smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1nc(S(=O)(=O)N2CCC[C@@H](C(=O)[O-])C2)c(-c2ccccc2)s1	ZINC000663286247	732409339	/nfs/dbraw/zinc/40/93/39/732409339.db2.gz	QAALEYUEDBHLTJ-CYBMUJFWSA-N	-1	0	366.464	2.604	50	0		FFAARM
Cc1c(C(=O)[O-])cnn1-c1ccc(C(=O)N2C[C@H](C)OC(C)(C)C2)cc1	ZINC000137136890	971525418	/nfs/dbraw/zinc/52/54/18/971525418.db2.gz	KHSCQIPQHIABOJ-LBPRGKRZSA-N	-1	0	357.410	2.518	50	0		FFAARM
O=C([O-])c1cc(O)cc(C(=O)N[C@@H]2CCCN(Cc3ccccc3F)C2)c1	ZINC000952986972	1011043779	/nfs/dbraw/zinc/04/37/79/1011043779.db2.gz	HPSZQBQLGBHVFS-MRXNPFEDSA-N	-1	0	372.396	2.624	50	0		FFAARM
C[C@@H](NC(=O)Nc1ccnn1Cc1ccccn1)[C@@H]1C[C@H](C(=O)[O-])C1(C)C	ZINC000653541412	1024936930	/nfs/dbraw/zinc/93/69/30/1024936930.db2.gz	OWTHHIWVHAEFGN-VHDGCEQUSA-N	-1	0	371.441	2.583	50	0		FFAARM
CN(Cc1ccc2ncccc2c1)C(=O)c1ccc(N2CC(=O)N=C2[O-])cc1	ZINC001506407080	1059498559	/nfs/dbraw/zinc/49/85/59/1059498559.db2.gz	IFNXMHNGJYGCEI-UHFFFAOYSA-N	-1	0	374.400	2.563	50	0		FFAARM
CCn1c(NCc2nc3cc(OC)ccc3[nH]2)nc2cc(C(=O)[O-])cnc21	ZINC001506413603	1059504345	/nfs/dbraw/zinc/50/43/45/1059504345.db2.gz	JBXJAOKOFKOYQH-UHFFFAOYSA-N	-1	0	366.381	2.646	50	0		FFAARM
COc1cccc([C@@H](C)N(C)S(=O)(=O)c2cc(C(=O)[O-])ccc2F)c1	ZINC001506428005	1059514078	/nfs/dbraw/zinc/51/40/78/1059514078.db2.gz	WTKROKRZISEPHR-LLVKDONJSA-N	-1	0	367.398	2.914	50	0		FFAARM
CCOc1ccc([C@H](CC(=O)[O-])NS(=O)(=O)c2ccc(C)cc2)cc1	ZINC000001131374	203985658	/nfs/dbraw/zinc/98/56/58/203985658.db2.gz	FSTMZBGKAUYQOV-KRWDZBQOSA-N	-1	0	363.435	2.888	50	0		FFAARM
COc1cc2[n-]c(=S)n(Cc3ccc4c(c3)OCO4)c(=O)c2cc1OC	ZINC000002194788	204028852	/nfs/dbraw/zinc/02/88/52/204028852.db2.gz	ZYKYOXKWKCZXHJ-UHFFFAOYSA-N	-1	0	372.402	2.853	50	0		FFAARM
CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)C)C(=O)[O-]	ZINC000002243012	204029865	/nfs/dbraw/zinc/02/98/65/204029865.db2.gz	WRWKLZMOFAMVPZ-BPUTZDHNSA-N	-1	0	364.442	2.553	50	0		FFAARM
COc1ccc([C@@H]2N[C@H](C(=O)[O-])CS2)cc1COCC(F)(F)F	ZINC000003013663	204073268	/nfs/dbraw/zinc/07/32/68/204073268.db2.gz	ROVUMDZPGHDPPQ-CMPLNLGQSA-N	-1	0	351.346	2.562	50	0		FFAARM
CC(C)(C)c1ccc(OC[C@H](O)CNC(=O)c2ccccc2C(=O)[O-])cc1	ZINC000004122026	204122057	/nfs/dbraw/zinc/12/20/57/204122057.db2.gz	SDKHNHXSAASUNH-OAHLLOKOSA-N	-1	0	371.433	2.852	50	0		FFAARM
CC(C)Oc1ccc([C@H](CC(=O)[O-])NS(=O)(=O)c2ccccc2)cc1	ZINC000004580862	204148453	/nfs/dbraw/zinc/14/84/53/204148453.db2.gz	WDLNFWDZMXZPLQ-KRWDZBQOSA-N	-1	0	363.435	2.968	50	0		FFAARM
COc1ccc(C(=O)N[C@@H](CC(=O)[O-])c2ccc(OC)c(OC)c2)cc1	ZINC000004689546	204155365	/nfs/dbraw/zinc/15/53/65/204155365.db2.gz	RALWDDQKQRAAGT-HNNXBMFYSA-N	-1	0	359.378	2.658	50	0	biogenic	FFAARM
Cc1nccc([N-]S(=O)(=O)c2ccc(NC(=O)c3ccccc3)cc2)n1	ZINC000004756607	204161938	/nfs/dbraw/zinc/16/19/38/204161938.db2.gz	OUVLITFUIHZNCY-UHFFFAOYSA-N	-1	0	368.418	2.838	50	0		FFAARM
O=C([O-])c1cccc(NC(=O)CSc2nnc(-c3cccnc3)o2)c1	ZINC000004769868	204162836	/nfs/dbraw/zinc/16/28/36/204162836.db2.gz	YHAKDPYILIRIDI-UHFFFAOYSA-N	-1	0	356.363	2.561	50	0		FFAARM
O=C([O-])c1nccnc1C(=O)NCCSCc1c(F)cccc1Cl	ZINC000004324973	204134339	/nfs/dbraw/zinc/13/43/39/204134339.db2.gz	YAPFBLQFKJCRCG-UHFFFAOYSA-N	-1	0	369.805	2.631	50	0		FFAARM
COc1cccc([C@H]2[C@@H](C(=O)[O-])c3cc(OC)c(OC)cc3C(=O)N2C)c1	ZINC000004563435	204147182	/nfs/dbraw/zinc/14/71/82/204147182.db2.gz	OBUCYFWXYBYFPV-ROUUACIJSA-N	-1	0	371.389	2.708	50	0		FFAARM
O=C1CCc2cc(S(=O)(=O)[N-]c3cc(Cl)ccc3O)ccc2O1	ZINC000004988149	204183193	/nfs/dbraw/zinc/18/31/93/204183193.db2.gz	WUZUWIZMXMUBBZ-UHFFFAOYSA-N	-1	0	353.783	2.698	50	0		FFAARM
CC(C)C[C@@H](NC(=O)/C(=C\c1ccccc1)NC(=O)c1ccco1)C(=O)[O-]	ZINC000005092887	204192320	/nfs/dbraw/zinc/19/23/20/204192320.db2.gz	RZEPHDIOWHZEQV-ASNKMWSDSA-N	-1	0	370.405	2.666	50	0		FFAARM
CC(C)[C@H](NC(=O)c1cccc2c1C(=O)N(c1ccccc1)C2)C(=O)[O-]	ZINC000005206045	204197499	/nfs/dbraw/zinc/19/74/99/204197499.db2.gz	YLLUZRXAPNXNAI-KRWDZBQOSA-N	-1	0	352.390	2.686	50	0		FFAARM
CCNc1nc([N-]c2nc(C)c(C(=O)OCC)s2)nc(NC(C)C)n1	ZINC000005709048	204221562	/nfs/dbraw/zinc/22/15/62/204221562.db2.gz	GKKUEHGDFWZACS-UHFFFAOYSA-N	-1	0	365.463	2.809	50	0		FFAARM
CNC(=O)c1ccc([N-]S(=O)(=O)c2ccccc2C(F)(F)F)cc1	ZINC000007054420	204288267	/nfs/dbraw/zinc/28/82/67/204288267.db2.gz	BFGFJQYKUYEVRR-UHFFFAOYSA-N	-1	0	358.341	2.866	50	0		FFAARM
CCOC(=O)c1cc(S(=O)(=O)[N-]c2cccc(SC)c2)cn1C	ZINC000006777961	204269485	/nfs/dbraw/zinc/26/94/85/204269485.db2.gz	UHAFBXPOIDWZFN-UHFFFAOYSA-N	-1	0	354.453	2.725	50	0		FFAARM
O=c1c2ccc(C(F)(F)F)cc2[n-]c(=S)n1CCCN1CCOCC1	ZINC000007988178	204313382	/nfs/dbraw/zinc/31/33/82/204313382.db2.gz	CGFVYTVWDSSQAC-UHFFFAOYSA-N	-1	0	373.400	2.800	50	0		FFAARM
CCCOC(=O)c1ccc(N2C(=O)c3ccc(C(=O)[O-])cc3C2=O)cc1	ZINC000008433950	204330829	/nfs/dbraw/zinc/33/08/29/204330829.db2.gz	QGDKSFMFDCRKCL-UHFFFAOYSA-N	-1	0	353.330	2.752	50	0		FFAARM
CCc1ccccc1NC(=O)c1sc2[nH]c(=O)c(C(=O)[O-])cc2c1N	ZINC000009109313	204354483	/nfs/dbraw/zinc/35/44/83/204354483.db2.gz	HHQLUDBYFJVHGR-UHFFFAOYSA-N	-1	0	357.391	2.685	50	0		FFAARM
O=C([O-])[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(-n2cccn2)cc1	ZINC000013260043	204525827	/nfs/dbraw/zinc/52/58/27/204525827.db2.gz	FHKKFBPJUSWOPM-IBGZPJMESA-N	-1	0	374.400	2.779	50	0		FFAARM
COc1ccc(Cl)cc1S(=O)(=O)N(CC(=O)[O-])Cc1ccccc1	ZINC000039315659	205045292	/nfs/dbraw/zinc/04/52/92/205045292.db2.gz	LTBWURQFIMVBOJ-UHFFFAOYSA-N	-1	0	369.826	2.624	50	0		FFAARM
COc1cccc(CSc2sc3c([nH]c(=O)cc3[O-])c2C(N)=O)c1	ZINC000040286945	205065714	/nfs/dbraw/zinc/06/57/14/205065714.db2.gz	RUVRDAYSJQHBSO-UHFFFAOYSA-N	-1	0	362.432	2.695	50	0		FFAARM
COc1cc2c(cc1OC)[C@@H](CC(=O)[O-])N(C(=O)c1occc1C)CC2	ZINC000299384657	205093970	/nfs/dbraw/zinc/09/39/70/205093970.db2.gz	IBEJRIBDUONIMC-CQSZACIVSA-N	-1	0	359.378	2.820	50	0		FFAARM
Cc1c(C(=O)[O-])cnn1-c1ccc(C(=O)N(C[C@H]2CCOC2)C2CC2)cc1	ZINC000299740537	205117140	/nfs/dbraw/zinc/11/71/40/205117140.db2.gz	BKTNEIJLQFMLAD-CQSZACIVSA-N	-1	0	369.421	2.520	50	0		FFAARM
Cc1c(C(=O)[O-])cnn1-c1ccc(C(=O)N(C[C@@H]2CCOC2)C2CC2)cc1	ZINC000299740536	205117894	/nfs/dbraw/zinc/11/78/94/205117894.db2.gz	BKTNEIJLQFMLAD-AWEZNQCLSA-N	-1	0	369.421	2.520	50	0		FFAARM
COc1ccc(CNC(=O)[C@@H]2Cc3cc(Cl)ccc3O2)cc1C(=O)[O-]	ZINC000299745973	205127909	/nfs/dbraw/zinc/12/79/09/205127909.db2.gz	UJXHABYGZMRSND-INIZCTEOSA-N	-1	0	361.781	2.667	50	0		FFAARM
Cc1ccc(F)cc1S(=O)(=O)[N-]c1ccn(CCc2ccccn2)n1	ZINC000057784631	205243818	/nfs/dbraw/zinc/24/38/18/205243818.db2.gz	MIIDXHXOOCIAJJ-UHFFFAOYSA-N	-1	0	360.414	2.769	50	0		FFAARM
Cn1c2ccc(NC(=O)CC3(CC(=O)[O-])CCCCC3)cc2n(C)c1=O	ZINC000064611604	205302371	/nfs/dbraw/zinc/30/23/71/205302371.db2.gz	OELSGBPPDHHBCY-UHFFFAOYSA-N	-1	0	359.426	2.631	50	0		FFAARM
CCOc1ccccc1[N-]S(=O)(=O)c1c(C)nc2sc(CC)nn21	ZINC000065183776	205322223	/nfs/dbraw/zinc/32/22/23/205322223.db2.gz	MXKVBXANBZYCJU-UHFFFAOYSA-N	-1	0	366.468	2.861	50	0		FFAARM
CCc1nn2c(nc(C)c2S(=O)(=O)[N-]c2cccc(C(C)=O)c2)s1	ZINC000065183764	205322249	/nfs/dbraw/zinc/32/22/49/205322249.db2.gz	MBOQKHMANLUDNZ-UHFFFAOYSA-N	-1	0	364.452	2.665	50	0		FFAARM
CCn1cc(S(=O)(=O)[N-]c2cc(OC)cc(OC)c2)c2cccnc21	ZINC000065242149	205328154	/nfs/dbraw/zinc/32/81/54/205328154.db2.gz	JGQDBRRLQLBDTJ-UHFFFAOYSA-N	-1	0	361.423	2.874	50	0		FFAARM
Cc1cccc(-n2ncc3c2[nH]c(=O)c(C(=O)NCc2ccccc2)c3[O-])c1	ZINC000065249916	205329290	/nfs/dbraw/zinc/32/92/90/205329290.db2.gz	ZISIAUZGBHDXAX-UHFFFAOYSA-N	-1	0	374.400	2.658	50	0		FFAARM
CCOC(=O)c1c(C)c(S(=O)(=O)[N-]c2ccccc2C)c(C)n1C	ZINC000064863206	205307008	/nfs/dbraw/zinc/30/70/08/205307008.db2.gz	ZWXSGNOJMLAAFG-UHFFFAOYSA-N	-1	0	350.440	2.928	50	0		FFAARM
COc1ccc(C)cc1[N-]S(=O)(=O)c1ccc2c(c1)sc(=O)n2C	ZINC000064947095	205310008	/nfs/dbraw/zinc/31/00/08/205310008.db2.gz	BKYQKZPTUFGHQD-UHFFFAOYSA-N	-1	0	364.448	2.718	50	0		FFAARM
COc1ccc(NC(=O)Cn2[n-]c(-c3ccc(F)cc3)cc2=O)c(C)c1	ZINC000065133012	205319677	/nfs/dbraw/zinc/31/96/77/205319677.db2.gz	LIPNCDJMWHYRPB-UHFFFAOYSA-N	-1	0	355.369	2.938	50	0		FFAARM
CC1(C)[C@H](C(=O)Nc2ccc(Cl)c(C(=O)NC3CC3)c2)[C@@H]1C(=O)[O-]	ZINC000071288306	205424747	/nfs/dbraw/zinc/42/47/47/205424747.db2.gz	RTRMKBSREUZDMA-QWHCGFSZSA-N	-1	0	350.802	2.528	50	0		FFAARM
O=C([O-])[C@H](c1ccc(Cl)c(F)c1)N1CCN(Cc2ccccn2)CC1	ZINC000095383102	205745314	/nfs/dbraw/zinc/74/53/14/205745314.db2.gz	MLFWOEVTMLFYQT-KRWDZBQOSA-N	-1	0	363.820	2.818	50	0		FFAARM
CC1CCN(S(=O)(=O)N2CCC[C@H](c3cccc(C(=O)[O-])c3)C2)CC1	ZINC000095387456	205749725	/nfs/dbraw/zinc/74/97/25/205749725.db2.gz	VYNRAAONSRDCOA-KRWDZBQOSA-N	-1	0	366.483	2.541	50	0		FFAARM
COc1cc(CNC(=O)c2ccccc2Cn2cccn2)ccc1C(=O)[O-]	ZINC000095989549	205800721	/nfs/dbraw/zinc/80/07/21/205800721.db2.gz	JUQCLGFZDMPRQE-UHFFFAOYSA-N	-1	0	365.389	2.568	50	0		FFAARM
COc1ccc(Cn2[nH][n-]c3c(=O)n(-c4cccc(Cl)c4)c(=O)c2=3)cc1	ZINC000101418085	205960366	/nfs/dbraw/zinc/96/03/66/205960366.db2.gz	HUGQHDQFZAMNIF-HOTGVXAUSA-N	-1	0	370.796	2.842	50	0		FFAARM
COc1ccccc1CCNC(=O)Cc1csc([N-]c2ncccn2)n1	ZINC000049029388	206085501	/nfs/dbraw/zinc/08/55/01/206085501.db2.gz	QQDGLPJLUNXJPM-UHFFFAOYSA-N	-1	0	369.450	2.587	50	0		FFAARM
Cc1nn(Cc2cccc(Cl)c2)cc1C(=O)N1CCCC[C@H]1C(=O)[O-]	ZINC000128587752	206123102	/nfs/dbraw/zinc/12/31/02/206123102.db2.gz	UQURAOITPIFQQC-INIZCTEOSA-N	-1	0	361.829	2.973	50	0		FFAARM
COc1cc([N-]S(=O)(=O)c2ccc(C)s2)ccc1N1CCCC1=O	ZINC000005329404	206194802	/nfs/dbraw/zinc/19/48/02/206194802.db2.gz	YGOWPFYZVHWPAM-UHFFFAOYSA-N	-1	0	366.464	2.993	50	0		FFAARM
COc1ccc(C(C)(C)C(=O)[N-]S(=O)(=O)c2sc(C)nc2C)cc1	ZINC000155824250	206222786	/nfs/dbraw/zinc/22/27/86/206222786.db2.gz	JOFDFUIMSGGGRY-UHFFFAOYSA-N	-1	0	368.480	2.551	50	0		FFAARM
CCOC(=O)c1ccc(NS(=O)(=O)c2ccc(OC)c(OC)c2)cc1	ZINC000003662216	206234526	/nfs/dbraw/zinc/23/45/26/206234526.db2.gz	CILNVHISQKNILE-UHFFFAOYSA-N	-1	0	365.407	2.681	50	0		FFAARM
CCCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](C(=O)[O-])C(C)C	ZINC000004760613	206238600	/nfs/dbraw/zinc/23/86/00/206238600.db2.gz	SPAQWPZGFYWELB-JKSUJKDBSA-N	-1	0	364.442	2.697	50	0		FFAARM
CC(=O)NCc1ccc(NC(=O)CC2(C(=O)[O-])Cc3ccccc3C2)cc1	ZINC000169985799	206268289	/nfs/dbraw/zinc/26/82/89/206268289.db2.gz	XYVCNRFPORNNBE-UHFFFAOYSA-N	-1	0	366.417	2.521	50	0		FFAARM
CCOc1ccc([C@@H](c2sc3nc(C)nn3c2[O-])N2CCOCC2)cc1	ZINC000022626649	206388106	/nfs/dbraw/zinc/38/81/06/206388106.db2.gz	FQNMWHYCTWMIET-HNNXBMFYSA-N	-1	0	374.466	2.625	50	0		FFAARM
O=C([O-])[C@@H]1CCCN(S(=O)(=O)Cc2c(Cl)cccc2Cl)C1	ZINC000226087391	206508298	/nfs/dbraw/zinc/50/82/98/206508298.db2.gz	ADFGVFHGIGFRKP-SECBINFHSA-N	-1	0	352.239	2.620	50	0		FFAARM
CC[C@H](C)[C@@H](NC(=O)CCc1nc(-c2ccc3cc[nH]c3c2)no1)C(=O)[O-]	ZINC000252552022	206580969	/nfs/dbraw/zinc/58/09/69/206580969.db2.gz	ULUVSAUIWNKOPX-APPDUMDISA-N	-1	0	370.409	2.766	50	0		FFAARM
C[C@@H](C(=O)N(C)C)S(=O)(=O)[N-]c1ccc(Cl)cc1C(F)(F)F	ZINC000278624545	256332539	/nfs/dbraw/zinc/33/25/39/256332539.db2.gz	SSNOIPKGWIZGKH-ZETCQYMHSA-N	-1	0	358.769	2.577	50	0		FFAARM
Cc1nccc(N2CCC(Oc3ccc4c(c3)CCC4)(C(=O)[O-])CC2)n1	ZINC000082091326	132193750	/nfs/dbraw/zinc/19/37/50/132193750.db2.gz	SEEFHPJPGBFYAH-UHFFFAOYSA-N	-1	0	353.422	2.776	50	0		FFAARM
CCc1cc(N2CCC(Oc3ccccc3OC)(C(=O)[O-])CC2)nc(C)n1	ZINC000082115470	132195647	/nfs/dbraw/zinc/19/56/47/132195647.db2.gz	LRAUAUABRGOQPE-UHFFFAOYSA-N	-1	0	371.437	2.859	50	0		FFAARM
CN1C[C@]2(CCCN(c3nc(-c4ccccc4)ccc3C(=O)[O-])C2)OC1=O	ZINC000072407851	136145220	/nfs/dbraw/zinc/14/52/20/136145220.db2.gz	GWUDTPHUMYJEHC-FQEVSTJZSA-N	-1	0	367.405	2.868	50	0		FFAARM
CCCCNC(=O)c1ccc2c(c1)[n-]c(=S)n(C[C@H]1CCCO1)c2=O	ZINC000002970803	263327440	/nfs/dbraw/zinc/32/74/40/263327440.db2.gz	KQHZRLWSXLBHJM-CYBMUJFWSA-N	-1	0	361.467	2.768	50	0		FFAARM
O=C([O-])c1ccc(NS(=O)(=O)c2ccc(Br)cc2)cc1	ZINC000000704476	506228360	/nfs/dbraw/zinc/22/83/60/506228360.db2.gz	LKXOWYHVOFFRHD-UHFFFAOYSA-N	-1	0	356.197	2.948	50	0		FFAARM
CC(C)n1ncc2cc([N-]S(=O)(=O)c3cccc4nsnc43)cnc21	ZINC000032098005	506231582	/nfs/dbraw/zinc/23/15/82/506231582.db2.gz	YXKAKCHHMPVUOQ-UHFFFAOYSA-N	-1	0	374.451	2.818	50	0		FFAARM
CCc1nnc([N-]S(=O)(=O)c2ccc(OC(F)(F)F)cc2)s1	ZINC000001047742	506246273	/nfs/dbraw/zinc/24/62/73/506246273.db2.gz	ZTJPSGLGESZROP-UHFFFAOYSA-N	-1	0	353.347	2.800	50	0		FFAARM
CCCN1C(=O)c2ccc(C(=O)Nc3ccc(CC(=O)[O-])cc3)cc2C1=O	ZINC000001061154	506246301	/nfs/dbraw/zinc/24/63/01/506246301.db2.gz	ROFXIJQHHSYPDD-UHFFFAOYSA-N	-1	0	366.373	2.572	50	0		FFAARM
CC[C@]1(c2ccccc2)C(=O)[N-]C(=O)N(C(=O)c2cccc(Cl)c2)C1=O	ZINC000001216352	506257259	/nfs/dbraw/zinc/25/72/59/506257259.db2.gz	CVIJAXUUHVXWDD-IBGZPJMESA-N	-1	0	370.792	2.907	50	0		FFAARM
CCN1CCCn2cc(S(=O)(=O)[N-]c3cc(F)ccc3C)cc2C1=O	ZINC000065258798	506277596	/nfs/dbraw/zinc/27/75/96/506277596.db2.gz	HJHRCBNSDMWOFF-UHFFFAOYSA-N	-1	0	365.430	2.602	50	0		FFAARM
CC(=O)Nc1ccc(N2CCN(Cc3cccc(F)c3)CC2)c(C(=O)[O-])c1	ZINC000033078821	506332774	/nfs/dbraw/zinc/33/27/74/506332774.db2.gz	PBKFSANFNKZZNM-UHFFFAOYSA-N	-1	0	371.412	2.805	50	0		FFAARM
O=C(CCc1nnc(-c2cccc(F)c2)[n-]c1=O)NCc1ccc(F)cc1	ZINC000034768583	506370410	/nfs/dbraw/zinc/37/04/10/506370410.db2.gz	FTMSLXVFMVZZND-UHFFFAOYSA-N	-1	0	370.359	2.771	50	0		FFAARM
Cc1cccc(-c2nnc(CCC(=O)NCCc3ccccc3)c(=O)[n-]2)c1	ZINC000034768702	506370487	/nfs/dbraw/zinc/37/04/87/506370487.db2.gz	BUUJLSQANIXTSB-UHFFFAOYSA-N	-1	0	362.433	2.844	50	0		FFAARM
CN(C)S(=O)(=O)c1ccc(Sc2ccccc2CC(=O)[O-])cc1	ZINC000006637873	506493518	/nfs/dbraw/zinc/49/35/18/506493518.db2.gz	MTHVYELTKBYKOI-UHFFFAOYSA-N	-1	0	351.449	2.715	50	0		FFAARM
CC(Nc1ccc(N(C)C)cc1)=C1C(=O)[N-]C(=O)N(c2ccccc2)C1=O	ZINC000009013834	506678310	/nfs/dbraw/zinc/67/83/10/506678310.db2.gz	HKRWYLDXYLEKNN-GHRIWEEISA-N	-1	0	364.405	2.722	50	0		FFAARM
O=C([O-])[C@]1(NC(=O)c2ccc(Br)cc2Cl)CCSC1	ZINC000043511091	506752950	/nfs/dbraw/zinc/75/29/50/506752950.db2.gz	CYIGERIAYYRHOH-LBPRGKRZSA-N	-1	0	364.648	2.793	50	0		FFAARM
CS(=O)(=O)Nc1cccc([N-]S(=O)(=O)c2ccccc2Cl)c1	ZINC000012520974	506870814	/nfs/dbraw/zinc/87/08/14/506870814.db2.gz	AAMBXKMCPZOTHQ-UHFFFAOYSA-N	-1	0	360.844	2.512	50	0		FFAARM
