	10	70		FEIERO
CC[C@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)NCc1cn(C)nc1C(F)(F)F	ZINC000160887480	546081097	/nfs/dbraw/zinc/08/10/97/546081097.db2.gz	UPUSFEYGUANIFV-QWHCGFSZSA-N	1	0	359.396	2.207	10	70		FEIERO
CC(C)[N@H+]1C[C@H](NC(=O)c2ccc(CS(=O)(=O)C(F)F)cc2)[C@@H](C)C1	ZINC000161400743	546126602	/nfs/dbraw/zinc/12/66/02/546126602.db2.gz	WAHFQCAQZFUAQZ-WFASDCNBSA-N	1	0	374.453	2.283	10	70		FEIERO
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC[NH2+]CC1)c1ccc(Cl)cc1	ZINC000159396361	326930181	/nfs/dbraw/zinc/93/01/81/326930181.db2.gz	NJJWYEDJJJQDGM-SFHVURJKSA-N	1	0	371.868	2.113	10	70		FEIERO
C[C@H](O)C[NH+]1CCC(CN(C)C(=O)c2ccncc2Br)CC1	ZINC000159870167	326945091	/nfs/dbraw/zinc/94/50/91/326945091.db2.gz	MVDAEFSWMRCZMU-LBPRGKRZSA-N	1	0	370.291	2.009	10	70		FEIERO
CCOc1ccccc1C(=O)NCC(=O)NC[C@H]1CCC[N@@H+]1CC(C)C	ZINC000160503484	546046447	/nfs/dbraw/zinc/04/64/47/546046447.db2.gz	CDKMTYDWMCWNAK-MRXNPFEDSA-N	1	0	361.486	2.052	10	70		FEIERO
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)CCN1C(=O)COc2ccccc21	ZINC000160527563	546049505	/nfs/dbraw/zinc/04/95/05/546049505.db2.gz	UDDFGOHGQIFFIF-MRXNPFEDSA-N	1	0	359.470	2.039	10	70		FEIERO
CN(CC[NH+]1CCC([C@@H](O)c2nccn2C)CC1)Cc1ccc(F)cc1	ZINC000160917689	546084266	/nfs/dbraw/zinc/08/42/66/546084266.db2.gz	MQHKZRPCXDBKSD-LJQANCHMSA-N	1	0	360.477	2.437	10	70		FEIERO
O=C(NC[C@H](O)C[NH+]1CCCCC1)c1cc(Oc2ccccc2)ccn1	ZINC000160111635	326953755	/nfs/dbraw/zinc/95/37/55/326953755.db2.gz	QDOPMLMNGZAFIE-INIZCTEOSA-N	1	0	355.438	2.451	10	70		FEIERO
O=C(NC[C@@H](O)C[NH+]1CCCCC1)c1csc(Cc2ccccc2)n1	ZINC000160443023	326965590	/nfs/dbraw/zinc/96/55/90/326965590.db2.gz	INGJCZIULONBCT-MRXNPFEDSA-N	1	0	359.495	2.311	10	70		FEIERO
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)CCn1cnc2ccccc2c1=O	ZINC000160384499	546035628	/nfs/dbraw/zinc/03/56/28/546035628.db2.gz	LNGKXHJELHPEBJ-MRXNPFEDSA-N	1	0	356.470	2.023	10	70		FEIERO
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)C[C@@H](NC(N)=O)c1cccs1	ZINC000160533471	546048678	/nfs/dbraw/zinc/04/86/78/546048678.db2.gz	UWPXMHVJHBFQCE-ZIAGYGMSSA-N	1	0	352.504	2.084	10	70		FEIERO
CCOCC[N@@H+]1CCN(C(=O)N[C@@H]2CCO[C@H](C3CC3)C2)C[C@H]1CC	ZINC000160628098	546057837	/nfs/dbraw/zinc/05/78/37/546057837.db2.gz	AWSKDHVZMQCDGS-KURKYZTESA-N	1	0	353.507	2.086	10	70		FEIERO
CCOCC[N@@H+]1CCN(C(=O)N[C@@H]2CCO[C@H](C3CC3)C2)C[C@@H]1CC	ZINC000160628190	546057887	/nfs/dbraw/zinc/05/78/87/546057887.db2.gz	AWSKDHVZMQCDGS-SQNIBIBYSA-N	1	0	353.507	2.086	10	70		FEIERO