O=C([O-])c1ccc(S(=O)(=O)Nc2cccc(NC(=O)C3CC3)c2)cc1	ZINC000012526189	506872902	/nfs/dbraw/zinc/87/29/02/506872902.db2.gz	ZKKJGBBFCBRUPA-UHFFFAOYSA-N	-1	0	360.391	2.534	50	0		FFAARM
Cc1cccc(OCC(=O)N(C)Cc2nc(=O)c3sccc3[n-]2)c1C	ZINC000012765573	506897293	/nfs/dbraw/zinc/89/72/93/506897293.db2.gz	PJBINYMCIIMGLC-UHFFFAOYSA-N	-1	0	357.435	2.639	50	0		FFAARM
Cc1ccc(C)c(S(=O)(=O)n2cc(C(=O)c3ccccc3[O-])cn2)c1	ZINC000014166284	506974479	/nfs/dbraw/zinc/97/44/79/506974479.db2.gz	SBTMKEQCUHOGGT-UHFFFAOYSA-N	-1	0	356.403	2.674	50	0		FFAARM
Cc1cccn2c(CNCc3nc(-c4ccc(C(=O)[O-])cc4)no3)cnc12	ZINC000067973616	507072579	/nfs/dbraw/zinc/07/25/79/507072579.db2.gz	ZJPVDAFNZNCILR-UHFFFAOYSA-N	-1	0	363.377	2.681	50	0		FFAARM
C[C@H]1CCc2c(sc(NC(=O)CCCC(=O)[O-])c2C(=O)NC2CC2)C1	ZINC000017074938	507115468	/nfs/dbraw/zinc/11/54/68/507115468.db2.gz	XRIDBFCGARFCPD-JTQLQIEISA-N	-1	0	364.467	2.959	50	0		FFAARM
CCN1c2ccc([N-]S(=O)(=O)c3cc(C)ccc3OC)cc2CC1=O	ZINC000017288960	507119341	/nfs/dbraw/zinc/11/93/41/507119341.db2.gz	LVSDCSHHDRTDFU-UHFFFAOYSA-N	-1	0	360.435	2.713	50	0		FFAARM
Cc1cc(=O)n2nc(CN(C(=O)c3ccccc3)c3ccccc3)[n-]c2n1	ZINC000021796035	507269510	/nfs/dbraw/zinc/26/95/10/507269510.db2.gz	GCAIOXOUMOLPPQ-UHFFFAOYSA-N	-1	0	359.389	2.573	50	0		FFAARM
C[C@@]1(C(=O)[O-])CCN(C(=O)C2(c3ccc(Br)cc3)CC2)C1	ZINC000062913484	507688417	/nfs/dbraw/zinc/68/84/17/507688417.db2.gz	ZBHIXIDRABQUPM-OAHLLOKOSA-N	-1	0	352.228	2.804	50	0		FFAARM
COc1ccc(NC(=O)[C@H]2[C@H](C(=O)[O-])C2(C)C)cc1NC(=O)C1CCC1	ZINC000071285513	507700268	/nfs/dbraw/zinc/70/02/68/507700268.db2.gz	RBYPOAPBDUQLQN-HUUCEWRRSA-N	-1	0	360.410	2.729	50	0		FFAARM
O=C([O-])c1nccnc1C(=O)Nc1ccc(NC(=O)C2CCC2)c(Cl)c1	ZINC000071285544	507701068	/nfs/dbraw/zinc/70/10/68/507701068.db2.gz	DVBHJXFBPJNFOW-UHFFFAOYSA-N	-1	0	374.784	2.819	50	0		FFAARM
COc1cc(Cl)cc(CN2CCOC[C@H]2CC(=O)[O-])c1OC(C)C	ZINC000072135325	507755640	/nfs/dbraw/zinc/75/56/40/507755640.db2.gz	YJSBFNZQHBTNDN-CQSZACIVSA-N	-1	0	357.834	2.811	50	0		FFAARM
O=C([O-])CCc1cc2n(n1)CCCN(C(=O)CCCc1cccs1)C2	ZINC000072428407	507789184	/nfs/dbraw/zinc/78/91/84/507789184.db2.gz	BCYSMXBXPZYTRD-UHFFFAOYSA-N	-1	0	361.467	2.717	50	0		FFAARM
Cc1ccccc1[C@@H]1CN(C(=O)c2scc3c2OCCO3)C[C@H]1C(=O)[O-]	ZINC000091445148	507986143	/nfs/dbraw/zinc/98/61/43/507986143.db2.gz	JXABOTGGRTWNNP-UONOGXRCSA-N	-1	0	373.430	2.768	50	0		FFAARM
CC[C@]1(C(=O)[O-])CCCN(C(=O)c2c(Cl)c(C(F)(F)F)nn2C)C1	ZINC000091602563	507995691	/nfs/dbraw/zinc/99/56/91/507995691.db2.gz	PMSFOTAWXLMTHA-ZDUSSCGKSA-N	-1	0	367.755	2.809	50	0		FFAARM
COCC[C@]1(C(=O)[O-])CCCN(C(=O)CCCc2ccc(F)cc2)C1	ZINC000091755525	508008945	/nfs/dbraw/zinc/00/89/45/508008945.db2.gz	WZFLWXNKKCFLCI-LJQANCHMSA-N	-1	0	351.418	2.878	50	0		FFAARM
COc1ccc(OC)c([N-]S(=O)(=O)c2cc(-c3cc[nH]n3)oc2C)c1	ZINC000075518915	508113280	/nfs/dbraw/zinc/11/32/80/508113280.db2.gz	WVXBFZZLRAROMF-UHFFFAOYSA-N	-1	0	363.395	2.796	50	0		FFAARM
COCCN1CCN([C@@H](C(=O)[O-])c2cccc3c4ccccc4oc32)CC1	ZINC000095363728	508176827	/nfs/dbraw/zinc/17/68/27/508176827.db2.gz	LMSXUIPOSAQCEY-LJQANCHMSA-N	-1	0	368.433	2.976	50	0		FFAARM
CCCc1cc(C(=O)N[C@@H](C(=O)[O-])c2ccc(F)c(Cl)c2)n(C)n1	ZINC000095366044	508177486	/nfs/dbraw/zinc/17/74/86/508177486.db2.gz	YDGFATHECUQFPA-CQSZACIVSA-N	-1	0	353.781	2.721	50	0		FFAARM
CC(C)Oc1ccc([C@H](C(=O)[O-])N2CCN(Cc3ccccn3)CC2)cc1	ZINC000095384681	508182298	/nfs/dbraw/zinc/18/22/98/508182298.db2.gz	LZSAZTPCPNZQNR-HXUWFJFHSA-N	-1	0	369.465	2.812	50	0		FFAARM
Cn1cc(S(=O)(=O)[N-]c2csc(-c3ccccc3)c2)cc1C(N)=O	ZINC000095459695	508186202	/nfs/dbraw/zinc/18/62/02/508186202.db2.gz	FSFXYKSCICDBNF-UHFFFAOYSA-N	-1	0	361.448	2.653	50	0		FFAARM
Cc1oc(-c2cccc(C)c2)nc1CN1Cc2nc[nH]c2C[C@@H]1C(=O)[O-]	ZINC000095509935	508192761	/nfs/dbraw/zinc/19/27/61/508192761.db2.gz	HOJZRZOIBKINQS-QGZVFWFLSA-N	-1	0	352.394	2.693	50	0		FFAARM
O=C([O-])[C@@H]1Cc2[nH]cnc2CN1C(=O)c1ccc(-c2ccccc2Cl)o1	ZINC000095520336	508194809	/nfs/dbraw/zinc/19/48/09/508194809.db2.gz	YKPBQUHOGQKDED-AWEZNQCLSA-N	-1	0	371.780	2.975	50	0		FFAARM
COCCOc1ccc(S(=O)(=O)[N-]c2cc(C)nc(C(C)C)n2)cc1	ZINC000095944104	508198692	/nfs/dbraw/zinc/19/86/92/508198692.db2.gz	IYAROZMKRAJQOR-UHFFFAOYSA-N	-1	0	365.455	2.734	50	0		FFAARM
Cc1ccc(F)cc1C(=O)N1C[C@@H]2c3ccccc3OC[C@]2(C(=O)[O-])C1	ZINC000096180904	508209685	/nfs/dbraw/zinc/20/96/85/508209685.db2.gz	SPOCRVAKXLMGEK-OXQOHEQNSA-N	-1	0	355.365	2.837	50	0		FFAARM
COC(=O)C[C@@H](c1ccc(C(=O)[O-])cc1)c1c2[nH]snc-2ccc1=O	ZINC000096232347	508212070	/nfs/dbraw/zinc/21/20/70/508212070.db2.gz	AMWHDUXFCSAZHT-NSHDSACASA-N	-1	0	358.375	2.790	50	0		FFAARM
COc1ccc(-n2c(=O)c3[n-][nH]n(-c4ccc(F)c(Cl)c4)c=3c2=O)cc1	ZINC000097076905	508218292	/nfs/dbraw/zinc/21/82/92/508218292.db2.gz	JLCQVCJVEGUNCQ-LSDHHAIUSA-N	-1	0	374.759	2.986	50	0		FFAARM
Cc1cccc(Cn2[nH][n-]c3c(=O)n(-c4ccc(F)c(F)c4)c(=O)c2=3)c1	ZINC000101168166	508240917	/nfs/dbraw/zinc/24/09/17/508240917.db2.gz	FOPMKNFNBXRFIQ-JKSUJKDBSA-N	-1	0	356.332	2.767	50	0		FFAARM
CCc1ccc(-n2c(=O)c3[n-][nH]n(Cc4cccc(OC)c4)c=3c2=O)cc1	ZINC000101168033	508240935	/nfs/dbraw/zinc/24/09/35/508240935.db2.gz	FLHXHDCMVVSUNQ-ROUUACIJSA-N	-1	0	364.405	2.751	50	0		FFAARM
COc1cccc(-n2c(=O)c3[n-][nH]n(-c4ccc(C)c(F)c4)c=3c2=O)c1	ZINC000101261251	508241063	/nfs/dbraw/zinc/24/10/63/508241063.db2.gz	IYJZKTTYPQKFPS-JKSUJKDBSA-N	-1	0	354.341	2.641	50	0		FFAARM
O=c1c2[n-][nH]n(Cc3ccc(Cl)cc3)c=2c(=O)n1-c1ccc(F)cc1	ZINC000101272081	508241193	/nfs/dbraw/zinc/24/11/93/508241193.db2.gz	HBRFSERQPLYUFB-LSDHHAIUSA-N	-1	0	358.760	2.973	50	0		FFAARM
Cc1ccc(Cn2[nH][n-]c3c(=O)n(-c4ccc(F)c(F)c4)c(=O)c2=3)cc1	ZINC000101418109	508241419	/nfs/dbraw/zinc/24/14/19/508241419.db2.gz	GIVYTRMNKCEZMN-JKSUJKDBSA-N	-1	0	356.332	2.767	50	0		FFAARM
Cn1c(=O)c2ccc(C(=O)NCc3ccccc3Cl)cc2[n-]c1=S	ZINC000102177070	508269470	/nfs/dbraw/zinc/26/94/70/508269470.db2.gz	GRZIDTOPLNFAMZ-UHFFFAOYSA-N	-1	0	359.838	2.806	50	0		FFAARM
C[C@]1(CNC(=O)c2nn(-c3ccccc3C(F)(F)F)cc2[O-])CCCO1	ZINC000153109065	508548256	/nfs/dbraw/zinc/54/82/56/508548256.db2.gz	OJTKKHKYMHWEQH-MRXNPFEDSA-N	-1	0	369.343	2.896	50	0		FFAARM
CCNS(=O)(=O)c1c(Br)cc(C)cc1Br	ZINC000173005446	509345385	/nfs/dbraw/zinc/34/53/85/509345385.db2.gz	YYLVYMFRLDLXDQ-UHFFFAOYSA-N	-1	0	357.067	2.818	50	0		FFAARM
CCC[C@H](NC(=O)C[C@@H](NC(=O)c1ccccc1)c1ccccc1)C(=O)[O-]	ZINC000225484674	509373574	/nfs/dbraw/zinc/37/35/74/509373574.db2.gz	IJWNUFTYMLJFEL-ZWKOTPCHSA-N	-1	0	368.433	2.917	50	0		FFAARM
O=S(=O)([N-]c1ncn(-c2ccccc2)n1)c1cnc2ccc(F)cc2c1	ZINC000225696119	509384580	/nfs/dbraw/zinc/38/45/80/509384580.db2.gz	HWBPRQUEXXSLEE-UHFFFAOYSA-N	-1	0	369.381	2.755	50	0		FFAARM
CC(C)(C)c1noc(CCCC(=O)N2CCC[C@H](CCC(=O)[O-])C2)n1	ZINC000236662274	509473975	/nfs/dbraw/zinc/47/39/75/509473975.db2.gz	ULVCZHMHCXNHRQ-CYBMUJFWSA-N	-1	0	351.447	2.793	50	0		FFAARM
CC(C)[S@](=O)c1ccc(C(=O)N2CCC[C@H](CCC(=O)[O-])C2)cc1	ZINC000236703125	509485663	/nfs/dbraw/zinc/48/56/63/509485663.db2.gz	LBCDLKXXRPZFQB-SHACYNPGSA-N	-1	0	351.468	2.920	50	0		FFAARM
CN(Cc1ccc(C(=O)[O-])cc1)C(=O)[C@H]1CC(=O)Nc2cc(F)ccc21	ZINC000237045985	509558299	/nfs/dbraw/zinc/55/82/99/509558299.db2.gz	TYSZMHARKHTQGO-HNNXBMFYSA-N	-1	0	356.353	2.608	50	0		FFAARM
Cc1nc(C(=O)[N-]S(=O)(=O)c2cc3c(c(Cl)c2)O[C@H](C)C3)cs1	ZINC000170628846	509686271	/nfs/dbraw/zinc/68/62/71/509686271.db2.gz	QAMRDNDOFKPPED-SSDOTTSWSA-N	-1	0	372.855	2.547	50	0		FFAARM
Cc1oc(C)c(S(=O)(=O)N[C@@H]2CCC[C@H](C(F)(F)F)C2)c1C(=O)[O-]	ZINC000237647084	509701490	/nfs/dbraw/zinc/70/14/90/509701490.db2.gz	LSGMSBXMNLNBCV-VHSXEESVSA-N	-1	0	369.361	2.994	50	0		FFAARM
O=C([O-])[C@H]1Cc2ccccc2CN1C(=O)c1c(Cl)nc2ccccn21	ZINC000238038438	509807976	/nfs/dbraw/zinc/80/79/76/509807976.db2.gz	WIJBNQULJNBTKP-CYBMUJFWSA-N	-1	0	355.781	2.639	50	0		FFAARM
Cc1ccc(S(=O)(=O)[N-]C(=O)CN2c3ccccc3CC[C@@H]2C)cc1	ZINC000253433647	509883134	/nfs/dbraw/zinc/88/31/34/509883134.db2.gz	ZQXXYJVKPZFLNW-HNNXBMFYSA-N	-1	0	358.463	2.641	50	0		FFAARM
O=C([O-])[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)CCc1nnc(-c2ccccc2)o1	ZINC000265544335	510109231	/nfs/dbraw/zinc/10/92/31/510109231.db2.gz	FIRVKGSYFSHPBG-PMPSAXMXSA-N	-1	0	369.421	2.914	50	0		FFAARM
CCOc1ccccc1Oc1ccccc1C(=O)N1CCO[C@H](C(=O)[O-])C1	ZINC000262113990	510182365	/nfs/dbraw/zinc/18/23/65/510182365.db2.gz	OQCCTUQRLYYWQX-SFHVURJKSA-N	-1	0	371.389	2.803	50	0		FFAARM
O=S(=O)([N-]c1cnc2c(c1)COCC2)c1cccc(OC(F)(F)F)c1	ZINC000361973700	511110883	/nfs/dbraw/zinc/11/08/83/511110883.db2.gz	GRRCCAHRTPINMB-UHFFFAOYSA-N	-1	0	374.340	2.854	50	0		FFAARM
CCOc1cc2c(cc1OCC)CN(C(=O)c1ccc(C(=O)[O-])nc1)CC2	ZINC000298163499	511195062	/nfs/dbraw/zinc/19/50/62/511195062.db2.gz	XFRIEUMGKHXWHN-UHFFFAOYSA-N	-1	0	370.405	2.776	50	0		FFAARM
O=C1CCCc2cc(S(=O)(=O)[N-]c3nnc(C(F)F)s3)ccc21	ZINC000294929017	511223937	/nfs/dbraw/zinc/22/39/37/511223937.db2.gz	CUUREAHHAGXYJH-UHFFFAOYSA-N	-1	0	359.379	2.796	50	0		FFAARM
Cc1ccc(S(=O)(=O)[N-]C(=O)N2CCCn3c4ccccc4nc32)cc1	ZINC000334162605	511466462	/nfs/dbraw/zinc/46/64/62/511466462.db2.gz	CILJELNLQKEKIG-UHFFFAOYSA-N	-1	0	370.434	2.653	50	0		FFAARM
Cc1ccc(S(=O)(=O)[N-]c2cccc(C(=O)[O-])c2OC(C)C)cn1	ZINC000507932590	514615531	/nfs/dbraw/zinc/61/55/31/514615531.db2.gz	FHXPYKUKWZFJHC-UHFFFAOYSA-N	-1	0	350.396	2.676	50	0		FFAARM
COc1ccccc1OCc1ccc(C(=O)N2CCC[C@@H](C(=O)[O-])C2)o1	ZINC000507713484	516287186	/nfs/dbraw/zinc/28/71/86/516287186.db2.gz	KFJGPFLGTPWDMB-CYBMUJFWSA-N	-1	0	359.378	2.804	50	0		FFAARM
CSc1ncc(C(=O)[O-])c(-c2ccc([C@@H](C)N3CCOCC3)cc2)n1	ZINC000534633688	517973410	/nfs/dbraw/zinc/97/34/10/517973410.db2.gz	IXPBHABLKIJPOS-GFCCVEGCSA-N	-1	0	359.451	2.957	50	0		FFAARM
CCc1cc(-c2ccc(C(=O)N[C@@H](C)c3n[n-]c(=N)s3)cc2)nc(C)n1	ZINC000534655096	517985028	/nfs/dbraw/zinc/98/50/28/517985028.db2.gz	RWERARCRHSYVEI-JTQLQIEISA-N	-1	0	368.466	2.939	50	0		FFAARM
CCC[C@H](C(=O)NCCc1ccc(OCC(=O)[O-])cc1)c1ccccn1	ZINC000585139537	518545761	/nfs/dbraw/zinc/54/57/61/518545761.db2.gz	VNXWSOLNBPYTHX-KRWDZBQOSA-N	-1	0	356.422	2.788	50	0		FFAARM
CCOc1c(Cl)cc(/C=C/C(=O)N2CCC[C@@H]2C(=O)[O-])cc1OC	ZINC000269083954	520592514	/nfs/dbraw/zinc/59/25/14/520592514.db2.gz	KIKLSTSLORVKDF-KTRBRXNASA-N	-1	0	353.802	2.836	50	0		FFAARM
CCC[C@@H](C)c1cc([N-]S(=O)(=O)c2ccc(C(=O)OC)cc2)n[nH]1	ZINC000079106546	520675502	/nfs/dbraw/zinc/67/55/02/520675502.db2.gz	YTPZLAWYBHBNNF-LLVKDONJSA-N	-1	0	351.428	2.901	50	0		FFAARM
COc1cc(C(=O)N2CC[C@H](C(=O)[O-])C2)cc(Cl)c1OCC(C)C	ZINC000269174685	522090462	/nfs/dbraw/zinc/09/04/62/522090462.db2.gz	JEBUUDZUWCXUOB-NSHDSACASA-N	-1	0	355.818	2.930	50	0		FFAARM
Cc1nn(CCC(=O)[O-])c(C)c1NC(=O)[C@@H]1C[C@@]12CCc1ccccc12	ZINC000630330842	522795510	/nfs/dbraw/zinc/79/55/10/522795510.db2.gz	GLUQIABFRNQRGA-OXJNMPFZSA-N	-1	0	353.422	2.817	50	0		FFAARM
CN1C(=O)C[C@@H](C(=O)N[C@@H](CC(=O)[O-])c2ccc(F)cc2)c2ccccc21	ZINC000299750013	523698986	/nfs/dbraw/zinc/69/89/86/523698986.db2.gz	MKHBBMVXKZFPLJ-CVEARBPZSA-N	-1	0	370.380	2.608	50	0		FFAARM
O=C([O-])[C@@H]1CCN(C(=O)c2ccc(-c3ccc4c(c3)OCCO4)s2)C1	ZINC000269197382	526279297	/nfs/dbraw/zinc/27/92/97/526279297.db2.gz	QHYHKLRVPUWMRF-GFCCVEGCSA-N	-1	0	359.403	2.733	50	0		FFAARM
O=C([O-])[C@@H]1COCCN1C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1	ZINC000268997500	526287437	/nfs/dbraw/zinc/28/74/37/526287437.db2.gz	XEQYUONBRGFGFS-JTQLQIEISA-N	-1	0	371.233	2.650	50	0		FFAARM
O=C([O-])[C@H]1CCN(C(=O)COc2ccccc2OCc2ccccc2)C1	ZINC000269215647	526325866	/nfs/dbraw/zinc/32/58/66/526325866.db2.gz	YBTXTGZFDUINDD-INIZCTEOSA-N	-1	0	355.390	2.578	50	0		FFAARM
O=C([O-])[C@H]1CN(C(=O)c2cc(C3CC3)nc3ccc(Cl)cc32)CCO1	ZINC000178279573	526331684	/nfs/dbraw/zinc/33/16/84/526331684.db2.gz	PJENCWHHYFURCE-MRXNPFEDSA-N	-1	0	360.797	2.691	50	0		FFAARM
O=C([O-])[C@H]1CN(C(=O)c2cc(-c3ccccc3)nc3ccccc32)CCO1	ZINC000178280882	526331745	/nfs/dbraw/zinc/33/17/45/526331745.db2.gz	LQRWIHVELUZYMC-LJQANCHMSA-N	-1	0	362.385	2.827	50	0		FFAARM
Cc1oc(CN(C)C(=O)c2cccc(N3CCCC3=O)c2)cc1C(=O)[O-]	ZINC000268942335	526769201	/nfs/dbraw/zinc/76/92/01/526769201.db2.gz	UDMVYEGWMYEUSK-UHFFFAOYSA-N	-1	0	356.378	2.685	50	0		FFAARM
Cc1oc(CN(C)C(=O)[C@@H]2CC(=O)Nc3cc(F)ccc32)cc1C(=O)[O-]	ZINC000268940437	526769942	/nfs/dbraw/zinc/76/99/42/526769942.db2.gz	RTWDKDRETOSVPV-CQSZACIVSA-N	-1	0	360.341	2.510	50	0		FFAARM
COc1ccccc1N1CCN(C(=O)CC2(CC(=O)[O-])CCCC2)CC1	ZINC000003230672	537063891	/nfs/dbraw/zinc/06/38/91/537063891.db2.gz	LPCQKRQFWBREFH-UHFFFAOYSA-N	-1	0	360.454	2.769	50	0		FFAARM
CC[C@H](C)NC(=O)c1c([O-])c2cccnc2n(-c2ccc(OC)cc2)c1=O	ZINC000101723333	570822550	/nfs/dbraw/zinc/82/25/50/570822550.db2.gz	BIAIECRVPGXRMM-LBPRGKRZSA-N	-1	0	367.405	2.628	50	0		FFAARM
COc1ccc(C)cc1NC(=O)c1ccc2c(c1)[n-]c(=S)n(C)c2=O	ZINC000102344089	570830976	/nfs/dbraw/zinc/83/09/76/570830976.db2.gz	IKWBBDQYJBHVII-UHFFFAOYSA-N	-1	0	355.419	2.792	50	0		FFAARM
COCc1cccc(NC(=O)c2ccc3c(c2)[n-]c(=S)n(C)c3=O)c1	ZINC000102396799	570831340	/nfs/dbraw/zinc/83/13/40/570831340.db2.gz	NMZXXUZUNRYBOA-UHFFFAOYSA-N	-1	0	355.419	2.621	50	0		FFAARM
CCCC(=O)N(Cc1nn2c([n-]1)nc(C)cc2=O)c1ccc(Cl)cc1	ZINC000101582833	570860019	/nfs/dbraw/zinc/86/00/19/570860019.db2.gz	LNFJCGWZAUDUED-UHFFFAOYSA-N	-1	0	359.817	2.713	50	0		FFAARM
O=C(/N=c1\[n-]nc2ccccn21)[C@@H]1C[C@H]1c1ccccc1Br	ZINC000084502246	571086889	/nfs/dbraw/zinc/08/68/89/571086889.db2.gz	ICTLYEVYGOEVPJ-NWDGAFQWSA-N	-1	0	357.211	2.656	50	0		FFAARM
O=C(/N=c1\[n-]nc2ccccn21)[C@@H]1C[C@@H]1c1ccccc1Br	ZINC000084502248	571086956	/nfs/dbraw/zinc/08/69/56/571086956.db2.gz	ICTLYEVYGOEVPJ-VXGBXAGGSA-N	-1	0	357.211	2.656	50	0		FFAARM
O=C([N-]S(=O)(=O)Cc1ccc(Cl)nc1)[C@H]1CSc2ccccc21	ZINC000118600224	571176374	/nfs/dbraw/zinc/17/63/74/571176374.db2.gz	XWGPNPNWXBIXKT-LBPRGKRZSA-N	-1	0	368.867	2.571	50	0		FFAARM
C[C@](CC(=O)[O-])(C(=O)Nc1ccc2c(c1)C(=O)NCC2)C1CCCCC1	ZINC000169988588	571260353	/nfs/dbraw/zinc/26/03/53/571260353.db2.gz	MXXUIPNSJDTYDG-HXUWFJFHSA-N	-1	0	358.438	2.972	50	0		FFAARM