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)NCc1cn(C)nc1C(F)(F)F	ZINC000160889565	546081442	/nfs/dbraw/zinc/08/14/42/546081442.db2.gz	GLMRBSXSIYZXQG-CYBMUJFWSA-N	1	0	361.412	2.359	10	70		FEIERO
CC(=O)Nc1cc(NC(C)=O)cc(C(=O)N[C@H]2C[N@H+](C(C)C)C[C@H]2C)c1	ZINC000161376730	546124783	/nfs/dbraw/zinc/12/47/83/546124783.db2.gz	WMQZMRVINXMYJV-XIKOKIGWSA-N	1	0	360.458	2.062	10	70		FEIERO
Cc1cc(Cl)ccc1O[C@H](C)C(=O)NC[C@H](O)C[NH+]1CCCCC1	ZINC000160080980	326952491	/nfs/dbraw/zinc/95/24/91/326952491.db2.gz	GXLKHWARRICKAH-ZBFHGGJFSA-N	1	0	354.878	2.379	10	70		FEIERO
O=C(COc1ccc(Cl)cc1Cl)NC[C@H](O)C[NH+]1CCCCC1	ZINC000160498579	326967739	/nfs/dbraw/zinc/96/77/39/326967739.db2.gz	BBMOMWRBVVKCSI-ZDUSSCGKSA-N	1	0	361.269	2.335	10	70		FEIERO
CS(=O)(=O)c1ccc(OCCC[N@@H+]2CC[C@]3(O)CCCC[C@@H]3C2)cc1	ZINC000161017841	546092776	/nfs/dbraw/zinc/09/27/76/546092776.db2.gz	AUUCHQCHDIFKOL-VQIMIIECSA-N	1	0	367.511	2.486	10	70		FEIERO
Cc1cc(O[C@H](C)C(=O)NC[C@@H](O)C[NH+]2CCCCC2)ccc1Cl	ZINC000160371288	326963029	/nfs/dbraw/zinc/96/30/29/326963029.db2.gz	VDTKAWDFXGRJBY-HUUCEWRRSA-N	1	0	354.878	2.379	10	70		FEIERO
CCC[C@H](C(=O)NCc1ccc(S(=O)(=O)N(CC)CC)cc1)[NH+](C)C	ZINC000161272575	326994058	/nfs/dbraw/zinc/99/40/58/326994058.db2.gz	SDPNMSKNTAPPFK-QGZVFWFLSA-N	1	0	369.531	2.064	10	70		FEIERO
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)c1cn(Cc2cccc(F)c2)nn1	ZINC000160489424	546045219	/nfs/dbraw/zinc/04/52/19/546045219.db2.gz	WEKYDOUBLYIXPB-QGZVFWFLSA-N	1	0	359.449	2.316	10	70		FEIERO
CC(C)[N@@H+]1C[C@@H](C)[C@@H](NC(=O)[C@@H](c2cccc(F)c2)N2CCOCC2)C1	ZINC000161133240	546102946	/nfs/dbraw/zinc/10/29/46/546102946.db2.gz	BEPVIQKYERDZEH-AYOQOUSVSA-N	1	0	363.477	2.044	10	70		FEIERO
CC(C)[C@H](C(=O)N[C@H]1C[N@@H+](C(C)C)C[C@H]1C)N1C(=O)c2ccccc2C1=O	ZINC000161393768	546127116	/nfs/dbraw/zinc/12/71/16/546127116.db2.gz	FDRKJBZDMVLGOS-FHLIZLRMSA-N	1	0	371.481	2.152	10	70		FEIERO
Cc1cc(Cl)ccc1O[C@H](C)C(=O)NC[C@@H](O)C[NH+]1CCCCC1	ZINC000160081262	326952529	/nfs/dbraw/zinc/95/25/29/326952529.db2.gz	GXLKHWARRICKAH-GDBMZVCRSA-N	1	0	354.878	2.379	10	70		FEIERO
Cn1nccc1C1CC[NH+](CCC(=O)Nc2ccc3c(c2)OCO3)CC1	ZINC000160649329	326972583	/nfs/dbraw/zinc/97/25/83/326972583.db2.gz	LXLSNJSMQYWPGO-UHFFFAOYSA-N	1	0	356.426	2.357	10	70		FEIERO
O=C(NC1CC[NH+](Cc2ccccn2)CC1)N1CC[C@@]2(O)CCCC[C@@H]2C1	ZINC000161037600	326985963	/nfs/dbraw/zinc/98/59/63/326985963.db2.gz	JAEHSTSXIFIGHH-UTKZUKDTSA-N	1	0	372.513	2.383	10	70		FEIERO
CC(C)[C@@H](O)CC(=O)NCCC[NH+]1CCN(c2cccc(Cl)c2)CC1	ZINC000159376323	545947374	/nfs/dbraw/zinc/94/73/74/545947374.db2.gz	XJNIRSZLYOOSIJ-SFHVURJKSA-N	1	0	367.921	2.375	10	70		FEIERO