O=C([O-])C1(NC(=O)N2CCC([C@H](O)CCc3ccccc3)CC2)CCCC1	ZINC000670448730	571351683	/nfs/dbraw/zinc/35/16/83/571351683.db2.gz	KUGJDGMIUKELKI-GOSISDBHSA-N	-1	0	374.481	2.799	50	0		FFAARM
CC[C@@H](C)C1C(=O)N=C(SCC(=O)Nc2ccc(OC)cc2)N=C1[O-]	ZINC000016662323	727826653	/nfs/dbraw/zinc/82/66/53/727826653.db2.gz	MFKZMGCCXBXAMI-SNVBAGLBSA-N	-1	0	363.439	2.728	50	0		FFAARM
O=C([O-])[C@@H](NC(=O)c1cc(=O)[nH]c2ccccc21)c1ccccc1Cl	ZINC000095508712	728480519	/nfs/dbraw/zinc/48/05/19/728480519.db2.gz	YWSRQLLXVAOFQR-INIZCTEOSA-N	-1	0	356.765	2.737	50	0		FFAARM
Cc1cc(C(=O)[O-])c(F)c(S(=O)(=O)N(C)[C@H](C)c2ccccn2)c1	ZINC000185136609	729342382	/nfs/dbraw/zinc/34/23/82/729342382.db2.gz	ATSGCMXPTWSMLF-LLVKDONJSA-N	-1	0	352.387	2.609	50	0		FFAARM
O=C([O-])C1(n2cccn2)CCN(Cc2c(Cl)cncc2Cl)CC1	ZINC000072418960	845555732	/nfs/dbraw/zinc/55/57/32/845555732.db2.gz	OCIHSLHUMUKWEQ-UHFFFAOYSA-N	-1	0	355.225	2.661	50	0		FFAARM
CO[C@@H]1C[C@H](CC(=O)[O-])N(C(=O)[C@H]2C[C@@H]2c2cccc(C(F)(F)F)c2)C1	ZINC000263205107	980557427	/nfs/dbraw/zinc/55/74/27/980557427.db2.gz	ZAWKBQIDLVBQEO-TUVASFSCSA-N	-1	0	371.355	2.900	50	0		FFAARM
O=C(NCCCn1ccc2ccccc21)c1cc(=O)n(-c2ccccc2)[n-]1	ZINC000828140740	999556035	/nfs/dbraw/zinc/55/60/35/999556035.db2.gz	IJVFONOVTCWXBP-UHFFFAOYSA-N	-1	0	360.417	2.940	50	0		FFAARM
O=C([O-])[C@@]1(Cc2ccc(F)cc2)CCCN(C(=O)c2ccc(CO)cc2)C1	ZINC000071551674	1019662147	/nfs/dbraw/zinc/66/21/47/1019662147.db2.gz	LMPBHEAOADELDR-OAQYLSRUSA-N	-1	0	371.408	2.868	50	0		FFAARM
CC(=O)Nc1ccc(S(=O)(=O)[N-]c2nc3c(s2)CCCC3)cc1	ZINC000000986422	539336877	/nfs/dbraw/zinc/33/68/77/539336877.db2.gz	SDXLBDMDOWTGCG-UHFFFAOYSA-N	-1	0	351.453	2.781	50	0		FFAARM
CN(C(=O)OC(C)(C)C)[C@@H](CCC(=O)OCc1ccccc1)C(=O)[O-]	ZINC000002391125	204036594	/nfs/dbraw/zinc/03/65/94/204036594.db2.gz	NEJPFSNBCOTZHN-AWEZNQCLSA-N	-1	0	351.399	2.830	50	0		FFAARM
O=C([O-])c1cc(S(=O)(=O)N2CCc3ccccc3C2)ccc1Cl	ZINC000003251791	204084398	/nfs/dbraw/zinc/08/43/98/204084398.db2.gz	ZQASRJZDHNXUQG-UHFFFAOYSA-N	-1	0	351.811	2.785	50	0		FFAARM
C[C@H]1CCCCN1S(=O)(=O)c1ccc(Br)c(C(=O)[O-])c1	ZINC000002656173	204050259	/nfs/dbraw/zinc/05/02/59/204050259.db2.gz	RWQJTRRJITWTHF-VIFPVBQESA-N	-1	0	362.245	2.710	50	0		FFAARM
Cn1cc(S(=O)(=O)[N-]c2ccn(Cc3cccc4ccccc43)n2)cn1	ZINC000002803895	204059938	/nfs/dbraw/zinc/05/99/38/204059938.db2.gz	GWEOXRRJTJBGLG-UHFFFAOYSA-N	-1	0	367.434	2.619	50	0		FFAARM
CCn1cc(S(=O)(=O)[N-]c2cnn(Cc3ccccc3Cl)c2)cn1	ZINC000002804684	204060118	/nfs/dbraw/zinc/06/01/18/204060118.db2.gz	VXUCEYRQYGVALK-UHFFFAOYSA-N	-1	0	365.846	2.602	50	0		FFAARM
COc1ccc([C@@H](CC(=O)NCc2ccco2)[N-]C(=O)C(F)(F)F)cc1	ZINC000003663527	204110470	/nfs/dbraw/zinc/11/04/70/204110470.db2.gz	RHSZNHSUYQVKLR-CQSZACIVSA-N	-1	0	370.327	2.714	50	0		FFAARM
CCOc1ccc(NC(=O)[C@@H](Cc2ccc(OC)cc2)c2nnn[n-]2)cc1	ZINC000004671852	204152682	/nfs/dbraw/zinc/15/26/82/204152682.db2.gz	JDLBAKTYKPWAIQ-KRWDZBQOSA-N	-1	0	367.409	2.572	50	0		FFAARM
O=C([O-])[C@@H](NC(=O)COc1ccc(F)cc1)C12CC3CC(CC(C3)C1)C2	ZINC000004660930	204152952	/nfs/dbraw/zinc/15/29/52/204152952.db2.gz	JNQNLSSFEOEBJH-TXTVKVCSSA-N	-1	0	361.413	2.990	50	0	biogenic	FFAARM
COc1ccccc1C[C@H](C(=O)Nc1ccc(C)c(C)c1)c1nnn[n-]1	ZINC000005518416	204213597	/nfs/dbraw/zinc/21/35/97/204213597.db2.gz	DGYKVRZAZLCJDU-INIZCTEOSA-N	-1	0	351.410	2.790	50	0		FFAARM
O=C([O-])[C@@H](NS(=O)(=O)c1ccc(Br)cc1)c1ccccc1	ZINC000005555176	204214322	/nfs/dbraw/zinc/21/43/22/204214322.db2.gz	AAMMHGXIMZVDDB-ZDUSSCGKSA-N	-1	0	370.224	2.553	50	0		FFAARM
O=C([O-])CN(CCc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1	ZINC000004904608	204174475	/nfs/dbraw/zinc/17/44/75/204174475.db2.gz	CVTNJZWJVRGXRD-UHFFFAOYSA-N	-1	0	353.827	2.658	50	0		FFAARM
C[C@H](NC(=O)/C(=C\c1ccc(Cl)cc1)NC(=O)c1ccccc1)C(=O)[O-]	ZINC000005092232	204192150	/nfs/dbraw/zinc/19/21/50/204192150.db2.gz	BCGZSUJANOSRFW-JASJWYONSA-N	-1	0	372.808	2.700	50	0		FFAARM
COc1ccc(NC(C)=O)cc1[N-]S(=O)(=O)c1ccc(F)c(F)c1F	ZINC000006186236	204239830	/nfs/dbraw/zinc/23/98/30/204239830.db2.gz	ITSMCNDSUAYVRM-UHFFFAOYSA-N	-1	0	374.340	2.872	50	0		FFAARM
CCC(=O)Nc1ccc(OC)c(S(=O)(=O)[N-]c2ccc(OC)cc2)c1	ZINC000006316670	204244900	/nfs/dbraw/zinc/24/49/00/204244900.db2.gz	LDHFEIDETVODJY-UHFFFAOYSA-N	-1	0	364.423	2.853	50	0		FFAARM
O=C(NC1CC1)c1ccccc1[N-]S(=O)(=O)c1ccc(F)c(F)c1	ZINC000007054332	204288251	/nfs/dbraw/zinc/28/82/51/204288251.db2.gz	CSCLGPXHIWAUKI-UHFFFAOYSA-N	-1	0	352.362	2.658	50	0		FFAARM
COc1cccc(Cn2[nH][n-]c3c(=O)n(-c4ccccc4Cl)c(=O)c2=3)c1	ZINC000006770906	204268306	/nfs/dbraw/zinc/26/83/06/204268306.db2.gz	XASPKVNCZUBUGH-HZPDHXFCSA-N	-1	0	370.796	2.842	50	0		FFAARM
Cc1nc2sccn2c(=O)c1S(=O)(=O)[N-]c1ccc(C(C)C)cc1	ZINC000006859795	204277023	/nfs/dbraw/zinc/27/70/23/204277023.db2.gz	OSFMENGXKYLYBH-UHFFFAOYSA-N	-1	0	363.464	2.989	50	0		FFAARM
COc1ccc(CNC(=O)c2ccc(C=C3SC(=O)NC3=O)cc2)cc1	ZINC000008272486	204323201	/nfs/dbraw/zinc/32/32/01/204323201.db2.gz	LZJNNELFUROHLT-YBEGLDIGSA-N	-1	0	368.414	2.949	50	0		FFAARM
CN(Cc1cn(-c2ccccc2)nc1-c1ccco1)C(=O)CCC(=O)[O-]	ZINC000008861897	204347829	/nfs/dbraw/zinc/34/78/29/204347829.db2.gz	QOWHMUAHKVTHIB-UHFFFAOYSA-N	-1	0	353.378	2.956	50	0		FFAARM
CCCCN1C(=O)[N-]C(=O)C(=C(C)NNc2cccc3ccccc32)C1=O	ZINC000008969432	204350460	/nfs/dbraw/zinc/35/04/60/204350460.db2.gz	HPCGNRSPOPPCIC-GHRIWEEISA-N	-1	0	366.421	2.909	50	0		FFAARM
COC(=O)C[C@@H]([N-]S(=O)(=O)c1c(C)noc1C)c1ccccc1Cl	ZINC000009578376	204374880	/nfs/dbraw/zinc/37/48/80/204374880.db2.gz	JEWBFHDEUCJVFS-CYBMUJFWSA-N	-1	0	372.830	2.528	50	0		FFAARM
CS(=O)(=O)[N-]c1ccccc1C(=O)NCCc1ccc(Cl)cc1	ZINC000012605547	204480499	/nfs/dbraw/zinc/48/04/99/204480499.db2.gz	NIAGIVCRONRFLR-UHFFFAOYSA-N	-1	0	352.843	2.684	50	0		FFAARM
CCOc1ccc(C(=O)NCc2ccc(OC)c(C(=O)[O-])c2)cc1OC	ZINC000013392664	204529116	/nfs/dbraw/zinc/52/91/16/204529116.db2.gz	FTIXLTJEKVNIBO-UHFFFAOYSA-N	-1	0	359.378	2.731	50	0		FFAARM
CC(=O)N1CCc2cc(C(=O)N[C@@H](CC(=O)[O-])c3cccs3)ccc21	ZINC000013390008	204529509	/nfs/dbraw/zinc/52/95/09/204529509.db2.gz	NVUMCFXCLPBSSG-AWEZNQCLSA-N	-1	0	358.419	2.603	50	0		FFAARM
O=C([O-])c1ccccc1S[C@@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1=O	ZINC000019878860	204711301	/nfs/dbraw/zinc/71/13/01/204711301.db2.gz	GLVBTYQZFJNXBR-OAHLLOKOSA-N	-1	0	371.370	2.538	50	0		FFAARM
CC[C@@H](C)N(C(=O)CS(=O)(=O)c1nc2ccccc2[n-]1)[C@@H](C)CC	ZINC000040152113	205060554	/nfs/dbraw/zinc/06/05/54/205060554.db2.gz	AQDJYRVBSYEDHY-BETUJISGSA-N	-1	0	351.472	2.762	50	0		FFAARM
COc1cc2c(cc1OC)[C@H](CC(=O)[O-])N(C(=O)c1occc1C)CC2	ZINC000299384654	205094170	/nfs/dbraw/zinc/09/41/70/205094170.db2.gz	IBEJRIBDUONIMC-AWEZNQCLSA-N	-1	0	359.378	2.820	50	0		FFAARM
Cc1cc(C)c(S(=O)(=O)Nc2cccc(-n3cccn3)c2)cc1C(=O)[O-]	ZINC000042791768	205098041	/nfs/dbraw/zinc/09/80/41/205098041.db2.gz	ZDTPVLBPEHIIIZ-UHFFFAOYSA-N	-1	0	371.418	2.988	50	0		FFAARM
COc1ccc(C2=Nn3c(CCC(=O)[O-])nnc3-c3ccccc3C2)cc1	ZINC000040545672	205071200	/nfs/dbraw/zinc/07/12/00/205071200.db2.gz	VYVWYFFQIURSRP-UHFFFAOYSA-N	-1	0	362.389	2.779	50	0		FFAARM
O=C([O-])c1cc(I)cnc1NCc1ccccc1	ZINC000040564606	205071269	/nfs/dbraw/zinc/07/12/69/205071269.db2.gz	RJBSKVHDPIZBGQ-UHFFFAOYSA-N	-1	0	354.147	2.997	50	0		FFAARM
O=C([O-])[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)CCc1nc(C2CCCC2)no1	ZINC000299744584	205126681	/nfs/dbraw/zinc/12/66/81/205126681.db2.gz	PHFMUJDIPFZISY-KFWWJZLASA-N	-1	0	361.442	2.904	50	0		FFAARM
COc1ccc(-c2ccc(C(=O)N3CCO[C@@H](CC(=O)[O-])C3)c(F)c2)cc1	ZINC000299748007	205128195	/nfs/dbraw/zinc/12/81/95/205128195.db2.gz	FUHGGCRCPNVTGR-INIZCTEOSA-N	-1	0	373.380	2.817	50	0		FFAARM
Cn1c(=O)sc2cc([N-]S(=O)(=O)c3cc(F)ccc3F)ccc21	ZINC000046017804	205128782	/nfs/dbraw/zinc/12/87/82/205128782.db2.gz	WBAFKJXHXOPJNM-UHFFFAOYSA-N	-1	0	356.375	2.679	50	0		FFAARM
COc1ccc(C(=O)N2CCO[C@H](CC(=O)[O-])C2)cc1-c1ccccc1	ZINC000299753081	205135051	/nfs/dbraw/zinc/13/50/51/205135051.db2.gz	WSXAADKVFXLYMJ-MRXNPFEDSA-N	-1	0	355.390	2.678	50	0		FFAARM
COc1ccc(OC)c(S(=O)(=O)[N-]c2ccccc2-n2cccn2)c1	ZINC000048355289	205161522	/nfs/dbraw/zinc/16/15/22/205161522.db2.gz	ZEJWOYXHHJOIKH-UHFFFAOYSA-N	-1	0	359.407	2.690	50	0		FFAARM
CC(C)=CCCn1c2cc(C(=O)[O-])cnc2n(CCc2ccccn2)c1=O	ZINC000055225637	205210817	/nfs/dbraw/zinc/21/08/17/205210817.db2.gz	QIROUCUILRBYBV-UHFFFAOYSA-N	-1	0	366.421	2.890	50	0		FFAARM
COc1ccc(CC(=O)[O-])cc1S(=O)(=O)N(C)c1cc(C)ccc1C	ZINC000057119807	205235159	/nfs/dbraw/zinc/23/51/59/205235159.db2.gz	MXMJLCAHKLVQDZ-UHFFFAOYSA-N	-1	0	363.435	2.764	50	0		FFAARM
COc1ccc(CC(=O)[O-])cc1S(=O)(=O)N(C)c1ccc(C)cc1C	ZINC000057119746	205236016	/nfs/dbraw/zinc/23/60/16/205236016.db2.gz	CBNTYABJIZTPSN-UHFFFAOYSA-N	-1	0	363.435	2.764	50	0		FFAARM
CCc1cccc(OCCN(C)C(=O)c2ccccc2NCC(=O)[O-])c1	ZINC000055413089	205217894	/nfs/dbraw/zinc/21/78/94/205217894.db2.gz	WETPFSVYLIAALK-UHFFFAOYSA-N	-1	0	356.422	2.897	50	0		FFAARM
COc1ccc(S(=O)(=O)[N-]c2ccccc2C(N)=O)c2ccccc12	ZINC000055551075	205220652	/nfs/dbraw/zinc/22/06/52/205220652.db2.gz	BCFANCSDCOUIQZ-UHFFFAOYSA-N	-1	0	356.403	2.748	50	0		FFAARM
O=S(=O)([N-]c1cc(Cl)ccc1-n1cncn1)c1c[nH]c2ncccc12	ZINC000058162672	205251838	/nfs/dbraw/zinc/25/18/38/205251838.db2.gz	FHMKYYJQBJVJAV-UHFFFAOYSA-N	-1	0	374.813	2.598	50	0		FFAARM
COc1ccc2c(c1)S[C@H](CC(=O)Nc1cccc(C(=O)[O-])c1)C(=O)N2	ZINC000061720550	205288484	/nfs/dbraw/zinc/28/84/84/205288484.db2.gz	IUGHIQOKGQAOQX-OAHLLOKOSA-N	-1	0	372.402	2.835	50	0		FFAARM
COc1ccc(NC(=O)C[C@@H]2Sc3cc(C(=O)[O-])ccc3NC2=O)cc1	ZINC000061721002	205288682	/nfs/dbraw/zinc/28/86/82/205288682.db2.gz	YZOBTSUZMJNNCH-HNNXBMFYSA-N	-1	0	372.402	2.835	50	0		FFAARM
CS(=O)(=O)Cc1cccc(NC(=O)CC2(C(=O)[O-])CCCCC2)c1	ZINC000058473420	205275221	/nfs/dbraw/zinc/27/52/21/205275221.db2.gz	OOUBWRWEIIIZBI-UHFFFAOYSA-N	-1	0	353.440	2.595	50	0		FFAARM
Cc1ccccc1[N-]S(=O)(=O)c1cc(-c2ccc(=O)n(C)n2)cs1	ZINC000065128887	205317810	/nfs/dbraw/zinc/31/78/10/205317810.db2.gz	JTNOEOBGQGUEOL-UHFFFAOYSA-N	-1	0	361.448	2.618	50	0		FFAARM
CC[C@H](C)C(=O)N1CCc2c(c(C(=O)[O-])nn2Cc2cccc(OC)c2)C1	ZINC000067692555	205384247	/nfs/dbraw/zinc/38/42/47/205384247.db2.gz	GPOFUFXBEFIXLT-ZDUSSCGKSA-N	-1	0	371.437	2.569	50	0		FFAARM
COc1cc(NC(=O)[C@@H]2[C@@H](C(=O)[O-])C2(C)C)ccc1NC(=O)c1ccco1	ZINC000071280378	205423819	/nfs/dbraw/zinc/42/38/19/205423819.db2.gz	XZJQARGVAKCOTF-GJZGRUSLSA-N	-1	0	372.377	2.836	50	0		FFAARM
CC1(C)[C@@H](C(=O)[O-])[C@@H]1C(=O)Nc1ccc(C(=O)NCc2ccco2)cc1	ZINC000071288219	205425531	/nfs/dbraw/zinc/42/55/31/205425531.db2.gz	LPHKYQKNKXIOBP-HUUCEWRRSA-N	-1	0	356.378	2.505	50	0		FFAARM
COc1cc(F)ccc1-c1cc(C(=O)[O-])cc(S(=O)(=O)NC(C)C)c1	ZINC000071439458	205432624	/nfs/dbraw/zinc/43/26/24/205432624.db2.gz	RIZZHJJOPXTXMD-UHFFFAOYSA-N	-1	0	367.398	2.886	50	0		FFAARM
Cc1cc(I)cc(C(=O)[O-])c1NC(=O)C(F)(F)F	ZINC000072190690	205502057	/nfs/dbraw/zinc/50/20/57/205502057.db2.gz	PCKCXZFFQJBJOT-UHFFFAOYSA-N	-1	0	373.068	2.799	50	0		FFAARM
COc1ccc(Cn2cc([C@H](C(=O)[O-])N(C)Cc3ccoc3)cn2)cc1	ZINC000095352529	205725315	/nfs/dbraw/zinc/72/53/15/205725315.db2.gz	HYPVRSYDYKWCEL-GOSISDBHSA-N	-1	0	355.394	2.791	50	0		FFAARM
CCNc1ncc(C(=O)N2CCC[C@@H](c3cccc(C(=O)[O-])c3)C2)cn1	ZINC000095359238	205730535	/nfs/dbraw/zinc/73/05/35/205730535.db2.gz	VETHRBWPHJBQHZ-OAHLLOKOSA-N	-1	0	354.410	2.626	50	0		FFAARM
O=C([O-])[C@H](NC(=O)c1cccc(-n2cccn2)c1)c1ccc(F)c(F)c1	ZINC000095989908	205801450	/nfs/dbraw/zinc/80/14/50/205801450.db2.gz	KSIPGPMXMLECKX-MRXNPFEDSA-N	-1	0	357.316	2.706	50	0		FFAARM
CC(C)c1cc(C(=O)N2CCC(C(=O)[O-])(c3ccccc3)CC2)n(C)n1	ZINC000236682841	205927985	/nfs/dbraw/zinc/92/79/85/205927985.db2.gz	HYQUYMGXWYRYMZ-UHFFFAOYSA-N	-1	0	355.438	2.802	50	0		FFAARM
CCc1ccc(Cn2[nH][n-]c3c(=O)n(-c4ccc(OC)cc4)c(=O)c2=3)cc1	ZINC000101418024	205961119	/nfs/dbraw/zinc/96/11/19/205961119.db2.gz	KQUZKUDZMFKZDS-ROUUACIJSA-N	-1	0	364.405	2.751	50	0		FFAARM
CCOc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccc(F)cc4)c=3c2=O)cc1	ZINC000101417810	205961259	/nfs/dbraw/zinc/96/12/59/205961259.db2.gz	CBWKXJJKOMGWPP-DLBZAZTESA-N	-1	0	368.368	2.718	50	0		FFAARM
COc1ccc(S(=O)(=O)Nc2ccc(SC)cc2)cc1C(=O)[O-]	ZINC000047949076	206080349	/nfs/dbraw/zinc/08/03/49/206080349.db2.gz	RUVBGAOTYGJZRK-UHFFFAOYSA-N	-1	0	353.421	2.916	50	0		FFAARM
C[C@@H](Oc1ccccc1Br)C(=O)N1CC[C@](C)(C(=O)[O-])C1	ZINC000237539597	206105099	/nfs/dbraw/zinc/10/50/99/206105099.db2.gz	VYEQTOFVQRVMEL-BMIGLBTASA-N	-1	0	356.216	2.540	50	0		FFAARM
O=C(C[C@@H]1COCCN1C(=O)c1ccc2[n-]c(=S)oc2c1)c1ccco1	ZINC000119231033	206105932	/nfs/dbraw/zinc/10/59/32/206105932.db2.gz	YYRNEDWJKAYMSM-GFCCVEGCSA-N	-1	0	372.402	2.824	50	0		FFAARM
C[C@]1(C(=O)[O-])CCN(C(=O)C2(c3ccc(Cl)cc3)CCOCC2)C1	ZINC000237639008	206106589	/nfs/dbraw/zinc/10/65/89/206106589.db2.gz	SJZNYEMZIWKESW-KRWDZBQOSA-N	-1	0	351.830	2.711	50	0		FFAARM
C[C@]1(C(=O)[O-])CCN(C(=O)C2(c3ccccc3Cl)CCOCC2)C1	ZINC000237639792	206106653	/nfs/dbraw/zinc/10/66/53/206106653.db2.gz	HRYVLPAAMKWHIB-KRWDZBQOSA-N	-1	0	351.830	2.711	50	0		FFAARM
C[C@]1(C(=O)[O-])CCN(C(=O)[C@H]2C[C@@H]2c2ccc(Br)cc2)C1	ZINC000237650122	206106895	/nfs/dbraw/zinc/10/68/95/206106895.db2.gz	WGLAKHHJBKONIC-WWGRRREGSA-N	-1	0	352.228	2.876	50	0		FFAARM
Cc1noc(-c2ccc(C(=O)N3Cc4ccccc4C[C@H]3C(=O)[O-])cc2)n1	ZINC000237745578	206108041	/nfs/dbraw/zinc/10/80/41/206108041.db2.gz	WOTCTAMLQZLILK-KRWDZBQOSA-N	-1	0	363.373	2.697	50	0		FFAARM
O=C([O-])C1CCN(C(=O)c2c[nH]c3cccc(Br)c23)CC1	ZINC000238031568	206113277	/nfs/dbraw/zinc/11/32/77/206113277.db2.gz	JYVUIRVPMWJBDT-UHFFFAOYSA-N	-1	0	351.200	2.867	50	0		FFAARM
O=C([O-])[C@H]1CCCN1CC(=O)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000238093794	206113549	/nfs/dbraw/zinc/11/35/49/206113549.db2.gz	CGYIKPPFNADDOF-RBUKOAKNSA-N	-1	0	352.434	2.636	50	0		FFAARM
O=C([O-])COc1cccc(CNC(=O)[C@@H]2C[C@H]2c2cccc(F)c2F)c1	ZINC000238020160	206111582	/nfs/dbraw/zinc/11/15/82/206111582.db2.gz	GFSLSLIVINFQFP-LSDHHAIUSA-N	-1	0	361.344	2.848	50	0		FFAARM
O=C([O-])[C@H]1CCN(C(=O)CCCOc2ccccc2Br)C1	ZINC000237955598	206112099	/nfs/dbraw/zinc/11/20/99/206112099.db2.gz	LYBIBKRTIZCOSQ-NSHDSACASA-N	-1	0	356.216	2.541	50	0		FFAARM
O=C([O-])CC[C@@H]1CCCCN1C(=O)CC[C@@H]1Cc2ccccc2NC1=O	ZINC000237923780	206112191	/nfs/dbraw/zinc/11/21/91/206112191.db2.gz	FZGRPNQENUMDAS-CVEARBPZSA-N	-1	0	358.438	2.824	50	0		FFAARM
COCCCNC(=O)c1ccc2c(c1)[n-]c(=S)n(C1CCCC1)c2=O	ZINC000002971722	206157963	/nfs/dbraw/zinc/15/79/63/206157963.db2.gz	YWHDRDQGHOSUFC-UHFFFAOYSA-N	-1	0	361.467	2.567	50	0		FFAARM
CN(CC(=O)[O-])C(=O)c1ccc(Oc2cccc(Br)c2)nc1	ZINC000153082957	206201910	/nfs/dbraw/zinc/20/19/10/206201910.db2.gz	AYLUYXKADQVTHD-UHFFFAOYSA-N	-1	0	365.183	2.793	50	0		FFAARM
O=C([O-])c1cc2c(cc1NC(=O)c1ccccc1OC(F)F)OCO2	ZINC000006589169	206203002	/nfs/dbraw/zinc/20/30/02/206203002.db2.gz	CUZBPHHMNQSJNC-UHFFFAOYSA-N	-1	0	351.261	2.967	50	0		FFAARM
Cc1ccccc1-n1c(=O)cc([O-])nc1SCC(=O)NC1CCCCC1	ZINC000000979635	206224772	/nfs/dbraw/zinc/22/47/72/206224772.db2.gz	OBKFDNIGHPMVNJ-UHFFFAOYSA-N	-1	0	373.478	2.788	50	0		FFAARM
O=C(c1ccc2[n-]c(=S)oc2c1)N1CCOC[C@H]1[C@@H]1CCCCC1=O	ZINC000160522473	206228176	/nfs/dbraw/zinc/22/81/76/206228176.db2.gz	CMYIKAVMSGHPPK-JSGCOSHPSA-N	-1	0	360.435	2.717	50	0		FFAARM
CS(=O)(=O)c1ccc(F)c(NC(=O)CC2(C(=O)[O-])CCCCC2)c1	ZINC000013467698	206303569	/nfs/dbraw/zinc/30/35/69/206303569.db2.gz	ZPJQJXUYUOQGOG-UHFFFAOYSA-N	-1	0	357.403	2.593	50	0		FFAARM
CCOc1ccccc1[N-]S(=O)(=O)c1cc(NC(C)=O)ccc1OC	ZINC000016147658	206318751	/nfs/dbraw/zinc/31/87/51/206318751.db2.gz	BWPAHJRKNJUEFQ-UHFFFAOYSA-N	-1	0	364.423	2.853	50	0		FFAARM
CCN1CCN([C@@H](c2sc3nc(C)nn3c2[O-])c2cccc(C)c2)CC1	ZINC000022468464	206377739	/nfs/dbraw/zinc/37/77/39/206377739.db2.gz	YYMVLPNNNOCFST-MRXNPFEDSA-N	-1	0	371.510	2.840	50	0		FFAARM
C[C@@H]1CN([C@@H](c2sc3ncnn3c2[O-])c2ccc(F)cc2)C[C@@H](C)O1	ZINC000022609705	206389209	/nfs/dbraw/zinc/38/92/09/206389209.db2.gz	BESIFSPXZFVYLU-JTNHKYCSSA-N	-1	0	362.430	2.834	50	0		FFAARM
Cc1ccc(S(=O)(=O)[N-]c2cc(C(N)=O)cc(F)c2C)c(Cl)c1	ZINC000055614930	206382538	/nfs/dbraw/zinc/38/25/38/206382538.db2.gz	BOBXEPMYYXBONK-UHFFFAOYSA-N	-1	0	356.806	2.996	50	0		FFAARM
COc1ccc2cc(S(=O)(=O)[N-]c3ccccc3C(N)=O)ccc2c1	ZINC000223008492	206430213	/nfs/dbraw/zinc/43/02/13/206430213.db2.gz	AJJDOHSKAKFTSC-UHFFFAOYSA-N	-1	0	356.403	2.748	50	0		FFAARM
CC(=O)N1c2ccc(S(=O)(=O)Nc3cccc4c3CCO4)cc2C[C@H]1C	ZINC000330075174	258154483	/nfs/dbraw/zinc/15/44/83/258154483.db2.gz	DBOHWRIGWXIONV-GFCCVEGCSA-N	-1	0	372.446	2.720	50	0		FFAARM
O=C([O-])[C@H](c1ccc2c(c1)OCCO2)N1CCN(c2ccc(F)cc2)CC1	ZINC000095374965	132209100	/nfs/dbraw/zinc/20/91/00/132209100.db2.gz	UDAQMLZHUIBJOT-IBGZPJMESA-N	-1	0	372.396	2.545	50	0		FFAARM
Cc1cccc(N2CCN(c3ccc(NC(=O)/C=C/C(=O)[O-])cc3)CC2)c1	ZINC000005926762	132258432	/nfs/dbraw/zinc/25/84/32/132258432.db2.gz	NZZJNGKYFGFRMH-MDZDMXLPSA-N	-1	0	365.433	2.901	50	0		FFAARM
NC(=O)c1cccnc1N1CCC(CCCc2ccccc2)(C(=O)[O-])CC1	ZINC000071614606	136139639	/nfs/dbraw/zinc/13/96/39/136139639.db2.gz	MXRQMIFEAJZWAV-UHFFFAOYSA-N	-1	0	367.449	2.875	50	0		FFAARM
COc1ccc(C(=O)[O-])cc1NC(=S)NC(=O)C=Cc1ccccc1	ZINC000001159546	263143416	/nfs/dbraw/zinc/14/34/16/263143416.db2.gz	UYUBLBJIJZMCAU-JXMROGBWSA-N	-1	0	356.403	2.920	50	0		FFAARM
O=C1N=CN=CN(Cc2ccc(Br)cc2Br)[N-]1	ZINC000000711934	506229394	/nfs/dbraw/zinc/22/93/94/506229394.db2.gz	IQQVQUKCNRDKLC-UHFFFAOYSA-N	-1	0	360.009	2.708	50	0		FFAARM
O=C([O-])c1ccc(Br)c(S(=O)(=O)NCc2ccccc2)c1	ZINC000000797213	506233641	/nfs/dbraw/zinc/23/36/41/506233641.db2.gz	SOEQMMPAOITRLM-UHFFFAOYSA-N	-1	0	370.224	2.626	50	0		FFAARM
CC(C)COC(=O)c1ccc(N2C(=O)c3ccc(C(=O)[O-])cc3C2=O)cc1	ZINC000000850621	506236744	/nfs/dbraw/zinc/23/67/44/506236744.db2.gz	ACWSKMLQAVHKOD-UHFFFAOYSA-N	-1	0	367.357	2.998	50	0		FFAARM
Cc1cc(C)c(C)c(S(=O)(=O)N[C@H](Cc2ccccc2)C(=O)[O-])c1C	ZINC000000948471	506240600	/nfs/dbraw/zinc/24/06/00/506240600.db2.gz	STQXOMYIGNWPDF-QGZVFWFLSA-N	-1	0	361.463	2.894	50	0		FFAARM
O=C(/C=C/c1ccco1)Nc1ccc(S(=O)(=O)[N-]c2ncccn2)cc1	ZINC000000998647	506242539	/nfs/dbraw/zinc/24/25/39/506242539.db2.gz	PAWRMAUOBDTSLI-RMKNXTFCSA-N	-1	0	370.390	2.522	50	0		FFAARM
COC(=O)c1cc(OC)c(OC)cc1[N-]S(=O)(=O)c1ccc(C)cc1	ZINC000001027449	506243265	/nfs/dbraw/zinc/24/32/65/506243265.db2.gz	IGNFPIDOKBKTED-UHFFFAOYSA-N	-1	0	365.407	2.600	50	0		FFAARM
COc1ccc(OC)c(S(=O)(=O)[N-]c2ccc(-c3ncon3)cc2)c1	ZINC000001037987	506245821	/nfs/dbraw/zinc/24/58/21/506245821.db2.gz	BQGUPZVPCJLYET-UHFFFAOYSA-N	-1	0	361.379	2.555	50	0		FFAARM
Cc1cc2ncn([C@@H]3CC(=O)N(c4ccc(C(=O)[O-])cc4)C3=O)c2cc1C	ZINC000001101436	506248009	/nfs/dbraw/zinc/24/80/09/506248009.db2.gz	IGWXTXWMPLNGBU-QGZVFWFLSA-N	-1	0	363.373	2.856	50	0		FFAARM
CCOC(=O)Cc1csc([N-]S(=O)(=O)c2c(C)cc(C)cc2C)n1	ZINC000003991833	506353519	/nfs/dbraw/zinc/35/35/19/506353519.db2.gz	PWVFWMRVAJPZQZ-UHFFFAOYSA-N	-1	0	368.480	2.975	50	0		FFAARM
CCCOC(=O)c1ccc(NS(=O)(=O)c2cccc(C(=O)[O-])c2)cc1	ZINC000034876873	506371546	/nfs/dbraw/zinc/37/15/46/506371546.db2.gz	JBZJRKSELCLMFV-UHFFFAOYSA-N	-1	0	363.391	2.752	50	0		FFAARM
CC(=O)N1N=C(c2ccc3c(c2)OCO3)C[C@@H]1c1ccc(C(=O)[O-])cc1	ZINC000035655303	506388165	/nfs/dbraw/zinc/38/81/65/506388165.db2.gz	WVSWNNRGSPHBMB-MRXNPFEDSA-N	-1	0	352.346	2.811	50	0		FFAARM
O=C([O-])[C@H]1CCCC[C@@H]1C(=O)N1CCN(c2ccccc2Cl)CC1	ZINC000004749305	506393540	/nfs/dbraw/zinc/39/35/40/506393540.db2.gz	MKTQWEILLANZID-KBPBESRZSA-N	-1	0	350.846	2.880	50	0		FFAARM
COc1cc([C@@H]2SC(C)(C)[C@H](C(=O)[O-])N2C(C)=O)cc(OC)c1OC	ZINC000005283485	506433299	/nfs/dbraw/zinc/43/32/99/506433299.db2.gz	NPCUMDXXMDXQSI-GJZGRUSLSA-N	-1	0	369.439	2.538	50	0		FFAARM
CN1C(=O)CCc2cc([N-]S(=O)(=O)c3cccc4cccnc43)ccc21	ZINC000038706755	506442613	/nfs/dbraw/zinc/44/26/13/506442613.db2.gz	JKDZJHUIEYLWME-UHFFFAOYSA-N	-1	0	367.430	2.945	50	0		FFAARM
O=S(=O)([N-]c1ccc2c(c1)OCCO2)c1ccc(-c2ccno2)s1	ZINC000012340452	506853414	/nfs/dbraw/zinc/85/34/14/506853414.db2.gz	JCPNMONQASWSHW-UHFFFAOYSA-N	-1	0	364.404	2.975	50	0		FFAARM
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)[C@@H]1CC=CC[C@@H]1C(=O)[O-]	ZINC000012649143	506888088	/nfs/dbraw/zinc/88/80/88/506888088.db2.gz	CEVDAKZMDQZIES-SJORKVTESA-N	-1	0	353.422	2.772	50	0		FFAARM
CCOc1cc(C(=O)NCc2ccc(OC)c(C(=O)[O-])c2)ccc1OC	ZINC000013392706	506940959	/nfs/dbraw/zinc/94/09/59/506940959.db2.gz	XWLCSNFFHMPVHF-UHFFFAOYSA-N	-1	0	359.378	2.731	50	0		FFAARM
O=C([O-])c1ccc2c(c1)nc(N1CCCC1)n(-c1ccc(F)cc1)c2=O	ZINC000015829109	507062673	/nfs/dbraw/zinc/06/26/73/507062673.db2.gz	LEGHEVUNXORMEX-UHFFFAOYSA-N	-1	0	353.353	2.823	50	0		FFAARM
COc1ccccc1N1C(=O)[N-]C(=O)C(=C(C)Nc2ccc(F)cc2)C1=O	ZINC000016994403	507111675	/nfs/dbraw/zinc/11/16/75/507111675.db2.gz	ONPZPLUACFKGBM-WJDWOHSUSA-N	-1	0	369.352	2.803	50	0		FFAARM
COC(=O)c1c(-c2ccccc2)csc1NC(=O)CSCC(=O)[O-]	ZINC000017075064	507114872	/nfs/dbraw/zinc/11/48/72/507114872.db2.gz	IMVKMSSHCGGAMU-UHFFFAOYSA-N	-1	0	365.432	2.958	50	0		FFAARM
CCOC(=O)c1c(CC(C)C)csc1NC=C1C(=O)[N-]C(=O)NC1=O	ZINC000018204051	507144535	/nfs/dbraw/zinc/14/45/35/507144535.db2.gz	YVLALTUKLKYDJL-UHFFFAOYSA-N	-1	0	365.411	2.830	50	0		FFAARM
COc1cc(OC)cc(C2N=NC(=S)N2c2ccc(C(=O)[O-])cc2)c1	ZINC000018191124	507145429	/nfs/dbraw/zinc/14/54/29/507145429.db2.gz	RXQXQPVNQQATOI-UHFFFAOYSA-N	-1	0	357.391	2.938	50	0		FFAARM
Cc1cccc(N2C(=O)C[C@@H](Sc3ncccc3C(=O)[O-])C2=O)c1C	ZINC000019881451	507205310	/nfs/dbraw/zinc/20/53/10/507205310.db2.gz	KADMOYNRMBJCLS-CQSZACIVSA-N	-1	0	356.403	2.821	50	0		FFAARM
Cc1cc(F)ccc1[N-]S(=O)(=O)c1cc2c(cc1Cl)NC(=O)CO2	ZINC000021650756	507261516	/nfs/dbraw/zinc/26/15/16/507261516.db2.gz	DPYUPTGWGQRMLY-UHFFFAOYSA-N	-1	0	370.789	2.919	50	0		FFAARM
CC(=O)N1c2ccc(S(=O)(=O)[N-]c3cccc4c[nH]nc43)cc2C[C@@H]1C	ZINC000024425525	507410141	/nfs/dbraw/zinc/41/01/41/507410141.db2.gz	KQUJADRACGJJOT-NSHDSACASA-N	-1	0	370.434	2.661	50	0		FFAARM
Cc1[n-]n([C@H]2CCS(=O)(=O)C2)c(=O)c1Cc1cccc2ccccc21	ZINC000061717723	507633665	/nfs/dbraw/zinc/63/36/65/507633665.db2.gz	SHAVRCJPONJBFX-INIZCTEOSA-N	-1	0	356.447	2.588	50	0		FFAARM
COC(=O)c1[n-]c(=NC(=O)c2ccncc2)sc1-c1ccccc1OC	ZINC000072406016	507783962	/nfs/dbraw/zinc/78/39/62/507783962.db2.gz	GODWPCPTGQCLDR-UHFFFAOYSA-N	-1	0	369.402	3.253	50	0		FFAARM
O=C([O-])C1(n2ccnc2)CCN(C(=O)c2ccc3sccc3c2)CC1	ZINC000072457299	507793677	/nfs/dbraw/zinc/79/36/77/507793677.db2.gz	SVKNYWIEOQYKAL-UHFFFAOYSA-N	-1	0	355.419	2.814	50	0		FFAARM
O=C([O-])c1ccc(C[C@H]2CCN(C(=O)COc3ccc(F)cc3)C2)cc1	ZINC000072479902	507797574	/nfs/dbraw/zinc/79/75/74/507797574.db2.gz	CVUFNXXGJDSVBP-OAHLLOKOSA-N	-1	0	357.381	2.994	50	0		FFAARM
Cc1ccc(OC2(C(=O)[O-])CCN(C(=O)C[C@H]3C=CCC3)CC2)c(C)n1	ZINC000072481225	507797603	/nfs/dbraw/zinc/79/76/03/507797603.db2.gz	LMKJMQGRNALTNM-INIZCTEOSA-N	-1	0	358.438	2.879	50	0		FFAARM
CCN(Cc1nc(=O)c2sccc2[n-]1)C[C@@H]1COc2ccccc2O1	ZINC000031173671	507817930	/nfs/dbraw/zinc/81/79/30/507817930.db2.gz	KUUZZCSOYSYQEB-GFCCVEGCSA-N	-1	0	357.435	2.647	50	0		FFAARM
O=C([O-])C[C@@H](CC(=O)N1CCC2(CC1)OCCS2)c1cccs1	ZINC000090607357	507930313	/nfs/dbraw/zinc/93/03/13/507930313.db2.gz	GBPSPWIJGGPUHR-GFCCVEGCSA-N	-1	0	355.481	2.779	50	0		FFAARM
Cc1ccc(S(=O)(=O)[N-]c2ccc(I)cn2)cc1	ZINC000091302732	507978817	/nfs/dbraw/zinc/97/88/17/507978817.db2.gz	FSQZWFRWAZIXCK-UHFFFAOYSA-N	-1	0	374.203	2.795	50	0		FFAARM
COCCC[C@]1(C(=O)[O-])CCCN(C(=O)c2ccc3[nH]c(C)nc3c2)C1	ZINC000091713386	508004936	/nfs/dbraw/zinc/00/49/36/508004936.db2.gz	KZBUUUSYMVODOL-LJQANCHMSA-N	-1	0	359.426	2.605	50	0		FFAARM
Cc1ncsc1CCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)[O-]	ZINC000095366079	508177893	/nfs/dbraw/zinc/17/78/93/508177893.db2.gz	YZEFIFQUSZVWBG-HNNXBMFYSA-N	-1	0	357.435	2.678	50	0		FFAARM
O=C([O-])c1cccc(C[C@H]2CCN(C(=O)c3scc4c3OCCO4)C2)c1	ZINC000095383892	508181913	/nfs/dbraw/zinc/18/19/13/508181913.db2.gz	CIKHBBQMMGCMPA-CYBMUJFWSA-N	-1	0	373.430	2.922	50	0		FFAARM
COc1ccc([C@@H](C(=O)[O-])N2CCN(Cc3ccsc3)CC2)cc1F	ZINC000095383539	508182251	/nfs/dbraw/zinc/18/22/51/508182251.db2.gz	NBDKBRVRWLDVGK-KRWDZBQOSA-N	-1	0	364.442	2.839	50	0		FFAARM
O=S(=O)([N-]c1ccc2c(c1)OCCO2)c1c(Cl)ccnc1Cl	ZINC000095452397	508186068	/nfs/dbraw/zinc/18/60/68/508186068.db2.gz	MEFHCKQOBRZNKJ-UHFFFAOYSA-N	-1	0	361.206	2.960	50	0		FFAARM
COc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccccc4Cl)c=3c2=O)cc1	ZINC000096286254	508212850	/nfs/dbraw/zinc/21/28/50/508212850.db2.gz	NZQBOKANXRQAPA-HZPDHXFCSA-N	-1	0	370.796	2.842	50	0		FFAARM
O=c1c2[n-][nH]n(-c3cccc(F)c3)c=2c(=O)n1-c1ccc2c(c1)CCC2	ZINC000096500402	508214925	/nfs/dbraw/zinc/21/49/25/508214925.db2.gz	KWFFTOLQYSTKOC-IRXDYDNUSA-N	-1	0	350.353	2.812	50	0		FFAARM
CN(Cc1cn(-c2ccccc2)nc1-c1ccco1)C(=O)/C=C\C(=O)[O-]	ZINC000096930546	508215682	/nfs/dbraw/zinc/21/56/82/508215682.db2.gz	JIJZUACJWYQFCU-KTKRTIGZSA-N	-1	0	351.362	2.732	50	0		FFAARM
CCc1ncc(CN2CCC(Oc3ccccc3OC)(C(=O)[O-])CC2)cn1	ZINC000082148010	508226796	/nfs/dbraw/zinc/22/67/96/508226796.db2.gz	LJYTYOZGFZEEDE-UHFFFAOYSA-N	-1	0	371.437	2.546	50	0		FFAARM
COc1ccc(-n2c(=O)c3[n-][nH]n(Cc4cccc(Cl)c4)c=3c2=O)cc1	ZINC000101167291	508240901	/nfs/dbraw/zinc/24/09/01/508240901.db2.gz	ZISPBMLHLLCEMR-HOTGVXAUSA-N	-1	0	370.796	2.842	50	0		FFAARM
Cc1cc2nc(CN3CCC[C@H]3c3nc4ccccc4n3C)cc(=O)n2[n-]1	ZINC000077420733	508314500	/nfs/dbraw/zinc/31/45/00/508314500.db2.gz	ZUUPYBVQSPUBKX-KRWDZBQOSA-N	-1	0	362.437	2.555	50	0		FFAARM
Cc1ccc(C(C)(C)C)cc1S(=O)(=O)[N-]C(=O)/C=C/c1ccncn1	ZINC000158757353	508748906	/nfs/dbraw/zinc/74/89/06/508748906.db2.gz	XFCSPZRGCHUJJA-BQYQJAHWSA-N	-1	0	359.451	2.601	50	0		FFAARM
O=S(=O)(C[C@H]1CCCCO1)[N-]c1ccccc1-c1n[nH]c(C2CC2)n1	ZINC000150840966	508905519	/nfs/dbraw/zinc/90/55/19/508905519.db2.gz	PTYQCNQQNIHQFR-CYBMUJFWSA-N	-1	0	362.455	2.660	50	0		FFAARM
CCO[C@@H]1COCC[C@H]1NS(=O)(=O)c1cc(Cl)c(Cl)s1	ZINC000223092005	509328962	/nfs/dbraw/zinc/32/89/62/509328962.db2.gz	XZLWBAOFSICBCJ-RKDXNWHRSA-N	-1	0	360.284	2.527	50	0		FFAARM
CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)NCc1cccc(C(=O)[O-])c1	ZINC000236825247	509511112	/nfs/dbraw/zinc/51/11/12/509511112.db2.gz	SSVWUIVDJINSDX-IBGZPJMESA-N	-1	0	364.401	2.965	50	0		FFAARM
O=C([O-])[C@@H](NC(=O)Cc1cc(-c2ccccc2)on1)c1ccccc1F	ZINC000170066747	509667166	/nfs/dbraw/zinc/66/71/66/509667166.db2.gz	CSNAKQHSLYYEGS-SFHVURJKSA-N	-1	0	354.337	2.965	50	0		FFAARM
Cc1cc(C(=O)N(CC(=O)[O-])C2CCOCC2)c(C)n1-c1ccc(F)cc1	ZINC000237667974	509706444	/nfs/dbraw/zinc/70/64/44/509706444.db2.gz	KVBNZUCULGUJLQ-UHFFFAOYSA-N	-1	0	374.412	2.939	50	0		FFAARM
CCC[C@H](NC(=O)Cc1ccccc1)C(=O)Nc1ccc(F)c(C(=O)[O-])c1	ZINC000170672173	509711527	/nfs/dbraw/zinc/71/15/27/509711527.db2.gz	OXJDSSVUJVMFHX-KRWDZBQOSA-N	-1	0	372.396	2.990	50	0		FFAARM
O=C([O-])c1ccc(C=NNC(=O)c2cc(Br)ccc2O)cc1	ZINC000252475098	509837738	/nfs/dbraw/zinc/83/77/38/509837738.db2.gz	SPAFPWSNENSQSS-UHFFFAOYSA-N	-1	0	363.167	2.617	50	0		FFAARM
CO[C@H](CNS(=O)(=O)CCC(F)(F)F)c1cc2ccccc2o1	ZINC000244975078	509877434	/nfs/dbraw/zinc/87/74/34/509877434.db2.gz	IAOZNOPNVLAYND-CYBMUJFWSA-N	-1	0	351.346	2.992	50	0		FFAARM
O=C([O-])[C@H]1CCN(C(=O)CCCCOc2ccc(Br)cc2)C1	ZINC000178259152	510514094	/nfs/dbraw/zinc/51/40/94/510514094.db2.gz	LVXLBESCMHUHGJ-LBPRGKRZSA-N	-1	0	370.243	2.931	50	0		FFAARM
Cc1cc(C(=O)N(CC(=O)[O-])Cc2ccccc2)nc(C(F)(F)F)n1	ZINC000263104980	510563048	/nfs/dbraw/zinc/56/30/48/510563048.db2.gz	JDRFPPDUVHXQLH-UHFFFAOYSA-N	-1	0	353.300	2.531	50	0		FFAARM
Cc1cc(C(=O)NC2(CC(=O)[O-])CCOCC2)ccc1Br	ZINC000263183491	510599702	/nfs/dbraw/zinc/59/97/02/510599702.db2.gz	RSVHSJMPUKKNAO-UHFFFAOYSA-N	-1	0	356.216	2.511	50	0		FFAARM
O=C([O-])c1ccc(C(=O)N2CCN(Cc3ccccc3Cl)CC2)cc1	ZINC000263414475	510695398	/nfs/dbraw/zinc/69/53/98/510695398.db2.gz	JOZBSVAWJQDWIF-UHFFFAOYSA-N	-1	0	358.825	2.996	50	0		FFAARM
CN1C(=O)C[C@H](C(=O)N[C@@H](CC(=O)[O-])c2cccs2)c2ccccc21	ZINC000299746325	511668144	/nfs/dbraw/zinc/66/81/44/511668144.db2.gz	WQUOUMIJEYJKJL-STQMWFEESA-N	-1	0	358.419	2.530	50	0		FFAARM
O=C([O-])c1ccc(S(=O)(=O)N2CCCC2)c(OCc2ccccc2)c1	ZINC000299803758	511686866	/nfs/dbraw/zinc/68/68/66/511686866.db2.gz	BECJEGTZOBJAOB-UHFFFAOYSA-N	-1	0	361.419	2.748	50	0		FFAARM