CSc1ccc(S(=O)(=O)N(C)CC2CC[NH+](C[C@H](C)O)CC2)cc1	ZINC000161428139	546129033	/nfs/dbraw/zinc/12/90/33/546129033.db2.gz	LJAFRKFMBAEVPH-AWEZNQCLSA-N	1	0	372.556	2.122	10	70		FEIERO
COC(=O)c1ccccc1CS(=O)(=O)NC[C@H]1CCC[N@@H+]1CC(C)C	ZINC000160271045	546024530	/nfs/dbraw/zinc/02/45/30/546024530.db2.gz	WWSJIBBJBYMTNG-MRXNPFEDSA-N	1	0	368.499	2.013	10	70		FEIERO
CCN(CC)C(=O)C(=O)Nc1ccnn1[C@H]1CC[N@H+](Cc2ccccc2)C1	ZINC000160302706	546028426	/nfs/dbraw/zinc/02/84/26/546028426.db2.gz	SCPZPFHEKHPGBA-KRWDZBQOSA-N	1	0	369.469	2.137	10	70		FEIERO
COCCN1CCN(C(=O)N[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)C[C@H]1C	ZINC000160330711	546030730	/nfs/dbraw/zinc/03/07/30/546030730.db2.gz	HBHXTXWRDMQCJW-NLWGTHIKSA-N	1	0	374.529	2.012	10	70		FEIERO
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)CCCc1nc2ccccc2c(=O)[nH]1	ZINC000160411538	546038788	/nfs/dbraw/zinc/03/87/88/546038788.db2.gz	KNBVILATECRUJF-MRXNPFEDSA-N	1	0	370.497	2.482	10	70		FEIERO
O=C(NC[C@H](O)C[NH+]1CCCCC1)c1cc(-c2ccc(Cl)cc2)n[nH]1	ZINC000160671913	546061031	/nfs/dbraw/zinc/06/10/31/546061031.db2.gz	KODVASFOKCSSGJ-HNNXBMFYSA-N	1	0	362.861	2.307	10	70		FEIERO
O=C(C[N@@H+]1CC[C@@]2(O)CCCC[C@@H]2C1)NCCCOC1CCCCC1	ZINC000161152477	546105052	/nfs/dbraw/zinc/10/50/52/546105052.db2.gz	ZAMBINSUXCYJGO-XLIONFOSSA-N	1	0	352.519	2.469	10	70		FEIERO
CC(=O)Nc1cc(NC(C)=O)cc(C(=O)N[C@H]2C[N@H+](C(C)C)C[C@@H]2C)c1	ZINC000161376861	546124514	/nfs/dbraw/zinc/12/45/14/546124514.db2.gz	WMQZMRVINXMYJV-SGTLLEGYSA-N	1	0	360.458	2.062	10	70		FEIERO
CNC(=O)c1ccc(OC)c(NC(=O)NC[C@H]2CCC[N@@H+]2CC(C)C)c1	ZINC000160521067	546047627	/nfs/dbraw/zinc/04/76/27/546047627.db2.gz	VRCKPUZYUSAPNF-OAHLLOKOSA-N	1	0	362.474	2.297	10	70		FEIERO
CC(C)[C@H](O)CC(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCC[N@H+](C)C2)cc1	ZINC000160855533	546078699	/nfs/dbraw/zinc/07/86/99/546078699.db2.gz	IDYBMVSVZHAMOX-QZTJIDSGSA-N	1	0	361.486	2.198	10	70		FEIERO
CCOCC[NH+]1CCN(C[C@H]2CC(c3ccc(Cl)cc3)=NO2)CC1	ZINC000159811694	326942998	/nfs/dbraw/zinc/94/29/98/326942998.db2.gz	DTYMRWWZJBMKTO-QGZVFWFLSA-N	1	0	351.878	2.487	10	70		FEIERO
C[C@H](Oc1ccccc1C(F)(F)F)C(=O)NC[C@H](O)C[NH+]1CCCCC1	ZINC000160685420	326973797	/nfs/dbraw/zinc/97/37/97/326973797.db2.gz	ROEJDUMPFHSZGE-KBPBESRZSA-N	1	0	374.403	2.436	10	70		FEIERO
CCC[C@@H](C(=O)N1CCN(Cc2cc(OC)ccc2OC)CC1)[NH+](C)C	ZINC000161440881	326999431	/nfs/dbraw/zinc/99/94/31/326999431.db2.gz	CDTRWPFRXDRRIC-SFHVURJKSA-N	1	0	363.502	2.078	10	70		FEIERO
COC(=O)c1cccc(CS(=O)(=O)NC[C@H]2CCC[N@@H+]2CC(C)C)c1	ZINC000160305862	546028262	/nfs/dbraw/zinc/02/82/62/546028262.db2.gz	ZQRHCKLCOWWENW-QGZVFWFLSA-N	1	0	368.499	2.013	10	70		FEIERO