O=C([O-])Cn1ccc([C@H]2CCCN(C(=O)CCCc3ccc(F)cc3)C2)n1	ZINC000426361894	513914938	/nfs/dbraw/zinc/91/49/38/513914938.db2.gz	FRHQSBJYDSDOQU-INIZCTEOSA-N	-1	0	373.428	2.836	50	0		FFAARM
CCOC(=O)c1ccc2nc(NC(=O)[C@H]3CC[C@@H](C(=O)[O-])C3)sc2c1	ZINC000253473058	517692891	/nfs/dbraw/zinc/69/28/91/517692891.db2.gz	REMWYSZLJZYGFU-VHSXEESVSA-N	-1	0	362.407	2.912	50	0		FFAARM
O=C([O-])CN(C(=O)/C=C/c1ccccc1OC(F)(F)F)C1CCOCC1	ZINC000328594828	534499140	/nfs/dbraw/zinc/49/91/40/534499140.db2.gz	CONYHIPARYZPBB-AATRIKPKSA-N	-1	0	373.327	2.691	50	0		FFAARM
Cc1nn(C)c(C)c1[C@@H](C)C(=O)N1CCc2c(F)ccc(C(=O)[O-])c2C1	ZINC000630237579	522725116	/nfs/dbraw/zinc/72/51/16/522725116.db2.gz	CBKQRNWPKXOTKO-SNVBAGLBSA-N	-1	0	359.401	2.563	50	0		FFAARM
CC1=NN(c2ccc(C(=O)N[C@@H](C)c3ncc(C(=O)[O-])s3)cc2)CC1	ZINC000621608704	522967211	/nfs/dbraw/zinc/96/72/11/522967211.db2.gz	XDIIVBQJXKUDLR-NSHDSACASA-N	-1	0	358.423	2.918	50	0		FFAARM
COCCC[C@]1(C(=O)[O-])CCCN(C(=O)c2ccc(-c3cc[nH]n3)cc2)C1	ZINC000091664715	523494551	/nfs/dbraw/zinc/49/45/51/523494551.db2.gz	RQCGXJLULRPNQA-HXUWFJFHSA-N	-1	0	371.437	2.810	50	0		FFAARM
Cc1cccc(C[C@@H](CNC(=O)[C@@H]2CCOc3ccccc32)C(=O)[O-])c1	ZINC000237668443	524464483	/nfs/dbraw/zinc/46/44/83/524464483.db2.gz	IHHLYDFQIAYDJX-FUHWJXTLSA-N	-1	0	353.418	2.921	50	0		FFAARM
O=C([O-])[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)CC[C@H]1Cc2ccccc2NC1=O	ZINC000268935942	526291132	/nfs/dbraw/zinc/29/11/32/526291132.db2.gz	HKNIJECRIHRKRW-FZCLSBEQSA-N	-1	0	370.449	2.822	50	0		FFAARM
O=C([O-])[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)CCc1nc(-c2ccoc2)no1	ZINC000268938419	526293096	/nfs/dbraw/zinc/29/30/96/526293096.db2.gz	JDCPTIKURAPWJV-BNOWGMLFSA-N	-1	0	359.382	2.507	50	0		FFAARM
Cc1csc(-c2cc(S(=O)(=O)[N-]c3cccc(C)n3)c(C)n2C)n1	ZINC000065008958	571134182	/nfs/dbraw/zinc/13/41/82/571134182.db2.gz	NODIHJUYWBVZMB-UHFFFAOYSA-N	-1	0	362.480	3.270	50	0		FFAARM
O=C([O-])CCc1cc2n(n1)CCCN(Cc1nc3ccccc3s1)C2	ZINC000072478410	845555503	/nfs/dbraw/zinc/55/55/03/845555503.db2.gz	UQPPCUJXSGCDQJ-UHFFFAOYSA-N	-1	0	356.451	2.916	50	0		FFAARM
CN1C(=O)CCc2cc(C(=O)N3CC[C@H](C(=O)[O-])c4ccccc43)ccc21	ZINC000669434758	1027937680	/nfs/dbraw/zinc/93/76/80/1027937680.db2.gz	XOMQNPSNJCRTND-INIZCTEOSA-N	-1	0	364.401	2.814	50	0		FFAARM
CCn1c(N[C@H]2COc3c(cccc3OC)C2)nc2cc(C(=O)[O-])cnc21	ZINC001506403115	1059494527	/nfs/dbraw/zinc/49/45/27/1059494527.db2.gz	RIJHKLGRYRUIRB-CYBMUJFWSA-N	-1	0	368.393	2.574	50	0		FFAARM
CCCN1CCN([C@H](C(=O)[O-])c2ccc3cc(OC)ccc3c2)CC1=O	ZINC001506420908	1059508793	/nfs/dbraw/zinc/50/87/93/1059508793.db2.gz	DMXHVTXPUDIFLC-IBGZPJMESA-N	-1	0	356.422	2.528	50	0		FFAARM
CCOC(=O)c1ccc(NC(=O)CSc2cccc(C(=O)[O-])n2)cc1	ZINC000000632389	203935809	/nfs/dbraw/zinc/93/58/09/203935809.db2.gz	AIAXFVVYZYJPQU-UHFFFAOYSA-N	-1	0	360.391	2.687	50	0		FFAARM
COc1ccc(OC)c(S(=O)(=O)[N-]c2ccc3oc(=O)sc3c2)c1	ZINC000002493444	204042443	/nfs/dbraw/zinc/04/24/43/204042443.db2.gz	SZDFNTIRQYGTLM-UHFFFAOYSA-N	-1	0	367.404	2.673	50	0		FFAARM
COc1ccccc1Oc1ccc(S(=O)(=O)NCCCC(=O)[O-])cc1	ZINC000001795980	204019332	/nfs/dbraw/zinc/01/93/32/204019332.db2.gz	CMIXGGNCGJJSQW-UHFFFAOYSA-N	-1	0	365.407	2.631	50	0		FFAARM
O=C([O-])[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000003239278	204085018	/nfs/dbraw/zinc/08/50/18/204085018.db2.gz	MWFNHAUXOMDUFH-HNNXBMFYSA-N	-1	0	351.811	2.540	50	0		FFAARM
CC(C)(O)[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)[O-]	ZINC000002583269	204045180	/nfs/dbraw/zinc/04/51/80/204045180.db2.gz	KIOMNBRJPAICIT-QGZVFWFLSA-N	-1	0	355.390	2.749	50	0		FFAARM
O=C([O-])C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)c1ccc(F)cc1	ZINC000002634455	204047812	/nfs/dbraw/zinc/04/78/12/204047812.db2.gz	BBXNQFYDOZLGRX-AWEZNQCLSA-N	-1	0	357.790	2.973	50	0		FFAARM
C[C@@H](Cn1cc(Br)cn1)C(=O)Nc1ccc(C(=O)[O-])cc1	ZINC000002794758	204057844	/nfs/dbraw/zinc/05/78/44/204057844.db2.gz	IQDCOHOLRQKVEW-VIFPVBQESA-N	-1	0	352.188	2.619	50	0		FFAARM
Cc1noc(C)c1S(=O)(=O)[N-]c1cnn(Cc2cccc(Cl)c2)c1	ZINC000002792061	204058374	/nfs/dbraw/zinc/05/83/74/204058374.db2.gz	ALZDYUPCEKZPTP-UHFFFAOYSA-N	-1	0	366.830	2.990	50	0		FFAARM
Cc1n[nH]c(C)c1S(=O)(=O)[N-]c1cnn(Cc2ccccc2Cl)c1	ZINC000002805045	204059433	/nfs/dbraw/zinc/05/94/33/204059433.db2.gz	PBFXJMYGLJSFKW-UHFFFAOYSA-N	-1	0	365.846	2.726	50	0		FFAARM
CCn1ncc(S(=O)(=O)[N-]c2ccn(Cc3cccc(C)c3)n2)c1C	ZINC000002804719	204059620	/nfs/dbraw/zinc/05/96/20/204059620.db2.gz	UVVYYVLKFVTUMT-UHFFFAOYSA-N	-1	0	359.455	2.565	50	0		FFAARM
Cc1n[nH]c(C)c1S(=O)(=O)[N-]c1cnn(Cc2ccc(Cl)cc2)c1	ZINC000002804928	204059637	/nfs/dbraw/zinc/05/96/37/204059637.db2.gz	OJAQDIAUZLTKRG-UHFFFAOYSA-N	-1	0	365.846	2.726	50	0		FFAARM
O=C([O-])CCCCCNC(=O)/C(=C\c1ccccc1)NC(=O)c1ccco1	ZINC000003900247	204114259	/nfs/dbraw/zinc/11/42/59/204114259.db2.gz	SUHGDWPKYGQPAF-JQIJEIRASA-N	-1	0	370.405	2.812	50	0		FFAARM
O=C1c2ccccc2NC2(CCCC2)N1[N-]S(=O)(=O)c1ccccc1	ZINC000003641467	204109422	/nfs/dbraw/zinc/10/94/22/204109422.db2.gz	OOPWYUZEJZPXBL-UHFFFAOYSA-N	-1	0	357.435	2.718	50	0		FFAARM
C[C@@H]1CCc2c(sc(NC(=O)[C@@H]3CCCC[C@@H]3C(=O)[O-])c2C(N)=O)C1	ZINC000004646607	204152150	/nfs/dbraw/zinc/15/21/50/204152150.db2.gz	RIVQMHSILJEIBU-MXWKQRLJSA-N	-1	0	364.467	2.801	50	0		FFAARM
COC(=O)C[C@@H](NC(=O)C1=C(C(=O)[O-])CCCC1)c1cc(C)ccc1C	ZINC000004679309	204154523	/nfs/dbraw/zinc/15/45/23/204154523.db2.gz	KKJLCEPZVFXOSC-QGZVFWFLSA-N	-1	0	359.422	2.979	50	0		FFAARM
CCOc1cc(/C=C2/NC(=O)[N-]C2=O)ccc1OCc1ccccc1F	ZINC000004696485	204155716	/nfs/dbraw/zinc/15/57/16/204155716.db2.gz	HLVSSFMWFWAOKU-OQLLNIDSSA-N	-1	0	356.353	2.984	50	0		FFAARM
O=C([O-])CCN1C(=O)c2ccc(NC(=O)c3ccccc3Cl)cc2C1=O	ZINC000004826678	204166300	/nfs/dbraw/zinc/16/63/00/204166300.db2.gz	KXSRVTOZESIBFU-UHFFFAOYSA-N	-1	0	372.764	2.663	50	0		FFAARM
Cc1ccc(-n2nnnc2SCc2nc(=O)c3sccc3[n-]2)c(C)c1	ZINC000004407457	204139018	/nfs/dbraw/zinc/13/90/18/204139018.db2.gz	MWQPUXUPERCQOO-UHFFFAOYSA-N	-1	0	370.463	2.869	50	0		FFAARM
O=C([O-])c1ccccc1NC(=O)CCn1c(=O)oc2cc(Cl)ccc21	ZINC000004940027	204178229	/nfs/dbraw/zinc/17/82/29/204178229.db2.gz	KZEGISMGORUKMQ-UHFFFAOYSA-N	-1	0	360.753	2.975	50	0		FFAARM
Cc1ccc(CN2C(=O)C[C@@H](Sc3ncccc3C(=O)[O-])C2=O)cc1	ZINC000005016046	204184325	/nfs/dbraw/zinc/18/43/25/204184325.db2.gz	AQGNNQZNPLCEQN-CQSZACIVSA-N	-1	0	356.403	2.508	50	0		FFAARM
Cc1ccc(S(=O)(=O)N(CC(=O)[O-])Cc2cccc(Cl)c2)cc1	ZINC000006204962	204240692	/nfs/dbraw/zinc/24/06/92/204240692.db2.gz	TUHJHIHOVOXIRA-UHFFFAOYSA-N	-1	0	353.827	2.924	50	0		FFAARM
Cc1ccc(SCCNC(=O)c2ccccc2[N-]S(C)(=O)=O)cc1	ZINC000006270349	204243953	/nfs/dbraw/zinc/24/39/53/204243953.db2.gz	XQQIZKQORBURHY-UHFFFAOYSA-N	-1	0	364.492	2.889	50	0		FFAARM
CN1C(=S)N(c2ccccc2)C(=O)/C1=C/c1ccccc1OCC(=O)[O-]	ZINC000006420186	204248815	/nfs/dbraw/zinc/24/88/15/204248815.db2.gz	RFUPSKVBWWDPDE-PTNGSMBKSA-N	-1	0	368.414	2.754	50	0		FFAARM
O=C([O-])c1ccc(N[C@@H]2CC(=O)N(Cc3ccc(Cl)cc3)C2=O)cc1	ZINC000006579839	204254796	/nfs/dbraw/zinc/25/47/96/204254796.db2.gz	DIJSRHHEGGTUOG-OAHLLOKOSA-N	-1	0	358.781	2.778	50	0		FFAARM
C[C@@H](OC(=O)c1cc(=O)c2ccccc2[n-]1)C(=O)Nc1ccccc1F	ZINC000006605905	204256206	/nfs/dbraw/zinc/25/62/06/204256206.db2.gz	UZGZINXJOLNYPN-LLVKDONJSA-N	-1	0	354.337	2.851	50	0		FFAARM
Cc1noc(C)c1C(=O)[N-]n1c(C)nc2sc3c(c2c1=O)CCCC3	ZINC000006690899	204260350	/nfs/dbraw/zinc/26/03/50/204260350.db2.gz	YIRLMHUOIIAANU-UHFFFAOYSA-N	-1	0	358.423	2.634	50	0		FFAARM
COc1cc(S(=O)(=O)[N-]c2cccnc2)c(OC)cc1Br	ZINC000006706909	204262377	/nfs/dbraw/zinc/26/23/77/204262377.db2.gz	PQFJADGTMJOMLH-UHFFFAOYSA-N	-1	0	373.228	2.662	50	0		FFAARM
COc1ccc(Cn2[nH][n-]c3c(=O)n(-c4cccc(Cl)c4)c(=O)c2=3)cc1	ZINC000006770573	204267804	/nfs/dbraw/zinc/26/78/04/204267804.db2.gz	HUGQHDQFZAMNIF-HZPDHXFCSA-N	-1	0	370.796	2.842	50	0		FFAARM
CC(=O)Oc1ccc2ccccc2c1/C=C(\C(=O)[O-])N(C(C)=O)C(C)=O	ZINC000006856634	204276742	/nfs/dbraw/zinc/27/67/42/204276742.db2.gz	SRVWYACDSRNVOJ-LICLKQGHSA-N	-1	0	355.346	2.586	50	0		FFAARM
CCOC(=O)c1c(C)n(C)c(C)c1S(=O)(=O)[N-]c1ccc(OC)cc1	ZINC000006887589	204279340	/nfs/dbraw/zinc/27/93/40/204279340.db2.gz	FGYYOFXIQUUENW-UHFFFAOYSA-N	-1	0	366.439	2.628	50	0		FFAARM
Cc1ccc(C2=Nn3c(nnc3[C@@H]3CCCO3)S[C@H]2CC(=O)[O-])cc1	ZINC000008428706	204331537	/nfs/dbraw/zinc/33/15/37/204331537.db2.gz	UPWGLMBITHDUMP-STQMWFEESA-N	-1	0	358.423	2.639	50	0		FFAARM
CSc1nnc2n1N=C(c1ccc(Cl)cc1)[C@@H](CC(=O)[O-])S2	ZINC000009740612	204381497	/nfs/dbraw/zinc/38/14/97/204381497.db2.gz	ZNDYQTKQJDGAAD-SECBINFHSA-N	-1	0	354.844	2.855	50	0		FFAARM
Cc1ccc(C)c(S(=O)(=O)Nc2cc3c(cc2C(=O)[O-])OCCO3)c1	ZINC000013090264	204522597	/nfs/dbraw/zinc/52/25/97/204522597.db2.gz	ITOHNXBJOYSLMI-UHFFFAOYSA-N	-1	0	363.391	2.574	50	0		FFAARM
O=C([O-])COc1ccccc1/C=C1\NC(=S)N(c2ccccc2F)C1=O	ZINC000013302755	204527016	/nfs/dbraw/zinc/52/70/16/204527016.db2.gz	CSHGROKWRZDSTL-LCYFTJDESA-N	-1	0	372.377	2.551	50	0		FFAARM
COc1cc2c(cc1OC)[C@@H](C(=O)[O-])[C@H]1c3ccccc3CCN1C2=O	ZINC000032916813	204947018	/nfs/dbraw/zinc/94/70/18/204947018.db2.gz	XWMZLQGDUVBINT-QZTJIDSGSA-N	-1	0	353.374	2.625	50	0		FFAARM
O=C([N-]S(=O)(=O)/C=C/c1ccccc1)c1cc2c(c(Cl)c1)OCO2	ZINC000042319289	205095356	/nfs/dbraw/zinc/09/53/56/205095356.db2.gz	WTABRBJOZFOBPA-VOTSOKGWSA-N	-1	0	365.794	2.799	50	0		FFAARM
O=C([O-])C[C@@H]1CN(C(=O)[C@H]2C[C@H]2c2ccccc2C(F)(F)F)CCO1	ZINC000299753326	205134654	/nfs/dbraw/zinc/13/46/54/205134654.db2.gz	XVEZOBFPJUVZST-WXHSDQCUSA-N	-1	0	357.328	2.511	50	0		FFAARM
O=C([O-])[C@@H]1CC=CC[C@H]1C(=O)Nc1ccc(C(=O)NC2CC2)c(Cl)c1	ZINC000055150043	205208375	/nfs/dbraw/zinc/20/83/75/205208375.db2.gz	UNOATPDTPZJHQB-CHWSQXEVSA-N	-1	0	362.813	2.838	50	0		FFAARM
Cc1cccc([C@@H](NC(=O)CCC(=O)NC2CCCCCC2)C(=O)[O-])c1	ZINC000055183262	205209307	/nfs/dbraw/zinc/20/93/07/205209307.db2.gz	VCYGRTJLNGFSSD-LJQANCHMSA-N	-1	0	360.454	2.856	50	0		FFAARM
CC(C)(C)c1ncc([N-]S(=O)(=O)c2ccc3c(c2)OCCCO3)cn1	ZINC000058218013	205263212	/nfs/dbraw/zinc/26/32/12/205263212.db2.gz	YMJOJPKEMHNZSH-UHFFFAOYSA-N	-1	0	363.439	2.736	50	0		FFAARM
COc1ccccc1NC(=O)C[C@@H]1Sc2cc(C(=O)[O-])ccc2NC1=O	ZINC000061718087	205286407	/nfs/dbraw/zinc/28/64/07/205286407.db2.gz	PFVPJLCCQPWLGI-HNNXBMFYSA-N	-1	0	372.402	2.835	50	0		FFAARM
O=C([O-])c1nccnc1C(=O)Nc1ccc(Br)c2cccnc12	ZINC000061722014	205287640	/nfs/dbraw/zinc/28/76/40/205287640.db2.gz	PBPUGWFDPWTAKA-UHFFFAOYSA-N	-1	0	373.166	2.738	50	0		FFAARM
O=C([O-])COc1ccc(S(=O)(=O)N2CCc3ccc(Cl)cc32)cc1	ZINC000058495804	205276491	/nfs/dbraw/zinc/27/64/91/205276491.db2.gz	RBVFGKNAPURKQL-UHFFFAOYSA-N	-1	0	367.810	2.555	50	0		FFAARM
CCC(=O)N1CCc2sc(S(=O)(=O)[N-]c3ccc(F)cc3)cc2C1	ZINC000065196159	205323399	/nfs/dbraw/zinc/32/33/99/205323399.db2.gz	SZEMRYQIYHHIGF-UHFFFAOYSA-N	-1	0	368.455	2.983	50	0		FFAARM
C[C@@H](COc1cccc(F)c1)NC(=O)c1ccc2c(c1)[n-]c(=S)[nH]c2=O	ZINC000065478660	205353081	/nfs/dbraw/zinc/35/30/81/205353081.db2.gz	RVPQKCDYCVFVDW-JTQLQIEISA-N	-1	0	373.409	2.548	50	0		FFAARM
O=C(COC(=O)c1cc2c(cc1O)CCCC2)[N-]OCc1ccccc1	ZINC000065687150	205361234	/nfs/dbraw/zinc/36/12/34/205361234.db2.gz	VIEUFYLOLJXUJQ-UHFFFAOYSA-N	-1	0	355.390	2.676	50	0		FFAARM
Cc1cc(-c2nnc(SCC(=O)[O-])n2[C@@H](C)c2ccccc2)nn1C	ZINC000067689179	205384147	/nfs/dbraw/zinc/38/41/47/205384147.db2.gz	KZRBQBGURIEDCV-LBPRGKRZSA-N	-1	0	357.439	2.773	50	0		FFAARM
Cc1cc(C(=O)N2CCc3c(c(C(=O)[O-])nn3C)C2)c(-c2ccccc2)o1	ZINC000067947686	205405148	/nfs/dbraw/zinc/40/51/48/205405148.db2.gz	ATODXUMQLAGTSZ-UHFFFAOYSA-N	-1	0	365.389	2.885	50	0		FFAARM
CC(C)c1[nH]nc(NC(=O)c2nccnc2C(=O)[O-])c1-c1ccccc1	ZINC000071286418	205424893	/nfs/dbraw/zinc/42/48/93/205424893.db2.gz	VENVOWUPWPCSRB-UHFFFAOYSA-N	-1	0	351.366	2.941	50	0		FFAARM
O=C([O-])C1(Oc2ccccc2)CCN(C(=O)CCc2ccncc2)CC1	ZINC000072433355	205548195	/nfs/dbraw/zinc/54/81/95/205548195.db2.gz	SYXAMJWMSOCUDG-UHFFFAOYSA-N	-1	0	354.406	2.539	50	0		FFAARM
COc1ccccc1[C@@H]1CN(C(=O)c2cc(F)ccc2F)C[C@H]1C(=O)[O-]	ZINC000091794448	205695999	/nfs/dbraw/zinc/69/59/99/205695999.db2.gz	MHTSMENTKOGAGY-LSDHHAIUSA-N	-1	0	361.344	2.914	50	0		FFAARM
Cc1nc(N(C)C)ncc1C(=O)N1CCC[C@@H](c2cccc(C(=O)[O-])c2)C1	ZINC000095383202	205746345	/nfs/dbraw/zinc/74/63/45/205746345.db2.gz	KKSIXRXBZGGSKX-MRXNPFEDSA-N	-1	0	368.437	2.569	50	0		FFAARM
CCc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccccc4F)c=3c2=O)cc1	ZINC000101167710	205954122	/nfs/dbraw/zinc/95/41/22/205954122.db2.gz	GGYYGYHGSJFWJT-SJORKVTESA-N	-1	0	352.369	2.882	50	0		FFAARM
COc1cccc(-n2[nH][n-]c3c(=O)n(-c4cc(C)cc(C)c4)c(=O)c2=3)c1	ZINC000101260799	205955560	/nfs/dbraw/zinc/95/55/60/205955560.db2.gz	KDKDTASWZUTCBV-SJORKVTESA-N	-1	0	350.378	2.810	50	0		FFAARM
COc1ccc(S(=O)(=O)Nc2ccc(Cl)c(C(=O)[O-])c2)cc1OC	ZINC000047318209	206079698	/nfs/dbraw/zinc/07/96/98/206079698.db2.gz	BSPCOUVXTAAMTK-UHFFFAOYSA-N	-1	0	371.798	2.856	50	0		FFAARM
Cc1nc(-c2cccc(C(=O)N3Cc4ccccc4C[C@H]3C(=O)[O-])c2)no1	ZINC000237697797	206107621	/nfs/dbraw/zinc/10/76/21/206107621.db2.gz	UBSOBFQOBHSSMU-KRWDZBQOSA-N	-1	0	363.373	2.697	50	0		FFAARM
Cc1nn(C)c(C)c1CCC(=O)N1CCC(C(=O)[O-])(c2ccccc2)CC1	ZINC000237687173	206108195	/nfs/dbraw/zinc/10/81/95/206108195.db2.gz	AONOOZQVLUSLFO-UHFFFAOYSA-N	-1	0	369.465	2.615	50	0		FFAARM
O=C([O-])CN(C(=O)[C@@H]1C[C@@H]1c1c(F)cccc1Cl)C1CCOCC1	ZINC000238102689	206113403	/nfs/dbraw/zinc/11/34/03/206113403.db2.gz	LPGSFIMUFIMLKY-NWDGAFQWSA-N	-1	0	355.793	2.675	50	0		FFAARM
O=C([O-])CN(C(=O)[C@H]1C[C@H]1c1ccc(C(F)(F)F)cc1)C1CCOCC1	ZINC000238105499	206113431	/nfs/dbraw/zinc/11/34/31/206113431.db2.gz	PDKVPQKQEAJEKL-GJZGRUSLSA-N	-1	0	371.355	2.901	50	0		FFAARM
O=C([O-])CCN(C[C@@H]1CCCO1)C(=O)[C@@H]1C[C@@H]1c1cc(F)ccc1F	ZINC000238089087	206114125	/nfs/dbraw/zinc/11/41/25/206114125.db2.gz	YZZHXJWSWDJHIW-GZBFAFLISA-N	-1	0	353.365	2.551	50	0		FFAARM
Cc1nn(-c2ccc(F)cc2)c(Cl)c1C(=O)N1CCC[C@@H](C(=O)[O-])C1	ZINC000237768086	206109699	/nfs/dbraw/zinc/10/96/99/206109699.db2.gz	LQMKGZSGWLPSKU-LLVKDONJSA-N	-1	0	365.792	2.910	50	0		FFAARM