COC(=O)c1c(C)cccc1S(=O)(=O)NC[C@H]1CCC[N@@H+]1CC(C)C	ZINC000160307509	546028473	/nfs/dbraw/zinc/02/84/73/546028473.db2.gz	OICUWFWMNJDFTO-OAHLLOKOSA-N	1	0	368.499	2.180	10	70		FEIERO
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)CCN1c2ccccc2O[C@@H](C)C1=O	ZINC000160485891	546045696	/nfs/dbraw/zinc/04/56/96/546045696.db2.gz	VDBGRZWTMISCNJ-DLBZAZTESA-N	1	0	373.497	2.427	10	70		FEIERO
Cc1ccccc1[C@@H](CC(=O)NC[C@H]1CCC[N@H+]1CC(C)C)NC(N)=O	ZINC000160584102	546053794	/nfs/dbraw/zinc/05/37/94/546053794.db2.gz	LPIVOMWQADSNEZ-SJLPKXTDSA-N	1	0	360.502	2.331	10	70		FEIERO
CCOCC[NH+]1CCN(C[C@@H]2CC(c3ccc(Cl)cc3)=NO2)CC1	ZINC000159811537	545983027	/nfs/dbraw/zinc/98/30/27/545983027.db2.gz	DTYMRWWZJBMKTO-KRWDZBQOSA-N	1	0	351.878	2.487	10	70		FEIERO
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)c1ccc(=O)n(Cc2ccccc2)n1	ZINC000160512859	546047516	/nfs/dbraw/zinc/04/75/16/546047516.db2.gz	GEIALJSPRURILD-GOSISDBHSA-N	1	0	368.481	2.142	10	70		FEIERO
CCOC(=O)CN(C(=O)C[N@@H+]1CC[C@@]2(O)CCCC[C@@H]2C1)c1ccccc1	ZINC000160984141	546090502	/nfs/dbraw/zinc/09/05/02/546090502.db2.gz	VDVCGMLKOBJVPU-UTKZUKDTSA-N	1	0	374.481	2.210	10	70		FEIERO
CC[NH2+]CC1CCN(C(=O)C[C@@H](C)S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000161026325	326985337	/nfs/dbraw/zinc/98/53/37/326985337.db2.gz	TVKBPEHVHWADFA-CQSZACIVSA-N	1	0	370.490	2.226	10	70		FEIERO
CC[C@@H](Oc1ccccc1Cl)C(=O)NC[C@H](O)C[NH+]1CCCCC1	ZINC000160293574	546027458	/nfs/dbraw/zinc/02/74/58/546027458.db2.gz	TVSOGIJLWLCTDG-GOEBONIOSA-N	1	0	354.878	2.460	10	70		FEIERO
CC[C@@H](CO)[NH+]1CCN(C[C@@H]2CC(c3ccc(Cl)cc3)=NO2)CC1	ZINC000159855214	326944255	/nfs/dbraw/zinc/94/42/55/326944255.db2.gz	LLIVBBJKMIURBQ-IRXDYDNUSA-N	1	0	351.878	2.222	10	70		FEIERO
Cc1ccc(C(=O)NC[C@H](O)C[NH+]2CCCCC2)cc1Br	ZINC000160347344	326962156	/nfs/dbraw/zinc/96/21/56/326962156.db2.gz	QCTRFWFKVORUQD-AWEZNQCLSA-N	1	0	355.276	2.334	10	70		FEIERO
C[C@@H](NC(=O)NCc1cccc(C[NH+](C)C)c1)c1nnc2n1CCCC2	ZINC000159903555	545990358	/nfs/dbraw/zinc/99/03/58/545990358.db2.gz	AOYXUMJLNBXXQD-CQSZACIVSA-N	1	0	356.474	2.236	10	70		FEIERO
COc1cccc(C2(C(=O)NC[C@H](O)C[NH+]3CCCCC3)CCCC2)c1	ZINC000160242667	546021421	/nfs/dbraw/zinc/02/14/21/546021421.db2.gz	BWCOWZKLGMVEQB-SFHVURJKSA-N	1	0	360.498	2.470	10	70		FEIERO
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)COc1ccc(N2CCCC2=O)cc1	ZINC000160388485	546036141	/nfs/dbraw/zinc/03/61/41/546036141.db2.gz	YGJCEGIWDHOJLK-GOSISDBHSA-N	1	0	373.497	2.429	10	70		FEIERO
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)c1ccc(CS(C)(=O)=O)cc1	ZINC000160455561	546041833	/nfs/dbraw/zinc/04/18/33/546041833.db2.gz	RRKVCTZOLTUENH-QGZVFWFLSA-N	1	0	352.500	2.081	10	70		FEIERO
CCS(=O)(=O)c1ccc(C(=O)NC[C@H]2CCC[N@@H+]2CC(C)C)cc1	ZINC000160580327	546053251	/nfs/dbraw/zinc/05/32/51/546053251.db2.gz	HITQHVRYAIPGAO-MRXNPFEDSA-N	1	0	352.500	2.330	10	70		FEIERO
O=C(NC[C@@H](O)C[NH+]1CCCCC1)c1csc(-c2cccs2)n1	ZINC000160099724	326953126	/nfs/dbraw/zinc/95/31/26/326953126.db2.gz	BQFXWMAXWZPXTO-GFCCVEGCSA-N	1	0	351.497	2.448	10	70		FEIERO
O=C(CCCOc1ccccc1Cl)NC[C@@H](O)C[NH+]1CCCCC1	ZINC000160239196	326958465	/nfs/dbraw/zinc/95/84/65/326958465.db2.gz	KYMWRTXMNVNWMZ-OAHLLOKOSA-N	1	0	354.878	2.462	10	70		FEIERO
CC(C)c1nc2n(n1)C[C@H](NC(=O)N[C@H](CC[NH+](C)C)C(C)(C)C)CC2	ZINC000160220777	546018635	/nfs/dbraw/zinc/01/86/35/546018635.db2.gz	BGBGYIXCUHOQRA-HUUCEWRRSA-N	1	0	364.538	2.382	10	70		FEIERO
O=C(NC1CC[NH+](Cc2ccccn2)CC1)N1CC[C@]2(O)CCCC[C@H]2C1	ZINC000161037716	546095153	/nfs/dbraw/zinc/09/51/53/546095153.db2.gz	JAEHSTSXIFIGHH-LAUBAEHRSA-N	1	0	372.513	2.383	10	70		FEIERO
O=C(C[N@@H+]1CC[C@]2(O)CCCC[C@@H]2C1)Nc1cccc(N2CCCC2=O)c1	ZINC000161125963	546102184	/nfs/dbraw/zinc/10/21/84/546102184.db2.gz	AQEQVGNLOMXPFF-IIBYNOLFSA-N	1	0	371.481	2.379	10	70		FEIERO
CC[C@@H](CO)[NH+]1CCN(C[C@H]2CC(c3ccc(Cl)cc3)=NO2)CC1	ZINC000159855440	326944356	/nfs/dbraw/zinc/94/43/56/326944356.db2.gz	LLIVBBJKMIURBQ-DLBZAZTESA-N	1	0	351.878	2.222	10	70		FEIERO
CC(C)c1nc2n(n1)C[C@@H](NC(=O)N[C@H](CC[NH+](C)C)C(C)(C)C)CC2	ZINC000160220898	326957597	/nfs/dbraw/zinc/95/75/97/326957597.db2.gz	BGBGYIXCUHOQRA-LSDHHAIUSA-N	1	0	364.538	2.382	10	70		FEIERO
COC(=O)[C@H](c1cccnc1)N1CCN(Cc2cnn(C(C)(C)C)c2)CC1	ZINC000159951515	545994807	/nfs/dbraw/zinc/99/48/07/545994807.db2.gz	HLMXDUCJWIBCDZ-SFHVURJKSA-N	1	0	371.485	2.065	10	70		FEIERO
CCOCC[N@@H+]1CCN(C(=O)C[C@@H](C)c2c(C)n[nH]c2C)C[C@@H]1CC	ZINC000160433782	546040575	/nfs/dbraw/zinc/04/05/75/546040575.db2.gz	PQCMIJYIOBTSRO-PBHICJAKSA-N	1	0	350.507	2.479	10	70		FEIERO
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)C[C@H](NC(N)=O)c1cccs1	ZINC000160533361	546049102	/nfs/dbraw/zinc/04/91/02/546049102.db2.gz	UWPXMHVJHBFQCE-KGLIPLIRSA-N	1	0	352.504	2.084	10	70		FEIERO
C[C@H](NC(=O)N1CCC[C@@H]([NH+]2CCCC2)CC1)C(=O)N1CCCCC1	ZINC000160356741	326962724	/nfs/dbraw/zinc/96/27/24/326962724.db2.gz	SWKMQAKBHKCYRQ-DLBZAZTESA-N	1	0	350.507	2.047	10	70		FEIERO
CC[C@H](C)[C@@H]([NH3+])C(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1=O	ZINC000161291551	326994822	/nfs/dbraw/zinc/99/48/22/326994822.db2.gz	DDRQTOINCHXHKM-NILFDRSVSA-N	1	0	369.412	2.273	10	70		FEIERO