O=C([O-])CCN(C(=O)[C@H]1C[C@H]1c1ccc(F)c(F)c1)C1CCOCC1	ZINC000238070327	206112382	/nfs/dbraw/zinc/11/23/82/206112382.db2.gz	XEUOFGUYUYJKCA-KBPBESRZSA-N	-1	0	353.365	2.551	50	0		FFAARM
O=C([O-])CN(C(=O)c1cc(-c2cccc(Cl)c2)no1)C1CCOCC1	ZINC000238111715	206112527	/nfs/dbraw/zinc/11/25/27/206112527.db2.gz	OKSOJENYPSQZOP-UHFFFAOYSA-N	-1	0	364.785	2.701	50	0		FFAARM
O=C([O-])[C@H]1CCCN1C(=O)/C=C/c1ccc(OCc2cccnc2)cc1	ZINC000238077086	206112573	/nfs/dbraw/zinc/11/25/73/206112573.db2.gz	GMKRLBXAPQTTLA-RUJXFNLJSA-N	-1	0	352.390	2.749	50	0		FFAARM
COc1ccc(C)cc1[N-]S(=O)(=O)c1cc2c3c(c1)CCC(=O)N3CC2	ZINC000004270402	206174440	/nfs/dbraw/zinc/17/44/40/206174440.db2.gz	LAIQOJXCGNGCIM-UHFFFAOYSA-N	-1	0	372.446	2.640	50	0		FFAARM
O=C(CC1CCC(c2ccccc2)CC1)[N-]S(=O)(=O)c1cnccn1	ZINC000152512504	206189756	/nfs/dbraw/zinc/18/97/56/206189756.db2.gz	YOMDGUCYVVNRJM-UHFFFAOYSA-N	-1	0	359.451	2.646	50	0		FFAARM
COc1ccc(C)cc1[N-]S(=O)(=O)c1ccc(N2CCCC2=O)cc1	ZINC000007708472	206211927	/nfs/dbraw/zinc/21/19/27/206211927.db2.gz	UYTBYEGXFZIBFX-UHFFFAOYSA-N	-1	0	360.435	2.931	50	0		FFAARM
O=C(c1ccc2c(c1)[n-]c(=S)[nH]c2=O)N1CCOC2(C1)CCCCCC2	ZINC000160481535	206228545	/nfs/dbraw/zinc/22/85/45/206228545.db2.gz	NPVVFXDGSWYNON-UHFFFAOYSA-N	-1	0	373.478	2.777	50	0		FFAARM
C[C@]1(O)Cc2[nH][nH]c(=O)c2[C@@H](c2ccccc2)[C@H]1C(=O)Nc1ccccc1	ZINC000103521369	206229634	/nfs/dbraw/zinc/22/96/34/206229634.db2.gz	MFCMYLBYJQIUHC-MMOPVJDHSA-N	-1	0	363.417	2.809	50	0		FFAARM
CNC(=O)c1ccccc1[N-]S(=O)(=O)c1ccc(Br)cc1	ZINC000006015914	206240315	/nfs/dbraw/zinc/24/03/15/206240315.db2.gz	BNLJCRGMNXKVCE-UHFFFAOYSA-N	-1	0	369.240	2.610	50	0		FFAARM
COc1ccc(Br)cc1S(=O)(=O)[N-]c1c(C)nn(C)c1C	ZINC000006975332	206242924	/nfs/dbraw/zinc/24/29/24/206242924.db2.gz	MXYZZJSPRXWEOV-UHFFFAOYSA-N	-1	0	374.260	2.609	50	0		FFAARM
CNC(=O)c1ccc([N-]S(=O)(=O)c2ccccc2Br)cc1	ZINC000007054446	206243130	/nfs/dbraw/zinc/24/31/30/206243130.db2.gz	JCMQCILIZAFWIH-UHFFFAOYSA-N	-1	0	369.240	2.610	50	0		FFAARM
CC(=O)N1CCc2cc([N-]S(=O)(=O)c3ccc(F)cc3F)ccc21	ZINC000012068312	206288604	/nfs/dbraw/zinc/28/86/04/206288604.db2.gz	JGBIJAQWOVSUON-UHFFFAOYSA-N	-1	0	352.362	2.675	50	0		FFAARM
CCn1c(=O)c2ccc(C(=O)NCCc3ccccc3)cc2[n-]c1=S	ZINC000017357637	206323502	/nfs/dbraw/zinc/32/35/02/206323502.db2.gz	READAFMCFLBVED-UHFFFAOYSA-N	-1	0	353.447	2.678	50	0		FFAARM
CC[C@H](C)[C@@H](NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)C)C(=O)[O-]	ZINC000004321883	206325819	/nfs/dbraw/zinc/32/58/19/206325819.db2.gz	WRWKLZMOFAMVPZ-NUEKZKHPSA-N	-1	0	364.442	2.553	50	0		FFAARM
COc1ccc(OC)c(/C=C2\SC(=O)N(CCCC(=O)[O-])C2=O)c1	ZINC000013769671	206306075	/nfs/dbraw/zinc/30/60/75/206306075.db2.gz	MEVDFVSZJDLBQR-LCYFTJDESA-N	-1	0	351.380	2.605	50	0		FFAARM
COC(=O)C[C@H](c1ccccc1)c1c(=O)nc2ccc(Cl)cn2c1[O-]	ZINC000205977001	206336932	/nfs/dbraw/zinc/33/69/32/206336932.db2.gz	PCFSMZNUDMTXJS-CYBMUJFWSA-N	-1	0	358.781	2.749	50	0		FFAARM
CCc1nc2sc([C@@H](c3cccc(F)c3)N3CCOCC3)c([O-])n2n1	ZINC000022854215	206393387	/nfs/dbraw/zinc/39/33/87/206393387.db2.gz	IDMMTUKCLBRQCP-CQSZACIVSA-N	-1	0	362.430	2.620	50	0		FFAARM
O=C([O-])[C@]12CCC(=O)N1c1ccccc1-c1nc(-c3cccc(F)c3)nn12	ZINC000225401764	206476818	/nfs/dbraw/zinc/47/68/18/206476818.db2.gz	TWPVTAJDSCAFHV-LJQANCHMSA-N	-1	0	364.336	2.629	50	0		FFAARM
Cc1nn(-c2cccc(Cl)c2)nc1C(=O)NCc1cccc(C(=O)[O-])c1	ZINC000225550081	206486049	/nfs/dbraw/zinc/48/60/49/206486049.db2.gz	RWFDUPQZIQBUEA-UHFFFAOYSA-N	-1	0	370.796	2.857	50	0		FFAARM
C[C@@H](Nc1ncc(C(C)(C)C(=O)[O-])c(N2CCOCC2)n1)C1CCCC1	ZINC000096149723	132220532	/nfs/dbraw/zinc/22/05/32/132220532.db2.gz	XQOHAKYSIUJRJQ-CYBMUJFWSA-N	-1	0	362.474	2.666	50	0		FFAARM
O=C([O-])c1ccc(N2CCCCC2)c(S(=O)(=O)N2CCCCC2)c1	ZINC000003889003	132385836	/nfs/dbraw/zinc/38/58/36/132385836.db2.gz	FGFILSIODSULAP-UHFFFAOYSA-N	-1	0	352.456	2.550	50	0		FFAARM
CC(=O)Nc1ccc(S(=O)(=O)[N-]c2nnc(CC(C)(C)C)s2)cc1	ZINC000000792546	506231090	/nfs/dbraw/zinc/23/10/90/506231090.db2.gz	WFXYSAFJJJISBJ-UHFFFAOYSA-N	-1	0	368.484	2.886	50	0		FFAARM
Cc1cc([N-]S(=O)(=O)c2ccc(NC(=O)c3ccco3)cc2)nc(C)n1	ZINC000001299185	506258441	/nfs/dbraw/zinc/25/84/41/506258441.db2.gz	VNRCJQACNSCQTJ-UHFFFAOYSA-N	-1	0	372.406	2.740	50	0		FFAARM
O=C([N-]C1(C(Cl)(Cl)Cl)OCCO1)C(Cl)(Cl)Cl	ZINC000032620086	506272135	/nfs/dbraw/zinc/27/21/35/506272135.db2.gz	QLBNODFSALXPLV-UHFFFAOYSA-N	-1	0	351.828	2.544	50	0		FFAARM
CCOc1ccc(-n2[nH][n-]c3c(=O)n(-c4ccc(C)cc4)c(=O)c2=3)cc1	ZINC000033274040	506352844	/nfs/dbraw/zinc/35/28/44/506352844.db2.gz	RNPJXVASVLJZKQ-IAGOWNOFSA-N	-1	0	350.378	2.892	50	0		FFAARM
CN(Cc1ccccc1)C(=O)CCc1nnc(-c2cccc(F)c2)[n-]c1=O	ZINC000034768580	506370084	/nfs/dbraw/zinc/37/00/84/506370084.db2.gz	CIUWIMHPNQCJTN-UHFFFAOYSA-N	-1	0	366.396	2.975	50	0		FFAARM
O=C(CCc1nnc(-c2ccccc2)[n-]c1=O)NCc1ccc(F)cc1	ZINC000034767678	506370443	/nfs/dbraw/zinc/37/04/43/506370443.db2.gz	KHSGRKHOUAUNSD-UHFFFAOYSA-N	-1	0	352.369	2.632	50	0		FFAARM
CC(C)C[C@@H](NC(=O)/C(=C\c1ccco1)NC(=O)c1ccccc1)C(=O)[O-]	ZINC000005007855	506413825	/nfs/dbraw/zinc/41/38/25/506413825.db2.gz	ZWMRCGVPIXJDPG-NWNNTGRJSA-N	-1	0	370.405	2.666	50	0		FFAARM
O=C(Nc1ccccc1CN1C(=O)CCC1=O)c1c([O-])cc(F)cc1F	ZINC000066054021	506419441	/nfs/dbraw/zinc/41/94/41/506419441.db2.gz	OGUUTTDMCVEBAK-UHFFFAOYSA-N	-1	0	360.316	2.572	50	0		FFAARM
COc1cc(-c2nc3sc(C)c(C)c3c(=O)[nH]2)ccc1OCC(=O)[O-]	ZINC000005634711	506451911	/nfs/dbraw/zinc/45/19/11/506451911.db2.gz	IKKNFRTTXSGQKM-UHFFFAOYSA-N	-1	0	360.391	2.740	50	0		FFAARM
O=S(=O)([N-]c1ccccc1N1CCOCC1)c1ccccc1Cl	ZINC000006316308	506476151	/nfs/dbraw/zinc/47/61/51/506476151.db2.gz	NGBFEPKLPMMJNO-UHFFFAOYSA-N	-1	0	352.843	2.977	50	0		FFAARM
CCOc1cc(S(=O)(=O)[N-]c2cccc(C)n2)ccc1Br	ZINC000041096170	506490273	/nfs/dbraw/zinc/49/02/73/506490273.db2.gz	VXXNPXNLZFFZRC-UHFFFAOYSA-N	-1	0	371.256	3.352	50	0		FFAARM
Cc1cn(C)c(CC(=O)N2CCN(c3ccc(C)cc3C)CC2)c1C(=O)[O-]	ZINC000008607867	506660989	/nfs/dbraw/zinc/66/09/89/506660989.db2.gz	PVHBMAOFXXBXBT-UHFFFAOYSA-N	-1	0	369.465	2.540	50	0		FFAARM
CONC(=O)c1ccc2c(c1)[n-]c(=S)n(CCc1ccccc1)c2=O	ZINC000012521639	506870064	/nfs/dbraw/zinc/87/00/64/506870064.db2.gz	BUQMSEQENWTBKU-UHFFFAOYSA-N	-1	0	355.419	2.593	50	0		FFAARM
COc1cc(/C=C/C(=O)N2CCC[C@@H](C(=O)[O-])C2)ccc1OC(F)F	ZINC000013170548	506930811	/nfs/dbraw/zinc/93/08/11/506930811.db2.gz	FNCKKTNWWUAGMW-HOSRBBHYSA-N	-1	0	355.337	2.633	50	0		FFAARM
COc1cc2c(cc1OC)[C@@H](CC(=O)[O-])N(C(=O)c1cccs1)CC2	ZINC000013181774	506931211	/nfs/dbraw/zinc/93/12/11/506931211.db2.gz	SZYSJNXOXLSXPY-CYBMUJFWSA-N	-1	0	361.419	2.980	50	0		FFAARM
CC(C)CCNC(=O)Nc1ccc2nc([N-]S(C)(=O)=O)sc2c1	ZINC000013348879	506939611	/nfs/dbraw/zinc/93/96/11/506939611.db2.gz	LDXOAQPNMZDOCQ-UHFFFAOYSA-N	-1	0	356.473	2.835	50	0		FFAARM
O=C([N-]N1C(=O)NC2(CCCCC2)C1=O)c1cccc(Cl)c1Cl	ZINC000014792468	506998980	/nfs/dbraw/zinc/99/89/80/506998980.db2.gz	KQEKZOHHILADHR-UHFFFAOYSA-N	-1	0	356.209	2.893	50	0		FFAARM
COc1ccc(NC(=O)CSc2nnc(-c3ccccc3)c(=O)[n-]2)cc1	ZINC000016806875	507107433	/nfs/dbraw/zinc/10/74/33/507107433.db2.gz	WJWOXLACGXDDHN-UHFFFAOYSA-N	-1	0	368.418	2.984	50	0		FFAARM
C[C@@H]1CCc2c(sc3[n-]c(=S)n(CCN4CCOCC4)c(=O)c32)C1	ZINC000020562742	507226855	/nfs/dbraw/zinc/22/68/55/507226855.db2.gz	HPCJIISZJDJHQL-LLVKDONJSA-N	-1	0	365.524	2.578	50	0		FFAARM
Cc1cccc(-n2c3nc(C4CC4)cc(C(=O)[O-])c3c(=O)[nH]c2=S)c1	ZINC000020605719	507227174	/nfs/dbraw/zinc/22/71/74/507227174.db2.gz	SMIUYWNIZGOZRZ-UHFFFAOYSA-N	-1	0	353.403	2.953	50	0		FFAARM
CCOc1cc2c(cc1[N-]S(=O)(=O)c1c(C)n[nH]c1C)O[C@H](C)C2	ZINC000022244918	507284138	/nfs/dbraw/zinc/28/41/38/507284138.db2.gz	WNYSDJAGGHYJQQ-SECBINFHSA-N	-1	0	351.428	2.549	50	0		FFAARM
CCOc1cc(/C=C2/SC(=O)N(CCCC(=O)[O-])C2=O)ccc1O	ZINC000027229258	507640812	/nfs/dbraw/zinc/64/08/12/507640812.db2.gz	OTHSLGXIRKHKKY-UKTHLTGXSA-N	-1	0	351.380	2.692	50	0		FFAARM
COc1ccc(NC(=O)[C@H]2[C@@H](C(=O)[O-])C2(C)C)cc1NC(=O)C1CCC1	ZINC000071285515	507701094	/nfs/dbraw/zinc/70/10/94/507701094.db2.gz	RBYPOAPBDUQLQN-CABCVRRESA-N	-1	0	360.410	2.729	50	0		FFAARM
Cc1n[nH]c(C)c1CCC(=O)N1CCC[C@](Cc2ccccc2)(C(=O)[O-])C1	ZINC000071756818	507711684	/nfs/dbraw/zinc/71/16/84/507711684.db2.gz	RBTHZCASVCXSNS-OAQYLSRUSA-N	-1	0	369.465	2.895	50	0		FFAARM
CCS(=O)(=O)c1ccc([O-])c(NC(=O)c2ccc(OC)cc2F)c1	ZINC000028813522	507745141	/nfs/dbraw/zinc/74/51/41/507745141.db2.gz	QXNGCYXIXUAEPB-UHFFFAOYSA-N	-1	0	353.371	2.586	50	0		FFAARM
O=C([O-])c1ccccc1[C@@H]1CCN(C(=O)c2ccccc2-n2cncn2)C1	ZINC000072164854	507767194	/nfs/dbraw/zinc/76/71/94/507767194.db2.gz	OVNYHNRPUNHFNI-CQSZACIVSA-N	-1	0	362.389	2.595	50	0		FFAARM
COC(=O)c1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)[O-])c2)c(C)c1	ZINC000029339384	507774687	/nfs/dbraw/zinc/77/46/87/507774687.db2.gz	RRKQLFDZSAEGBQ-UHFFFAOYSA-N	-1	0	363.391	2.589	50	0		FFAARM
O=C([O-])CCc1cc2n(n1)CCCN(Cc1ccc(C(F)(F)F)nc1)C2	ZINC000072423677	507787554	/nfs/dbraw/zinc/78/75/54/507787554.db2.gz	QOTBTXOCDXWCNB-UHFFFAOYSA-N	-1	0	368.359	2.720	50	0		FFAARM
Cc1ccc(-c2nc3ccccc3[nH]c2=O)c(NC(=O)CCC(=O)[O-])c1	ZINC000075110284	508083854	/nfs/dbraw/zinc/08/38/54/508083854.db2.gz	HWHARUYUDIGOFA-UHFFFAOYSA-N	-1	0	351.362	2.702	50	0		FFAARM
Cc1cc(C)n(CCC(=O)N2CCC[C@H](c3ccc(C(=O)[O-])cc3)C2)n1	ZINC000095352352	508174136	/nfs/dbraw/zinc/17/41/36/508174136.db2.gz	OOUOTNMPWCXDJF-SFHVURJKSA-N	-1	0	355.438	2.994	50	0		FFAARM
CN(Cc1ccc2nonc2c1)[C@@H](C(=O)[O-])c1ccc(-c2cc[nH]n2)cc1	ZINC000095360600	508175910	/nfs/dbraw/zinc/17/59/10/508175910.db2.gz	XQUHGIWRMPVSQF-GOSISDBHSA-N	-1	0	363.377	2.871	50	0		FFAARM
O=C([O-])c1ccc([C@H]2CCCN(C(=O)CCN3CCCCCC3=O)C2)cc1	ZINC000095364051	508176672	/nfs/dbraw/zinc/17/66/72/508176672.db2.gz	RPGKFCJVZNPUAN-SFHVURJKSA-N	-1	0	372.465	2.884	50	0		FFAARM
COc1cccc(CC(=O)N[C@H](CC(=O)[O-])c2ccc(OC)cc2OC)c1	ZINC000095464088	508187298	/nfs/dbraw/zinc/18/72/98/508187298.db2.gz	NOJJWKWOMWEFRL-QGZVFWFLSA-N	-1	0	373.405	2.587	50	0		FFAARM
COc1ccc2c(C)c(C(=O)N[C@@H](Cc3ccncc3)C(=O)[O-])oc2c1	ZINC000095521488	508195097	/nfs/dbraw/zinc/19/50/97/508195097.db2.gz	PYXBDWFMRRMCIT-HNNXBMFYSA-N	-1	0	354.362	2.571	50	0		FFAARM
COc1ccc(C=CC(=O)Nc2ccc(-c3nc(=O)o[n-]3)cc2)cc1F	ZINC000096257189	508212811	/nfs/dbraw/zinc/21/28/11/508212811.db2.gz	JKAVYJWUYFEVLP-OQFOIZHKSA-N	-1	0	355.325	2.830	50	0		FFAARM
C[C@H]1CCc2cc(F)cc3c([O-])c(C(=O)Nc4ncccc4O)c(=O)n1c23	ZINC000100663044	508239973	/nfs/dbraw/zinc/23/99/73/508239973.db2.gz	VJTRPQFKKYYOEQ-VIFPVBQESA-N	-1	0	369.352	2.706	50	0		FFAARM
Cc1noc(C)c1CCCNc1nccc(-c2cc(C(=O)[O-])ccn2)n1	ZINC000077457054	508318682	/nfs/dbraw/zinc/31/86/82/508318682.db2.gz	HVVRLHWEDIVPLH-UHFFFAOYSA-N	-1	0	353.382	2.886	50	0		FFAARM
O=C([O-])[C@@H]1CCCCN1C(=O)Cc1csc(Cc2ccc(F)cc2)n1	ZINC000128606709	508617306	/nfs/dbraw/zinc/61/73/06/508617306.db2.gz	IWPULIKPRJFPQN-HNNXBMFYSA-N	-1	0	362.426	2.881	50	0		FFAARM
C[C@H](CN(C)C(=O)c1cc2ccccc2cc1OC(F)F)c1nnn[n-]1	ZINC000124162514	508790724	/nfs/dbraw/zinc/79/07/24/508790724.db2.gz	JFQQITDHXZBMFI-SNVBAGLBSA-N	-1	0	361.352	2.830	50	0		FFAARM
O=S(=O)([N-]c1nncn1-c1ccccc1)C1=Cc2ccccc2CC1	ZINC000126775854	509126790	/nfs/dbraw/zinc/12/67/90/509126790.db2.gz	OYDMKYIOCNBUIR-UHFFFAOYSA-N	-1	0	352.419	2.996	50	0		FFAARM
CCC[C@@H](NC(=O)C[C@@H](NC(=O)c1ccccc1)c1ccccc1)C(=O)[O-]	ZINC000225484704	509374771	/nfs/dbraw/zinc/37/47/71/509374771.db2.gz	IJWNUFTYMLJFEL-QZTJIDSGSA-N	-1	0	368.433	2.917	50	0		FFAARM
CC(C)[S@](=O)c1ccc(C(=O)N2Cc3ccccc3C[C@H]2C(=O)[O-])cc1	ZINC000236705958	509485039	/nfs/dbraw/zinc/48/50/39/509485039.db2.gz	YNYMCDXUNWAQFN-QYBDOPJKSA-N	-1	0	371.458	2.854	50	0		FFAARM
CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)NC1(C(=O)[O-])CCCCC1	ZINC000236828825	509512822	/nfs/dbraw/zinc/51/28/22/509512822.db2.gz	OSZKOPCOVUYBAE-QGZVFWFLSA-N	-1	0	356.422	2.854	50	0		FFAARM
CC[C@@H](Oc1ccccc1F)C(=O)[N-]S(=O)(=O)c1sc(C)nc1C	ZINC000170652335	509701279	/nfs/dbraw/zinc/70/12/79/509701279.db2.gz	NVZRMSBOJFPCOG-GFCCVEGCSA-N	-1	0	372.443	2.562	50	0		FFAARM
O=C([O-])c1ccc(CNC(=O)C2CCC(NC(=O)C3CCCC3)CC2)cc1	ZINC000238106579	509821982	/nfs/dbraw/zinc/82/19/82/509821982.db2.gz	OXBUUJYMKWNWOA-UHFFFAOYSA-N	-1	0	372.465	2.866	50	0		FFAARM
O=C([O-])c1ccccc1C=NNC(=O)c1cc(Br)ccc1O	ZINC000252498119	509844570	/nfs/dbraw/zinc/84/45/70/509844570.db2.gz	SHRDYAORQWLMLW-UHFFFAOYSA-N	-1	0	363.167	2.617	50	0		FFAARM
O=S(=O)(NCCOc1ccccc1)c1cc(C(F)(F)F)ccc1[O-]	ZINC000253430413	509881874	/nfs/dbraw/zinc/88/18/74/509881874.db2.gz	QOXOCDLCWVGDBB-UHFFFAOYSA-N	-1	0	361.341	2.768	50	0		FFAARM
CC[C@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](C(=O)[O-])C(C)C	ZINC000256010976	509941090	/nfs/dbraw/zinc/94/10/90/509941090.db2.gz	XISNUVNLGJKNIK-NUEKZKHPSA-N	-1	0	364.442	2.553	50	0		FFAARM
CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)NC[C@H](CC(C)C)C(=O)[O-]	ZINC000262424437	510275330	/nfs/dbraw/zinc/27/53/30/510275330.db2.gz	DBVDQDGGHLUWHK-FUHWJXTLSA-N	-1	0	358.438	2.814	50	0		FFAARM
CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)NC[C@@H](CC(C)C)C(=O)[O-]	ZINC000262424438	510275457	/nfs/dbraw/zinc/27/54/57/510275457.db2.gz	DBVDQDGGHLUWHK-SJLPKXTDSA-N	-1	0	358.438	2.814	50	0		FFAARM
COc1ccc2c(c1)C[C@@H](C(C)C)CN2C(=O)c1cnc(C(=O)[O-])cn1	ZINC000263115346	510567386	/nfs/dbraw/zinc/56/73/86/510567386.db2.gz	DTNWCFHABJPKFT-CYBMUJFWSA-N	-1	0	355.394	2.659	50	0		FFAARM
Cc1[nH]c(C(=O)[O-])c(C)c1C(=O)N[C@@H]1CCCN(Cc2ccccc2F)C1	ZINC000299786402	511680824	/nfs/dbraw/zinc/68/08/24/511680824.db2.gz	XCRQLAAHEGGEQV-OAHLLOKOSA-N	-1	0	373.428	2.863	50	0		FFAARM
Cc1ccc(Cl)c(O[C@H](C)C(=O)N(CCC(=O)[O-])C2CCOCC2)c1	ZINC000408513302	513083368	/nfs/dbraw/zinc/08/33/68/513083368.db2.gz	NIXMZINVZDXIMI-CYBMUJFWSA-N	-1	0	369.845	2.898	50	0		FFAARM
CCCOc1ccccc1C(=O)N1CCC[C@@H](c2ccn(CC(=O)[O-])n2)C1	ZINC000426372553	513918882	/nfs/dbraw/zinc/91/88/82/513918882.db2.gz	ZTHUVDJXNUSWTJ-OAHLLOKOSA-N	-1	0	371.437	2.776	50	0		FFAARM
CC(C)(C(=O)[O-])C(=O)Nc1ccc(CC(=O)N2CCc3ccccc32)cc1	ZINC000517744182	516433925	/nfs/dbraw/zinc/43/39/25/516433925.db2.gz	OTBHJBPLVOVUIH-UHFFFAOYSA-N	-1	0	366.417	2.868	50	0		FFAARM
C[C@@]1(C(=O)[O-])C[C@H](O)CN1C(=O)OCC1c2ccccc2-c2ccccc21	ZINC000521398884	517715026	/nfs/dbraw/zinc/71/50/26/517715026.db2.gz	WSKXCJGRXYRWBH-ZSEKCTLFSA-N	-1	0	367.401	2.845	50	0		FFAARM
O=C([O-])CCc1ccc(-c2ccc([C@@H](O)CN3CCOCC3)cc2)cc1	ZINC000534662615	517990186	/nfs/dbraw/zinc/99/01/86/517990186.db2.gz	YWAUFBSRLKZKQR-FQEVSTJZSA-N	-1	0	355.434	2.736	50	0		FFAARM
CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)NC1CCC(C(=O)[O-])CC1	ZINC000268946537	519483494	/nfs/dbraw/zinc/48/34/94/519483494.db2.gz	XFKYREQMICXFBB-LEOMRAHMSA-N	-1	0	356.422	2.710	50	0		FFAARM
CCOc1cc(C(=O)N2CCC[C@H]2C(=O)[O-])ccc1OCc1cccnc1	ZINC000262710501	520658620	/nfs/dbraw/zinc/65/86/20/520658620.db2.gz	PBJKYERPZCJYIK-INIZCTEOSA-N	-1	0	370.405	2.749	50	0		FFAARM
COc1ccccc1[C@@H]1CN(C(=O)CSc2ccncc2)C[C@H]1C(=O)[O-]	ZINC000091536938	524758209	/nfs/dbraw/zinc/75/82/09/524758209.db2.gz	IHDHBOMDCPZTEC-JKSUJKDBSA-N	-1	0	372.446	2.509	50	0		FFAARM
COc1ccc([C@@H](CC(=O)[O-])NC(=O)[C@H]2COc3ccccc32)cc1OC	ZINC000268942234	525173721	/nfs/dbraw/zinc/17/37/21/525173721.db2.gz	LQAZKYSMDPYLAM-LSDHHAIUSA-N	-1	0	371.389	2.512	50	0		FFAARM
O=C([O-])[C@@H]1CCCN1CC(=O)N1CCc2sccc2[C@H]1c1ccccc1	ZINC000262607727	526274197	/nfs/dbraw/zinc/27/41/97/526274197.db2.gz	BBSNPOILQGCBTO-QFBILLFUSA-N	-1	0	370.474	2.771	50	0		FFAARM
O=C([O-])[C@@H]1[C@@H](c2ccccc2)[C@H](C(=O)OCCCO)[C@H]1c1ccccc1	ZINC000244764150	526294264	/nfs/dbraw/zinc/29/42/64/526294264.db2.gz	PCFRNRNCXSRKCS-QGFMHUBQSA-N	-1	0	354.402	2.810	50	0		FFAARM
Cc1oc(CNC(=O)C2(c3ccc(F)cc3)CCOCC2)cc1C(=O)[O-]	ZINC000263030514	526773263	/nfs/dbraw/zinc/77/32/63/526773263.db2.gz	UOOICNHJJXQBLO-UHFFFAOYSA-N	-1	0	361.369	2.790	50	0		FFAARM
O=C([O-])COc1cccc(CNC(=O)[C@H]2C[C@H]2c2c(F)cccc2F)c1	ZINC000238021178	527619106	/nfs/dbraw/zinc/61/91/06/527619106.db2.gz	XEMVCXOZFZHOPJ-KGLIPLIRSA-N	-1	0	361.344	2.848	50	0		FFAARM
CC1(C)Cc2c3c(nc(N4CCOCC4)c2CO1)sc1c3[n-]cnc1=O	ZINC000008766709	534944254	/nfs/dbraw/zinc/94/42/54/534944254.db2.gz	DAZGXOBKHOSKQM-UHFFFAOYSA-N	-1	0	372.450	2.633	50	0		FFAARM
COc1ccc(Br)c(C(=O)NC2(C(=O)[O-])CCCCC2)c1	ZINC000021020474	536624130	/nfs/dbraw/zinc/62/41/30/536624130.db2.gz	SFPOSXSPPCGRRK-UHFFFAOYSA-N	-1	0	356.216	2.975	50	0		FFAARM
COc1ccccc1OC1(C(=O)[O-])CCN(c2nc(C)cnc2C)CC1	ZINC000082120743	537087969	/nfs/dbraw/zinc/08/79/69/537087969.db2.gz	QXFKGEWKYHFFCH-UHFFFAOYSA-N	-1	0	357.410	2.605	50	0		FFAARM
Cc1noc(C)c1CN(C)S(=O)(=O)c1cc(Cl)cc(C(=O)[O-])c1C	ZINC000123762823	571189458	/nfs/dbraw/zinc/18/94/58/571189458.db2.gz	MSWFTSRYHDKVHY-UHFFFAOYSA-N	-1	0	372.830	2.772	50	0		FFAARM
Cc1ccc(-n2ncc3c2CCC[C@@H]3NC(=O)c2cc(=O)[nH][n-]2)cc1C	ZINC000091986950	571197719	/nfs/dbraw/zinc/19/77/19/571197719.db2.gz	OMUNRJUMSYQOAQ-HNNXBMFYSA-N	-1	0	351.410	2.725	50	0		FFAARM
Cn1c(=O)c(C(=O)NN=Cc2cccc(Cl)c2)c([O-])c2ccccc21	ZINC000006191418	727785096	/nfs/dbraw/zinc/78/50/96/727785096.db2.gz	MMBLRDZUJMPLRW-KEBDBYFISA-N	-1	0	355.781	2.661	50	0		FFAARM
O=C([O-])C1(NC(=O)C[C@@H](Cc2ccccc2)c2ccco2)CCOCC1	ZINC000952964728	939809508	/nfs/dbraw/zinc/80/95/08/939809508.db2.gz	PGJLVKJFYYUBTH-MRXNPFEDSA-N	-1	0	357.406	2.746	50	0		FFAARM
CCn1c(C)nc2cc(C(=O)NN=Cc3ccc(C(=O)[O-])cc3)ccc21	ZINC000254713573	1014506200	/nfs/dbraw/zinc/50/62/00/1014506200.db2.gz	FOUAHLGPSWEUAY-UHFFFAOYSA-N	-1	0	350.378	2.827	50	0		FFAARM
CCOC(=O)c1ccccc1NC(=O)c1c([O-])c2ccccc2n(C)c1=O	ZINC000000626807	986695586	/nfs/dbraw/zinc/69/55/86/986695586.db2.gz	VZYRAKQKOGJXIE-UHFFFAOYSA-N	-1	0	366.373	2.673	50	0		FFAARM
O=C([O-])[C@H]1CCN(S(=O)(=O)c2cccc3c2OCCC3)c2ccccc21	ZINC000656643465	1025434801	/nfs/dbraw/zinc/43/48/01/1025434801.db2.gz	HVGWGRTUGSMQEW-HNNXBMFYSA-N	-1	0	373.430	2.779	50	0		FFAARM
Cn1ccnc1C(=O)N1C[C@@H]2C[C@@H](c3ccccc3)CC[C@]2(C(=O)[O-])C1	ZINC000299798829	223102653	/nfs/dbraw/zinc/10/26/53/223102653.db2.gz	SORVHFQQDIFRNL-FTRWYGJKSA-N	-1	0	353.422	2.531	50	0		FFAARM
CC(C)(C)OC(=O)N[C@@H](Cc1c(F)c(F)c(F)c(F)c1F)C(=O)[O-]	ZINC000002517129	204043075	/nfs/dbraw/zinc/04/30/75/204043075.db2.gz	UZDKQMIDSLETST-LURJTMIESA-N	-1	0	355.259	2.903	50	0		FFAARM
Cc1ccc(C(=O)[O-])cc1NC(=O)[C@H](C)Cn1cc(Br)cn1	ZINC000002794429	204058400	/nfs/dbraw/zinc/05/84/00/204058400.db2.gz	CMEJXKXZLYOCRN-SNVBAGLBSA-N	-1	0	366.215	2.927	50	0		FFAARM
O=C1N[C@@H](c2ccccc2)C(=C([O-])c2cccs2)[C@](O)(C(F)(F)F)N1	ZINC000004163465	204124086	/nfs/dbraw/zinc/12/40/86/204124086.db2.gz	OXRRYKXYECAQSB-XUJVJEKNSA-N	-1	0	370.352	2.852	50	0		FFAARM
CCOc1ccc(C(=O)Nc2cnn(CCCC(=O)[O-])c2)cc1OCC	ZINC000004761062	204161971	/nfs/dbraw/zinc/16/19/71/204161971.db2.gz	YXZLKVDUNNKBPA-UHFFFAOYSA-N	-1	0	361.398	2.798	50	0		FFAARM
COc1ccc(C(=O)Nc2cc(OC)c(OC)cc2C(=O)[O-])c(OC)c1	ZINC000004828634	204167244	/nfs/dbraw/zinc/16/72/44/204167244.db2.gz	CUFPRULEHBLSCC-UHFFFAOYSA-N	-1	0	361.350	2.672	50	0		FFAARM
COc1cccc(C[C@H](C(=O)Nc2ccccc2Cl)c2nnn[n-]2)c1	ZINC000005485642	204210576	/nfs/dbraw/zinc/21/05/76/204210576.db2.gz	KWZXYKYFGSMHII-ZDUSSCGKSA-N	-1	0	357.801	2.827	50	0		FFAARM
Cc1ccnc([N-]S(=O)(=O)c2ccc(I)cc2)c1	ZINC000005598850	204217051	/nfs/dbraw/zinc/21/70/51/204217051.db2.gz	QCYASFBBNOQHKB-UHFFFAOYSA-N	-1	0	374.203	2.795	50	0		FFAARM
O=C([O-])c1cnn2c1N[C@@H](c1ccc3c(c1)OCO3)C[C@@H]2C(F)(F)F	ZINC000005027165	204186317	/nfs/dbraw/zinc/18/63/17/204186317.db2.gz	BLNNAPTWPAAZLE-BXKDBHETSA-N	-1	0	355.272	2.970	50	0		FFAARM
COc1ccc2c(c1OC)C(=O)N(c1cccc(/C=C\C(=O)[O-])c1)C2=O	ZINC000006373198	204246239	/nfs/dbraw/zinc/24/62/39/204246239.db2.gz	METZUJJKTOHAGT-TWGQIWQCSA-N	-1	0	353.330	2.602	50	0		FFAARM
Cc1cc(C(F)(F)F)c2c(N)c(C(=O)N3CCC[C@H]3C(=O)[O-])sc2n1	ZINC000008783394	204346226	/nfs/dbraw/zinc/34/62/26/204346226.db2.gz	LUPOYOUOQBNILQ-QMMMGPOBSA-N	-1	0	373.356	2.895	50	0	biogenic,in-vitro	FFAARM
Cc1ccc(-n2nnnc2SCc2nc(=O)c3sccc3[n-]2)cc1	ZINC000009499879	204371071	/nfs/dbraw/zinc/37/10/71/204371071.db2.gz	HYMWCDMRXSVFNR-UHFFFAOYSA-N	-1	0	356.436	2.561	50	0		FFAARM
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)[C@H]1CC=CC[C@H]1C(=O)[O-]	ZINC000012649155	204483535	/nfs/dbraw/zinc/48/35/35/204483535.db2.gz	CEVDAKZMDQZIES-DLBZAZTESA-N	-1	0	353.422	2.772	50	0		FFAARM
COCCCn1c2nc(-c3ccccc3)cc(C(=O)[O-])c2c(=O)[nH]c1=S	ZINC000036617229	205017663	/nfs/dbraw/zinc/01/76/63/205017663.db2.gz	RIPQDXXVADEOIE-UHFFFAOYSA-N	-1	0	371.418	2.856	50	0		FFAARM
O=C([O-])c1ccccc1NC(=O)N1CCc2[nH]cnc2[C@@H]1c1ccccn1	ZINC000040309533	205024205	/nfs/dbraw/zinc/02/42/05/205024205.db2.gz	BWLSBRACRPQXRV-KRWDZBQOSA-N	-1	0	363.377	2.683	50	0	biogenic	FFAARM
CC[C@H](O)[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)[O-]	ZINC000038528955	205042003	/nfs/dbraw/zinc/04/20/03/205042003.db2.gz	VSKJOSVYDOHRGI-ROUUACIJSA-N	-1	0	355.390	2.749	50	0		FFAARM
O=C([O-])c1cc(NS(=O)(=O)N2CCCCC2)cc(C(F)(F)F)c1	ZINC000072015910	205032478	/nfs/dbraw/zinc/03/24/78/205032478.db2.gz	SMVPBFPWXSIDLE-UHFFFAOYSA-N	-1	0	352.334	2.546	50	0		FFAARM
CC(=O)Nc1ccc(NS(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)cc1C	ZINC000040058143	205051443	/nfs/dbraw/zinc/05/14/43/205051443.db2.gz	SRARTTIXXKAEIC-BJMVGYQFSA-N	-1	0	374.418	2.852	50	0		FFAARM
O=C([O-])c1ccc(NC(=O)[C@@H]2CC(=O)Nc3nc4ccccc4n32)cc1	ZINC000040268864	205064308	/nfs/dbraw/zinc/06/43/08/205064308.db2.gz	HHRMUMKDIYHDTD-AWEZNQCLSA-N	-1	0	350.334	2.906	50	0		FFAARM
[O-]c1c([C@@H](c2ccccc2Cl)N2CCOCC2)sc2ncnn12	ZINC000041636510	205091573	/nfs/dbraw/zinc/09/15/73/205091573.db2.gz	PQRGYNYKQKAVGU-GFCCVEGCSA-N	-1	0	350.831	2.571	50	0		FFAARM
COc1cccc([C@@H]2C[C@H]2C(=O)NCc2ccc(OC)c(C(=O)[O-])c2)c1	ZINC000299752559	205134171	/nfs/dbraw/zinc/13/41/71/205134171.db2.gz	UOQSGCROFATVFO-JKSUJKDBSA-N	-1	0	355.390	2.822	50	0		FFAARM
O=C([O-])CN(C(=O)CCCOc1ccccc1Cl)C1CCOCC1	ZINC000299753150	205134487	/nfs/dbraw/zinc/13/44/87/205134487.db2.gz	XAPCDRVTPMIBBZ-UHFFFAOYSA-N	-1	0	355.818	2.591	50	0		FFAARM
O=S(=O)(Cc1cc2c(c(Cl)c1)OCO2)c1nc2ccccc2[n-]1	ZINC000047940195	205150444	/nfs/dbraw/zinc/15/04/44/205150444.db2.gz	XJXOUGHNNZDTPL-UHFFFAOYSA-N	-1	0	350.783	2.919	50	0		FFAARM
CCOC(=O)CN(C)c1ccc(NC(=O)c2cccc(C)c2)cc1C(=O)[O-]	ZINC000046053504	205130797	/nfs/dbraw/zinc/13/07/97/205130797.db2.gz	NSDUNEKYHVTKHI-UHFFFAOYSA-N	-1	0	370.405	2.945	50	0		FFAARM
CC(C)Oc1ncc(C(=O)N(CCC(=O)[O-])C2CCOCC2)cc1Cl	ZINC000299751496	205131284	/nfs/dbraw/zinc/13/12/84/205131284.db2.gz	QSNJJYFRTVFSMY-UHFFFAOYSA-N	-1	0	370.833	2.618	50	0		FFAARM
C[C@H](Oc1ccc(F)cc1Cl)C(=O)N(CCC(=O)[O-])C1CCOCC1	ZINC000299751669	205131352	/nfs/dbraw/zinc/13/13/52/205131352.db2.gz	RGIFUOMPMBSQQG-NSHDSACASA-N	-1	0	373.808	2.729	50	0		FFAARM
CCc1cc(=O)[nH]c(-c2cccc(NC(=O)[C@H]3CC=CC[C@H]3C(=O)[O-])c2)n1	ZINC000055149708	205207732	/nfs/dbraw/zinc/20/77/32/205207732.db2.gz	CTUCCGRJKBUESQ-JKSUJKDBSA-N	-1	0	367.405	2.605	50	0		FFAARM
COc1cccc(C[C@H](C(=O)Nc2ccc(C)cc2C)c2nnn[n-]2)c1	ZINC000057525350	205243064	/nfs/dbraw/zinc/24/30/64/205243064.db2.gz	AOJDGXWETYSIRM-INIZCTEOSA-N	-1	0	351.410	2.790	50	0		FFAARM
COc1ccc([N-]S(=O)(=O)c2cn(C)cn2)cc1Cc1ccccc1	ZINC000058378273	205274013	/nfs/dbraw/zinc/27/40/13/205274013.db2.gz	WMOIQJVTIFLQMF-UHFFFAOYSA-N	-1	0	357.435	2.820	50	0		FFAARM
COc1ccc([N-]S(=O)(=O)c2ccc(-c3ccno3)o2)cc1OC	ZINC000064958616	205311952	/nfs/dbraw/zinc/31/19/52/205311952.db2.gz	OYLBVWNVKXVFIQ-UHFFFAOYSA-N	-1	0	350.352	2.753	50	0		FFAARM
Cc1cc([N-]S(=O)(=O)c2cc(-c3ccc(=O)[nH]n3)cs2)ccc1F	ZINC000065129074	205318374	/nfs/dbraw/zinc/31/83/74/205318374.db2.gz	NJUACFVEXHUEDJ-UHFFFAOYSA-N	-1	0	365.411	2.747	50	0		FFAARM
CCc1nn2c(nc(C)c2S(=O)(=O)[N-]c2ccc(C(C)=O)cc2)s1	ZINC000065183716	205322069	/nfs/dbraw/zinc/32/20/69/205322069.db2.gz	PBJMMRUWUZHCQV-UHFFFAOYSA-N	-1	0	364.452	2.665	50	0		FFAARM
CC1(C)[C@H](C(=O)Nc2cccc(C(=O)Nc3ccccn3)c2)[C@@H]1C(=O)[O-]	ZINC000071285786	205424578	/nfs/dbraw/zinc/42/45/78/205424578.db2.gz	ZGQUQGRADZIJNE-LSDHHAIUSA-N	-1	0	353.378	2.629	50	0		FFAARM
COc1cc(Cl)cc(CN2CCOC[C@@H]2CC(=O)[O-])c1OC(C)C	ZINC000072135324	205475361	/nfs/dbraw/zinc/47/53/61/205475361.db2.gz	YJSBFNZQHBTNDN-AWEZNQCLSA-N	-1	0	357.834	2.811	50	0		FFAARM
C[C@@H]1Cc2ccccc2N1C(=O)c1ccc2c(c1)[n-]c(=S)n(C)c2=O	ZINC000102750858	205979070	/nfs/dbraw/zinc/97/90/70/205979070.db2.gz	IESUMEWVCOSTBS-LLVKDONJSA-N	-1	0	351.431	2.814	50	0		FFAARM
CCn1c(=O)c2ccc(C(=O)NCCc3cccs3)cc2[n-]c1=S	ZINC000102168598	205970495	/nfs/dbraw/zinc/97/04/95/205970495.db2.gz	RDYNMESUFAEIBH-UHFFFAOYSA-N	-1	0	359.476	2.739	50	0		FFAARM
CCO[C@H](C)c1nc(CC(=O)N2CCC[C@H](CCC(=O)[O-])C2)cs1	ZINC000236918689	206001979	/nfs/dbraw/zinc/00/19/79/206001979.db2.gz	TUOXSMAGIRQADX-CHWSQXEVSA-N	-1	0	354.472	2.887	50	0		FFAARM
COCCn1c(C)c(C)c2cc(C(=O)N3CCC[C@H](C(=O)[O-])C3)ccc21	ZINC000237133626	206088361	/nfs/dbraw/zinc/08/83/61/206088361.db2.gz	DNJRURBMFYDANP-INIZCTEOSA-N	-1	0	358.438	2.841	50	0		FFAARM
O=C(C[C@H]1COCCN1C(=O)c1ccc2[n-]c(=S)oc2c1)c1ccco1	ZINC000119231165	206104658	/nfs/dbraw/zinc/10/46/58/206104658.db2.gz	YYRNEDWJKAYMSM-LBPRGKRZSA-N	-1	0	372.402	2.824	50	0		FFAARM
C[C@@H](Oc1cccc(Br)c1)C(=O)N1CC[C@@](C)(C(=O)[O-])C1	ZINC000237498369	206106075	/nfs/dbraw/zinc/10/60/75/206106075.db2.gz	QEQGPSIJJJPDES-MEBBXXQBSA-N	-1	0	356.216	2.540	50	0		FFAARM
C[C@@]1(C(=O)[O-])CCN(C(=O)c2ccc(-n3ccc(C(F)(F)F)n3)cc2)C1	ZINC000237658880	206107075	/nfs/dbraw/zinc/10/70/75/206107075.db2.gz	KXGLSSBYBOTJJT-MRXNPFEDSA-N	-1	0	367.327	2.828	50	0		FFAARM
Cc1nc(-c2ccc(C)cc2)c(CC(=O)N2CCO[C@H](CC(=O)[O-])C2)s1	ZINC000237689720	206107842	/nfs/dbraw/zinc/10/78/42/206107842.db2.gz	DRLXHTVDJCOOAP-OAHLLOKOSA-N	-1	0	374.462	2.672	50	0		FFAARM
O=C([O-])CCN(Cc1cccc(F)c1F)C(=O)CCC1CCOCC1	ZINC000238139059	206114726	/nfs/dbraw/zinc/11/47/26/206114726.db2.gz	SWARPOBWPUNTLP-UHFFFAOYSA-N	-1	0	355.381	2.975	50	0		FFAARM
CN(C(=O)c1ccc2[n-]c(=S)oc2c1)[C@@H]1CCCC[C@H]1S(C)(=O)=O	ZINC000129824554	206126148	/nfs/dbraw/zinc/12/61/48/206126148.db2.gz	QSLZAEORGQCJSO-TZMCWYRMSA-N	-1	0	368.480	2.544	50	0		FFAARM
Cc1noc(-c2ccc(C(=O)N3[C@H](C(=O)[O-])C[C@@H]4CCCC[C@@H]43)cc2)n1	ZINC000237745699	206110020	/nfs/dbraw/zinc/11/00/20/206110020.db2.gz	IERWBAYNEFRYMF-JYJNAYRXSA-N	-1	0	355.394	2.903	50	0		FFAARM
O=C([O-])COc1cccc(CNC(=O)[C@@H]2C[C@@H]2c2cccc(F)c2F)c1	ZINC000238019369	206111217	/nfs/dbraw/zinc/11/12/17/206111217.db2.gz	GFSLSLIVINFQFP-HUUCEWRRSA-N	-1	0	361.344	2.848	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)c1nc(N2CCCC2)ncc1Cl)c1ccccc1	ZINC000238030022	206112406	/nfs/dbraw/zinc/11/24/06/206112406.db2.gz	ILDSFWFXYUKNNK-AWEZNQCLSA-N	-1	0	374.828	2.676	50	0		FFAARM
O=C([O-])CCN(C(=O)[C@H]1C[C@@H]1c1ccc(F)c(F)c1)C1CCOCC1	ZINC000238069558	206112533	/nfs/dbraw/zinc/11/25/33/206112533.db2.gz	XEUOFGUYUYJKCA-KGLIPLIRSA-N	-1	0	353.365	2.551	50	0		FFAARM
O=C([O-])CCN(C(=O)Cc1ccc(C(F)(F)F)cc1)C1CCOCC1	ZINC000238065462	206112654	/nfs/dbraw/zinc/11/26/54/206112654.db2.gz	JQAIEGDVZRSSTI-UHFFFAOYSA-N	-1	0	359.344	2.730	50	0		FFAARM
O=C([O-])[C@H]1CCCN(C(=O)c2cc3cc(Br)ccc3[nH]2)C1	ZINC000238077836	206112685	/nfs/dbraw/zinc/11/26/85/206112685.db2.gz	OHCHTYQCYAEAES-VIFPVBQESA-N	-1	0	351.200	2.867	50	0		FFAARM
CC(C)(C)O[N-]C(=O)[C@H]1CCCN1C(=O)c1ccc2ccccc2c1O	ZINC000156022910	206222322	/nfs/dbraw/zinc/22/23/22/206222322.db2.gz	CXSNVUGMDVUCLA-MRXNPFEDSA-N	-1	0	356.422	2.996	50	0		FFAARM
O=S(=O)([N-]c1nccs1)c1ccc(I)cc1	ZINC000000682328	206223814	/nfs/dbraw/zinc/22/38/14/206223814.db2.gz	SZBQIDXGUMEGDB-UHFFFAOYSA-N	-1	0	366.205	2.549	50	0		FFAARM
O=C([O-])c1cc(S(=O)(=O)Nc2ccc3c(c2)OCCO3)ccc1Cl	ZINC000012521413	206291754	/nfs/dbraw/zinc/29/17/54/206291754.db2.gz	YDWYWKKCJJFNTM-UHFFFAOYSA-N	-1	0	369.782	2.610	50	0		FFAARM
COC(=O)C[C@@H](c1ccsc1)c1c(=O)nc2ccc(Cl)cn2c1[O-]	ZINC000205974889	206337113	/nfs/dbraw/zinc/33/71/13/206337113.db2.gz	YPQLDMLVLCRIRO-NSHDSACASA-N	-1	0	364.810	2.810	50	0		FFAARM
Cn1nc(C(=O)[O-])c2c1CCN(Cc1ccc([C@H]3CCCCO3)s1)C2	ZINC000215076031	206344458	/nfs/dbraw/zinc/34/44/58/206344458.db2.gz	GZTVIBPEWFMOQP-OAHLLOKOSA-N	-1	0	361.467	2.980	50	0		FFAARM