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)N[C@@H]1CCN(c2ncccc2F)C1	ZINC000160149910	546012808	/nfs/dbraw/zinc/01/28/08/546012808.db2.gz	NNRDFFHZTJBGSW-HZPDHXFCSA-N	1	0	363.481	2.219	10	70		FEIERO
Cc1cc(O[C@@H](C)C(=O)NC[C@@H](O)C[NH+]2CCCCC2)ccc1Cl	ZINC000160371184	546033667	/nfs/dbraw/zinc/03/36/67/546033667.db2.gz	VDTKAWDFXGRJBY-LSDHHAIUSA-N	1	0	354.878	2.379	10	70		FEIERO
O=C(CC[N@@H+]1C[C@@H](O)C[C@@H]1c1cccc(C(F)(F)F)c1)N1CCOCC1	ZINC000161061497	546096935	/nfs/dbraw/zinc/09/69/35/546096935.db2.gz	QDAAFIWTWFJXAH-JKSUJKDBSA-N	1	0	372.387	2.062	10	70		FEIERO
CCC(CC)(C[NH3+])C(=O)N(C)C[C@@H](c1cccs1)N1CCOCC1	ZINC000161288846	546117163	/nfs/dbraw/zinc/11/71/63/546117163.db2.gz	IGXNTHBFQAVWQE-HNNXBMFYSA-N	1	0	353.532	2.345	10	70		FEIERO
O=C(NCc1cccc(-c2ccccn2)c1)NC[C@H](O)C[NH+]1CCCCC1	ZINC000160342328	326962197	/nfs/dbraw/zinc/96/21/97/326962197.db2.gz	DBCHFSCJIXQUEX-IBGZPJMESA-N	1	0	368.481	2.395	10	70		FEIERO
O=C(NC[C@@H](O)C[NH+]1CCCCC1)c1ccnc(OCc2ccccc2)c1	ZINC000160640954	326972236	/nfs/dbraw/zinc/97/22/36/326972236.db2.gz	GMKYCJTVDHZADU-LJQANCHMSA-N	1	0	369.465	2.237	10	70		FEIERO
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)Nc1ccccc1OCCC(N)=O	ZINC000161212132	546111087	/nfs/dbraw/zinc/11/10/87/546111087.db2.gz	HULCNQIWGYGTBH-OAHLLOKOSA-N	1	0	362.474	2.183	10	70		FEIERO
NC(=O)[C@H]1CCC[N@@H+]1C1CCN(c2ccnc3c(F)cc(F)cc23)CC1	ZINC000160062356	546004812	/nfs/dbraw/zinc/00/48/12/546004812.db2.gz	PBDPFZRGJNLOLQ-QGZVFWFLSA-N	1	0	360.408	2.432	10	70		FEIERO
CC[C@H](Oc1ccccc1Cl)C(=O)NC[C@H](O)C[NH+]1CCCCC1	ZINC000160293433	546026907	/nfs/dbraw/zinc/02/69/07/546026907.db2.gz	TVSOGIJLWLCTDG-HOCLYGCPSA-N	1	0	354.878	2.460	10	70		FEIERO
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)Cn1nc(-c2ccccc2)ccc1=O	ZINC000160429429	546039319	/nfs/dbraw/zinc/03/93/19/546039319.db2.gz	XFEAYBXJEQKUNF-GOSISDBHSA-N	1	0	368.481	2.147	10	70		FEIERO
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)CCN1c2ccccc2O[C@H](C)C1=O	ZINC000160485760	546045056	/nfs/dbraw/zinc/04/50/56/546045056.db2.gz	VDBGRZWTMISCNJ-IAGOWNOFSA-N	1	0	373.497	2.427	10	70		FEIERO
Cc1ccccc1[C@H](CC(=O)NC[C@H]1CCC[N@H+]1CC(C)C)NC(N)=O	ZINC000160584241	546053423	/nfs/dbraw/zinc/05/34/23/546053423.db2.gz	LPIVOMWQADSNEZ-AEFFLSMTSA-N	1	0	360.502	2.331	10	70		FEIERO
O=C(CC[N@@H+]1CC[C@]2(O)CCCC[C@@H]2C1)NC(=O)NCc1ccccc1	ZINC000160770017	546070939	/nfs/dbraw/zinc/07/09/39/546070939.db2.gz	NMTLHTMMJNORLD-YLJYHZDGSA-N	1	0	359.470	2.030	10	70		FEIERO
O=C(CC[N@@H+]1CC[C@@]2(O)CCCC[C@@H]2C1)NC(=O)NCc1ccccc1	ZINC000160770148	546071380	/nfs/dbraw/zinc/07/13/80/546071380.db2.gz	NMTLHTMMJNORLD-XLIONFOSSA-N	1	0	359.470	2.030	10	70		FEIERO
COC(=O)c1ccc2[nH]cc(C(=O)CN3C[C@H]4CCC[N@@H+]4C[C@H]3C)c2c1	ZINC000161111028	546100623	/nfs/dbraw/zinc/10/06/23/546100623.db2.gz	QVAHXYPPJKLNHR-UKRRQHHQSA-N	1	0	355.438	2.306	10	70		FEIERO
COc1ccccc1[C@H](NC(=O)N1CCO[C@H](C[NH+](C)C)C1)c1ccco1	ZINC000160658373	326972799	/nfs/dbraw/zinc/97/27/99/326972799.db2.gz	GQJVEEQDEOJUAP-BEFAXECRSA-N	1	0	373.453	2.350	10	70		FEIERO
CCC(CC)(C[NH3+])C(=O)N(C)C[C@H](c1cccs1)N1CCOCC1	ZINC000161288963	326994692	/nfs/dbraw/zinc/99/46/92/326994692.db2.gz	IGXNTHBFQAVWQE-OAHLLOKOSA-N	1	0	353.532	2.345	10	70		FEIERO
CCn1cc(C2CC[NH+]([C@@H]3CCCN(c4cnn(C)c4)C3=O)CC2)cn1	ZINC000160058763	546004377	/nfs/dbraw/zinc/00/43/77/546004377.db2.gz	NOPVEJHZJDSUIA-GOSISDBHSA-N	1	0	356.474	2.012	10	70		FEIERO
CCCCOc1ccc(C(=O)NC[C@H](O)C[NH+]2CCCCC2)cc1OC	ZINC000160106833	546007358	/nfs/dbraw/zinc/00/73/58/546007358.db2.gz	JITULUGAPGXNJU-KRWDZBQOSA-N	1	0	364.486	2.451	10	70		FEIERO
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)CNC(=O)c1cc2ccccc2[nH]1	ZINC000160376502	546035379	/nfs/dbraw/zinc/03/53/79/546035379.db2.gz	GOVMWCAQIDULHO-MRXNPFEDSA-N	1	0	356.470	2.134	10	70		FEIERO
O=C(NC[C@@H](O)C[NH+]1CCCCC1)c1cc(-c2ccc(Cl)cc2)n[nH]1	ZINC000160672035	546061551	/nfs/dbraw/zinc/06/15/51/546061551.db2.gz	KODVASFOKCSSGJ-OAHLLOKOSA-N	1	0	362.861	2.307	10	70		FEIERO
CC[NH2+]CC1CCN(C(=O)[C@H](NC(=O)c2ccccc2F)C(C)C)CC1	ZINC000161034682	546095290	/nfs/dbraw/zinc/09/52/90/546095290.db2.gz	NIVSPURGEZSQLH-GOSISDBHSA-N	1	0	363.477	2.428	10	70		FEIERO
CC(C)[C@H](O)CC(=O)NCCC[NH+]1CCN(c2cccc(Cl)c2)CC1	ZINC000159376180	326929078	/nfs/dbraw/zinc/92/90/78/326929078.db2.gz	XJNIRSZLYOOSIJ-GOSISDBHSA-N	1	0	367.921	2.375	10	70		FEIERO
Cc1c(NC(=O)C(=O)N[C@@H](CC(C)C)C[NH+](C)C)cnn1-c1ccccc1	ZINC000160581554	326970056	/nfs/dbraw/zinc/97/00/56/326970056.db2.gz	GJKDAYTVGFBUJU-INIZCTEOSA-N	1	0	371.485	2.212	10	70		FEIERO
CC(C)c1nc2n(n1)C[C@H](NC(=O)NCCC[NH2+]C1CCCCC1)CC2	ZINC000161377288	326997473	/nfs/dbraw/zinc/99/74/73/326997473.db2.gz	GQDOCKVLAJNHJO-MRXNPFEDSA-N	1	0	362.522	2.328	10	70		FEIERO
C[C@H](C(=O)N[C@@H](C)c1ccccc1)N1CCN(Cc2ccncc2)CC1	ZINC000161181560	546107427	/nfs/dbraw/zinc/10/74/27/546107427.db2.gz	KJEICUJBCZOYAC-ZWKOTPCHSA-N	1	0	352.482	2.465	10	70		FEIERO
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)CNC(=O)c1cccc(Cl)c1	ZINC000160423373	546040181	/nfs/dbraw/zinc/04/01/81/546040181.db2.gz	VYJQWGPLCRRMGV-MRXNPFEDSA-N	1	0	351.878	2.306	10	70		FEIERO
Cc1c(NC(=O)C(=O)N[C@H](CC(C)C)C[NH+](C)C)cnn1-c1ccccc1	ZINC000160581715	546053871	/nfs/dbraw/zinc/05/38/71/546053871.db2.gz	GJKDAYTVGFBUJU-MRXNPFEDSA-N	1	0	371.485	2.212	10	70		FEIERO
CC(=O)NC1CCC([NH2+]C[C@H](c2ccc(C)s2)N2CCOCC2)CC1	ZINC000161441658	546129271	/nfs/dbraw/zinc/12/92/71/546129271.db2.gz	LZRSORVERKJKJL-DAWZGUTISA-N	1	0	365.543	2.467	10	70		FEIERO
CC(C)(Oc1ccc(Cl)cc1)C(=O)NC[C@H](O)C[NH+]1CCCCC1	ZINC000160053345	326951713	/nfs/dbraw/zinc/95/17/13/326951713.db2.gz	WQSHBXMMXKLZFV-HNNXBMFYSA-N	1	0	354.878	2.460	10	70		FEIERO
C[C@@H](NC(=O)CC1C[C@H]2CC[C@@H](C1)[NH2+]2)c1ccc(S(C)(=O)=O)c(F)c1	ZINC000160757847	326976325	/nfs/dbraw/zinc/97/63/25/326976325.db2.gz	RZMHVOWQCRRFSC-IKKMQULASA-N	1	0	368.474	2.327	10	70		FEIERO
O=C(COc1cc(Cl)ccc1Cl)NC[C@H](O)C[NH+]1CCCCC1	ZINC000160172487	546013822	/nfs/dbraw/zinc/01/38/22/546013822.db2.gz	PYLOIYYDYOGAOI-ZDUSSCGKSA-N	1	0	361.269	2.335	10	70		FEIERO
COCCOc1ccc(NC(=O)NC[C@H]2CCC[N@@H+]2CC(C)C)cn1	ZINC000160318149	546029469	/nfs/dbraw/zinc/02/94/69/546029469.db2.gz	BGLVTLXADHBSRY-MRXNPFEDSA-N	1	0	350.463	2.349	10	70		FEIERO
Cc1cc(O[C@@H](C)C(=O)NC[C@H](O)C[NH+]2CCCCC2)ccc1Cl	ZINC000160370944	546034365	/nfs/dbraw/zinc/03/43/65/546034365.db2.gz	VDTKAWDFXGRJBY-GJZGRUSLSA-N	1	0	354.878	2.379	10	70		FEIERO
COc1ccccc1[C@@H](NC(=O)N1CCO[C@@H](C[NH+](C)C)C1)c1ccco1	ZINC000160658737	546060520	/nfs/dbraw/zinc/06/05/20/546060520.db2.gz	GQJVEEQDEOJUAP-HNAYVOBHSA-N	1	0	373.453	2.350	10	70		FEIERO
CCCNC(=O)NC(=O)CN1C[C@@H](O)C[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000161146019	546104303	/nfs/dbraw/zinc/10/43/03/546104303.db2.gz	QMWIBFLGWGGSHO-UONOGXRCSA-N	1	0	373.375	2.049	10	70		FEIERO
CC[C@H](CS(=O)(=O)c1ccccc1)NC(=O)NC[C@H](C)[NH+](CC)CC	ZINC000159597319	326936518	/nfs/dbraw/zinc/93/65/18/326936518.db2.gz	YMSXEWWVIRDEOF-JKSUJKDBSA-N	1	0	369.531	2.268	10	70		FEIERO
CC(C)c1nc2n(n1)C[C@H](NC(=O)N[C@@H](CC[NH+](C)C)C(C)(C)C)CC2	ZINC000160220507	326957699	/nfs/dbraw/zinc/95/76/99/326957699.db2.gz	BGBGYIXCUHOQRA-CABCVRRESA-N	1	0	364.538	2.382	10	70		FEIERO
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)[C@H]1CCCN(C(=O)c2ccncc2)C1	ZINC000160377846	546034857	/nfs/dbraw/zinc/03/48/57/546034857.db2.gz	YLBSFSZEHCRDPB-RBUKOAKNSA-N	1	0	372.513	2.170	10	70		FEIERO
CCOCc1ccc(CNC(=O)C[N@@H+]2CC[C@@]3(O)CCCC[C@@H]3C2)cc1	ZINC000160496842	546047182	/nfs/dbraw/zinc/04/71/82/546047182.db2.gz	HQGOYBKGQVHXIS-CTNGQTDRSA-N	1	0	360.498	2.466	10	70		FEIERO
Cc1cnn(Cc2cc(C(=O)N[C@@H](C[NH+](C)C)c3ccccc3)no2)c1	ZINC000160543410	546050127	/nfs/dbraw/zinc/05/01/27/546050127.db2.gz	KVIFXEDKMONLNF-SFHVURJKSA-N	1	0	353.426	2.261	10	70		FEIERO