Cn1c(CO)nnc1C1CCN(Cc2c(Cl)ccc([O-])c2Cl)CC1	ZINC000216125323	206355528	/nfs/dbraw/zinc/35/55/28/206355528.db2.gz	VNMSCZUTSGMGCH-UHFFFAOYSA-N	-1	0	371.268	2.699	50	0		FFAARM
CCc1nc2sc([C@@H](c3ccccc3F)N3CCOCC3)c([O-])n2n1	ZINC000022854209	206394008	/nfs/dbraw/zinc/39/40/08/206394008.db2.gz	KCRAKJPRXCWRDI-CQSZACIVSA-N	-1	0	362.430	2.620	50	0		FFAARM
Cc1[nH]c2ccccc2c(=O)c1C[C@H](C(=O)[O-])C(=O)Nc1ccccc1	ZINC000227163501	206521430	/nfs/dbraw/zinc/52/14/30/206521430.db2.gz	CRQFTWGSFJQOEZ-INIZCTEOSA-N	-1	0	350.374	2.719	50	0		FFAARM
COc1cc(S(=O)(=O)N(C)c2ccc(C)cc2)cc(C(=O)[O-])c1OC	ZINC000065667926	206526652	/nfs/dbraw/zinc/52/66/52/206526652.db2.gz	QXXCOVPQYQAVCI-UHFFFAOYSA-N	-1	0	365.407	2.536	50	0		FFAARM
COc1ccc(N2CCN(Cc3ccc(CC(=O)[O-])cc3)[C@@H](C)C2=O)cc1	ZINC000077407306	132183860	/nfs/dbraw/zinc/18/38/60/132183860.db2.gz	RFKCYCLDFSFORK-HNNXBMFYSA-N	-1	0	368.433	2.560	50	0		FFAARM
O=C([O-])c1ccc(CNC(=O)CCN2C(=O)CCc3cc(F)ccc32)cc1	ZINC000238107726	132249019	/nfs/dbraw/zinc/24/90/19/132249019.db2.gz	LDIBIELURSBSTF-UHFFFAOYSA-N	-1	0	370.380	2.510	50	0		FFAARM
O=C([O-])/C=C\C(=O)Nc1ccc(N2CCN(c3ccccc3)CC2)cc1	ZINC000004661679	132387030	/nfs/dbraw/zinc/38/70/30/132387030.db2.gz	LXHPGFPZBRNHJB-KHPPLWFESA-N	-1	0	351.406	2.593	50	0		FFAARM
O=C([O-])C1(Cc2ccc(Cl)cc2)CCN(c2ncnc3nc[nH]c32)CC1	ZINC000071752689	136140321	/nfs/dbraw/zinc/14/03/21/136140321.db2.gz	POTJUBVCZQXKKM-UHFFFAOYSA-N	-1	0	371.828	2.920	50	0		FFAARM
Cc1sc2ncnc(N3CCC(C(=O)[O-])(n4ccnc4)CC3)c2c1C	ZINC000072433544	136147142	/nfs/dbraw/zinc/14/71/42/136147142.db2.gz	QZYSOUXTOARJES-UHFFFAOYSA-N	-1	0	357.439	2.585	50	0		FFAARM
CCCCNC(=O)c1ccc2c(c1)[n-]c(=S)n(C[C@@H]1CCCO1)c2=O	ZINC000002970804	263327300	/nfs/dbraw/zinc/32/73/00/263327300.db2.gz	KQHZRLWSXLBHJM-ZDUSSCGKSA-N	-1	0	361.467	2.768	50	0		FFAARM
O=c1c2cc(N3CCOCC3)ccc2[n-]c(=S)n1Cc1ccccc1	ZINC000002971390	263327319	/nfs/dbraw/zinc/32/73/19/263327319.db2.gz	UVSPHNCYULZUBM-UHFFFAOYSA-N	-1	0	353.447	2.944	50	0		FFAARM
COc1cccc([C@H]2N[C@@H](C(=O)[O-])Cc3c4ccccc4[nH]c32)c1OC	ZINC000000771868	506231472	/nfs/dbraw/zinc/23/14/72/506231472.db2.gz	ZKLBZOHWBKUYBF-NVXWUHKLSA-N	-1	0	352.390	2.873	50	0	biogenic	FFAARM
Cc1ccc(S(=O)(=O)[N-]c2nc(NC(C)C)nc(NC(C)C)n2)cc1	ZINC000000854240	506236717	/nfs/dbraw/zinc/23/67/17/506236717.db2.gz	SFZYXDKLDAMRQO-UHFFFAOYSA-N	-1	0	364.475	2.621	50	0		FFAARM
COc1ccc(OC)c([N-]S(=O)(=O)c2ccc(OC)c(OC)c2)c1	ZINC000000885127	506239230	/nfs/dbraw/zinc/23/92/30/506239230.db2.gz	MNVOTOIEUVAWRT-UHFFFAOYSA-N	-1	0	353.396	2.522	50	0		FFAARM
CCOc1ccc(NC(=O)[C@@H](Cc2ccccc2OC)c2nnn[n-]2)cc1	ZINC000000931691	506240867	/nfs/dbraw/zinc/24/08/67/506240867.db2.gz	APMISVWZPHDGTC-INIZCTEOSA-N	-1	0	367.409	2.572	50	0		FFAARM
O=C(N[C@@H]1CCSC1)c1ccccc1[N-]S(=O)(=O)c1ccccc1	ZINC000001024080	506244510	/nfs/dbraw/zinc/24/45/10/506244510.db2.gz	NZELCDBYPPBNGH-CYBMUJFWSA-N	-1	0	362.476	2.723	50	0		FFAARM
COc1cc(NC(=O)c2c([O-])c3sccc3n(C)c2=O)cc(OC)c1	ZINC000065215380	506269607	/nfs/dbraw/zinc/26/96/07/506269607.db2.gz	KBJBTSVSVWIVGQ-UHFFFAOYSA-N	-1	0	360.391	2.575	50	0		FFAARM
Cc1ccc(F)cc1S(=O)(=O)Nc1ccc(N(C)C)c(C(=O)[O-])c1	ZINC000032962255	506318039	/nfs/dbraw/zinc/31/80/39/506318039.db2.gz	VDLAIHZGRHPQNK-UHFFFAOYSA-N	-1	0	352.387	2.699	50	0		FFAARM
COc1ccc(NC(=O)CCc2nnc(-c3cccc(F)c3)[n-]c2=O)cc1	ZINC000034768554	506370556	/nfs/dbraw/zinc/37/05/56/506370556.db2.gz	KBXNXDJHLSGYHN-UHFFFAOYSA-N	-1	0	368.368	2.963	50	0		FFAARM
COc1ccc(S(=O)(=O)Nc2cccc(C(=O)[O-])c2C)cc1OC	ZINC000065844515	506377805	/nfs/dbraw/zinc/37/78/05/506377805.db2.gz	XTNRLQBGVZROOW-UHFFFAOYSA-N	-1	0	351.380	2.511	50	0		FFAARM
Cc1c(Cl)cccc1S(=O)(=O)Nc1cnc(N(C)C)c(C(=O)[O-])c1	ZINC000035397742	506381270	/nfs/dbraw/zinc/38/12/70/506381270.db2.gz	LKNHWFKHRSXYOZ-UHFFFAOYSA-N	-1	0	369.830	2.608	50	0		FFAARM
CN1Cc2cc(C(=O)c3cc(Br)ccc3[O-])cnc2NC1=O	ZINC000009644649	506706602	/nfs/dbraw/zinc/70/66/02/506706602.db2.gz	ZJDBADTVTIKWRO-UHFFFAOYSA-N	-1	0	362.183	2.758	50	0		FFAARM
CCCn1c(=O)cc([O-])nc1SCC(=O)Nc1ccc(F)c(Cl)c1	ZINC000013121452	506928806	/nfs/dbraw/zinc/92/88/06/506928806.db2.gz	XCIADWJICXZKIG-UHFFFAOYSA-N	-1	0	371.821	2.882	50	0		FFAARM
COc1ccc([C@H](CC(=O)[O-])NC(=O)c2ccc(F)cc2F)cc1OC	ZINC000013182314	506930349	/nfs/dbraw/zinc/93/03/49/506930349.db2.gz	AIGPLWVOFQSYNY-AWEZNQCLSA-N	-1	0	365.332	2.928	50	0		FFAARM
CCOc1ccc(C(=O)N2C[C@@H](C(=O)[O-])Oc3ccccc32)cc1OC	ZINC000013434065	506941027	/nfs/dbraw/zinc/94/10/27/506941027.db2.gz	RRNKOTWKSHJTFT-KRWDZBQOSA-N	-1	0	357.362	2.586	50	0		FFAARM
CC(NCc1ccc(F)cc1)=C1C(=O)[N-]C(=O)N(c2ccccc2C)C1=O	ZINC000020292843	507218089	/nfs/dbraw/zinc/21/80/89/507218089.db2.gz	OIVXNYWFNZNRIL-GHRIWEEISA-N	-1	0	367.380	2.781	50	0		FFAARM
COc1ccccc1-c1nc(CC(=O)N[C@@H](CC(C)C)C(=O)[O-])cs1	ZINC000020720081	507231292	/nfs/dbraw/zinc/23/12/92/507231292.db2.gz	SZLLQGPMXSWXHT-AWEZNQCLSA-N	-1	0	362.451	2.977	50	0		FFAARM
O=C([O-])[C@H]1CCCN(C(=O)Cn2ccc3cc(Br)ccc32)C1	ZINC000020726918	507234062	/nfs/dbraw/zinc/23/40/62/507234062.db2.gz	CMWIZKDENDNHOY-LBPRGKRZSA-N	-1	0	365.227	2.727	50	0		FFAARM
CCCN(CC(=O)Nc1cccc(F)c1)Cc1nc(=O)c2sccc2[n-]1	ZINC000024834745	507443092	/nfs/dbraw/zinc/44/30/92/507443092.db2.gz	GCTFIOOGXQNEHF-UHFFFAOYSA-N	-1	0	374.441	2.974	50	0		FFAARM
O=C(Nc1ccc(S(=O)(=O)[N-]c2ncccn2)cc1)c1ccsc1	ZINC000025010375	507460113	/nfs/dbraw/zinc/46/01/13/507460113.db2.gz	AMULZMQMKQVLMZ-UHFFFAOYSA-N	-1	0	360.420	2.591	50	0		FFAARM
CCC[C@H]1CCc2sc(C(=O)N3CCC(O)(C(=O)[O-])CC3)cc2C1	ZINC000071764664	507714052	/nfs/dbraw/zinc/71/40/52/507714052.db2.gz	MEPLAKFLCFOJAK-LBPRGKRZSA-N	-1	0	351.468	2.705	50	0		FFAARM
Cc1[nH]c2ccc(C(=O)N3CCn4nc(CCC(=O)[O-])cc4C3)cc2c1C	ZINC000072132041	507752636	/nfs/dbraw/zinc/75/26/36/507752636.db2.gz	LMTGHFQQDVHNGT-UHFFFAOYSA-N	-1	0	366.421	2.654	50	0		FFAARM
COc1ccc(C2=NO[C@@](CC(=O)Nc3ccccc3)(C(=O)[O-])C2)cc1	ZINC000072405516	507783661	/nfs/dbraw/zinc/78/36/61/507783661.db2.gz	AGDQUIOIJKKYPD-IBGZPJMESA-N	-1	0	354.362	2.672	50	0		FFAARM
COC(=O)c1[n-]c(=NC(=O)c2sc(C)nc2C)sc1CC(C)C	ZINC000072405050	507784100	/nfs/dbraw/zinc/78/41/00/507784100.db2.gz	VBHJPPGOTDASGP-UHFFFAOYSA-N	-1	0	353.469	3.454	50	0		FFAARM
Cc1cc(C)n([C@H]2CCN(c3nccc(-c4cc(C(=O)[O-])ccn4)n3)C2)n1	ZINC000072448111	507792988	/nfs/dbraw/zinc/79/29/88/507792988.db2.gz	WXJASMSBKACWRF-HNNXBMFYSA-N	-1	0	364.409	2.502	50	0		FFAARM
O=C([O-])CCc1cc2n(n1)CCCN(Cc1nc3c(s1)CCCC3)C2	ZINC000072463342	507794813	/nfs/dbraw/zinc/79/48/13/507794813.db2.gz	IZRYXDUHCDCNKN-UHFFFAOYSA-N	-1	0	360.483	2.642	50	0		FFAARM
COC(=O)c1[n-]c(=NC(=O)c2nn(C)c3ccccc32)sc1C(C)C	ZINC000079480961	507965978	/nfs/dbraw/zinc/96/59/78/507965978.db2.gz	DNJBLWVWQLJCAQ-UHFFFAOYSA-N	-1	0	358.423	3.192	50	0		FFAARM
Cc1noc(C)c1[C@@H](C(=O)[O-])N1CCN(C/C=C/c2ccccc2)CC1	ZINC000095358643	508175611	/nfs/dbraw/zinc/17/56/11/508175611.db2.gz	XIXVVQMQJJIMQN-AIADIJKESA-N	-1	0	355.438	2.748	50	0		FFAARM
O=C([O-])[C@H](c1ccc(O)cc1)N1CCN(C/C=C/c2ccccc2)CC1	ZINC000095375695	508179583	/nfs/dbraw/zinc/17/95/83/508179583.db2.gz	XETZIESNYHJWNN-PDGUBNMISA-N	-1	0	352.434	2.849	50	0		FFAARM
CC(C)c1cncnc1N1C[C@H]2COc3ccccc3C[C@@]2(C(=O)[O-])C1	ZINC000095390388	508183447	/nfs/dbraw/zinc/18/34/47/508183447.db2.gz	OAZZSBWEXIBTQO-MGPUTAFESA-N	-1	0	353.422	2.742	50	0		FFAARM
Cc1nc(CN2CCN([C@@H](C(=O)[O-])c3cccc(C)c3F)CC2)cs1	ZINC000095520466	508194765	/nfs/dbraw/zinc/19/47/65/508194765.db2.gz	AJQKBTCHSONLFL-QGZVFWFLSA-N	-1	0	363.458	2.843	50	0		FFAARM
COc1cccc(C=CC(=O)N(C)Cc2nc(=O)c3sccc3[n-]2)c1	ZINC000096129706	508207424	/nfs/dbraw/zinc/20/74/24/508207424.db2.gz	ZDXVXGJXWOKUBG-SREVYHEPSA-N	-1	0	355.419	2.665	50	0		FFAARM
O=C([O-])CN1C(=O)/C(=C/c2ccccc2OC(F)(F)F)SC1=S	ZINC000096129254	508207742	/nfs/dbraw/zinc/20/77/42/508207742.db2.gz	UJDXNGDCLDZTRG-UITAMQMPSA-N	-1	0	363.338	2.871	50	0		FFAARM
COc1cccc2c1OC[C@]1(C(=O)[O-])CN(C(=O)c3cc(C)oc3C)C[C@H]21	ZINC000096149527	508208537	/nfs/dbraw/zinc/20/85/37/508208537.db2.gz	UBMGWCSDKBJELF-FOIQADDNSA-N	-1	0	371.389	2.608	50	0		FFAARM
CCc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccc(F)cc4)c=3c2=O)cc1	ZINC000101168022	508240754	/nfs/dbraw/zinc/24/07/54/508240754.db2.gz	YNWWZRCPBFWBLT-IRXDYDNUSA-N	-1	0	352.369	2.882	50	0		FFAARM
COc1cccc(-n2[nH][n-]c3c(=O)n(-c4cccc(Cl)c4)c(=O)c2=3)c1	ZINC000101260661	508241231	/nfs/dbraw/zinc/24/12/31/508241231.db2.gz	AMYYMFYWQPIHJW-LSDHHAIUSA-N	-1	0	356.769	2.846	50	0		FFAARM
CCOc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccccc4)c=3c2=O)cc1	ZINC000101417730	508241446	/nfs/dbraw/zinc/24/14/46/508241446.db2.gz	VKVRKORTRNWXTE-DLBZAZTESA-N	-1	0	350.378	2.579	50	0		FFAARM
Cc1nn(C)c([N-]S(=O)(=O)c2cc(Br)sc2C)c1C	ZINC000128161543	508556231	/nfs/dbraw/zinc/55/62/31/508556231.db2.gz	MAIVYQOEWFGCMW-UHFFFAOYSA-N	-1	0	364.290	2.970	50	0		FFAARM
O=C([O-])[C@@H]1CCCN(C(=O)c2nc(C3CC3)n(-c3ccccc3Cl)n2)C1	ZINC000136155730	508675130	/nfs/dbraw/zinc/67/51/30/508675130.db2.gz	MWZKSTHKWCRTJO-GFCCVEGCSA-N	-1	0	374.828	2.735	50	0		FFAARM
Cc1ccc2[nH]c(CCC(=O)NCCc3nc(C(=O)[O-])cs3)nc2c1C	ZINC000221310360	509306731	/nfs/dbraw/zinc/30/67/31/509306731.db2.gz	YFRFXDLXXJNRTB-UHFFFAOYSA-N	-1	0	372.450	2.626	50	0		FFAARM
CN(Cc1cccc(Cl)c1)C(=O)CC[C@]1(CCC(=O)[O-])CCC(=O)N1	ZINC000222290785	509314634	/nfs/dbraw/zinc/31/46/34/509314634.db2.gz	ZLLZAARWFHOCSQ-SFHVURJKSA-N	-1	0	366.845	2.592	50	0		FFAARM
O=S(=O)([N-]c1nnc(-c2ccc(F)cc2)o1)c1cc(F)cc(F)c1	ZINC000225694649	509384474	/nfs/dbraw/zinc/38/44/74/509384474.db2.gz	PZXWZMWRLPRGIO-UHFFFAOYSA-N	-1	0	355.297	2.955	50	0		FFAARM
CC(C)c1ncc(Cl)c(C(=O)N2Cc3ccccc3C[C@@H]2C(=O)[O-])n1	ZINC000236625293	509466356	/nfs/dbraw/zinc/46/63/56/509466356.db2.gz	JMMROEJKQUBQTR-CQSZACIVSA-N	-1	0	359.813	2.905	50	0		FFAARM
CCCCC[C@@H](NC(=O)[C@H]1CCCN(C(=O)c2ccccc2)C1)C(=O)[O-]	ZINC000170592113	509673890	/nfs/dbraw/zinc/67/38/90/509673890.db2.gz	QOZOFHGPWOJWST-DLBZAZTESA-N	-1	0	360.454	2.689	50	0		FFAARM
Cc1cc(F)ccc1-c1ccc(C(=O)N2CCO[C@@H](C(=O)[O-])C2)cc1F	ZINC000237649967	509701506	/nfs/dbraw/zinc/70/15/06/509701506.db2.gz	YIEOPOVTUNAWCT-QGZVFWFLSA-N	-1	0	361.344	2.866	50	0		FFAARM
O=C([O-])CCN(C(=O)c1cc(F)cc(Br)c1)C1CCOCC1	ZINC000238073909	509815029	/nfs/dbraw/zinc/81/50/29/509815029.db2.gz	CFKCIVXHVBKZCT-UHFFFAOYSA-N	-1	0	374.206	2.684	50	0		FFAARM
CC(C)[C@H]1CC[C@@H](C)C[C@@H]1OC(=O)[C@H](C)Sc1n[nH]c(=O)[n-]c1=O	ZINC000238937277	509835922	/nfs/dbraw/zinc/83/59/22/509835922.db2.gz	UXEDYYWVDVLBNH-KXNHARMFSA-N	-1	0	355.460	2.767	50	0		FFAARM
O=C(CCCc1c[nH]c2ccccc12)[N-]S(=O)(=O)c1ncccc1F	ZINC000242304963	509845495	/nfs/dbraw/zinc/84/54/95/509845495.db2.gz	YTQPXAMOSAKQKU-UHFFFAOYSA-N	-1	0	361.398	2.530	50	0		FFAARM
O=C([O-])[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccc2c(c1)NC(=O)CS2	ZINC000261657959	510015225	/nfs/dbraw/zinc/01/52/25/510015225.db2.gz	KJPKIKPTJFKACH-SWHYSGLUSA-N	-1	0	360.435	2.589	50	0		FFAARM
COc1cccc(Nc2ccccc2C(=O)N2CCO[C@@H](CC(=O)[O-])C2)c1	ZINC000262692855	510372299	/nfs/dbraw/zinc/37/22/99/510372299.db2.gz	AKYSHCPCISWHCO-INIZCTEOSA-N	-1	0	370.405	2.755	50	0		FFAARM
CCO[C@@H]1C[C@](NC(=O)c2ccc(-n3ccc(C)n3)cc2)(C(=O)[O-])C1(C)C	ZINC000262837739	510433904	/nfs/dbraw/zinc/43/39/04/510433904.db2.gz	SVOFYEKXNSZSPW-UZLBHIALSA-N	-1	0	371.437	2.569	50	0		FFAARM
Cc1oc(CNC(=O)c2ccc(OC[C@H]3CCCO3)cc2)cc1C(=O)[O-]	ZINC000262979112	510504792	/nfs/dbraw/zinc/50/47/92/510504792.db2.gz	MTRXQNUUCLTFLJ-OAHLLOKOSA-N	-1	0	359.378	2.774	50	0		FFAARM
C[C@H]1Cc2cc(S(=O)(=O)[N-]c3nnc(CC4CCCC4)o3)ccc2O1	ZINC000194901629	510583247	/nfs/dbraw/zinc/58/32/47/510583247.db2.gz	UXWIIWNZBTYLNX-NSHDSACASA-N	-1	0	363.439	2.927	50	0		FFAARM
O=C([O-])[C@H](Cc1c[nH]c2ccccc12)NC(=O)N1CCC(F)(F)CC1	ZINC000405095159	512971070	/nfs/dbraw/zinc/97/10/70/512971070.db2.gz	QIPRHWLRCRKGPT-AWEZNQCLSA-N	-1	0	351.353	2.604	50	0		FFAARM
COc1ccc(F)c(F)c1CN1CCC[C@H](c2ccn(CC(=O)[O-])n2)C1	ZINC000426509485	513963789	/nfs/dbraw/zinc/96/37/89/513963789.db2.gz	NMCOEPKUWWZRLL-LBPRGKRZSA-N	-1	0	365.380	2.634	50	0		FFAARM
CCN1CCN(C(=O)c2ccc(-c3ncc(C(=O)[O-])cc3Cl)cc2)CC1	ZINC000426511685	513965580	/nfs/dbraw/zinc/96/55/80/513965580.db2.gz	NDYPODASNGWCKM-UHFFFAOYSA-N	-1	0	373.840	2.878	50	0		FFAARM
COc1cc(C)cc(OC)c1-c1ccc(C[C@H](NC(C)=O)C(=O)[O-])cc1	ZINC000534636285	517974173	/nfs/dbraw/zinc/97/41/73/517974173.db2.gz	LJEUNRIWMHWMQA-INIZCTEOSA-N	-1	0	357.406	2.811	50	0		FFAARM
C[C@H](Cc1cncc2ccccc21)C(=O)NCCc1nc(C(=O)[O-])cs1	ZINC000585139516	518545474	/nfs/dbraw/zinc/54/54/74/518545474.db2.gz	KHCNTNLIAWSESB-GFCCVEGCSA-N	-1	0	369.446	2.927	50	0		FFAARM
O=C([O-])[C@@H](CNC(=O)[C@H]1CC=CCC1)Oc1ccc(Br)cc1	ZINC000573252678	518576669	/nfs/dbraw/zinc/57/66/69/518576669.db2.gz	DKMOPKPPNQYRMS-SMDDNHRTSA-N	-1	0	368.227	2.754	50	0		FFAARM
O=C([O-])C1(C(=O)NCc2ccc(Br)cc2C(F)(F)F)CC1	ZINC000569562384	519611392	/nfs/dbraw/zinc/61/13/92/519611392.db2.gz	FYFGSRPXGLDNOG-UHFFFAOYSA-N	-1	0	366.133	2.949	50	0		FFAARM
COc1ccc(-c2oc3cc(C)n(C)c(=O)c3c2CC(=O)[O-])cc1OC	ZINC000604404315	520553200	/nfs/dbraw/zinc/55/32/00/520553200.db2.gz	FBBCXVHHSPWADM-UHFFFAOYSA-N	-1	0	357.362	2.751	50	0	biogenic	FFAARM
O=C([O-])[C@@H]1CN(C(=O)/C(=C/c2ccc(F)cc2)c2cccs2)CCO1	ZINC000328595279	534524794	/nfs/dbraw/zinc/52/47/94/534524794.db2.gz	PZWFEKKJSPBYNS-IPJDOKCGSA-N	-1	0	361.394	2.740	50	0		FFAARM
COc1cc(/C=C\C(=O)N2CCC[C@@H](C(=O)[O-])C2)cc(Cl)c1OC	ZINC000606441134	521069425	/nfs/dbraw/zinc/06/94/25/521069425.db2.gz	UKFZZSKNQUWDRW-FOQNGQEVSA-N	-1	0	353.802	2.694	50	0		FFAARM
C[C@@H](Cc1ccc(NC(=O)c2ccn(C3CCOCC3)n2)cc1)C(=O)[O-]	ZINC000630163071	522665709	/nfs/dbraw/zinc/66/57/09/522665709.db2.gz	SIKTUSUCDMYSHY-ZDUSSCGKSA-N	-1	0	357.410	2.750	50	0		FFAARM
C[C@H](Cc1ccc(NC(=O)c2ccn(C3CCOCC3)n2)cc1)C(=O)[O-]	ZINC000630163070	522666263	/nfs/dbraw/zinc/66/62/63/522666263.db2.gz	SIKTUSUCDMYSHY-CYBMUJFWSA-N	-1	0	357.410	2.750	50	0		FFAARM
COCCC[C@@]1(C(=O)[O-])CCCN(C(=O)c2ccc(-c3cc[nH]n3)cc2)C1	ZINC000091664716	523469130	/nfs/dbraw/zinc/46/91/30/523469130.db2.gz	RQCGXJLULRPNQA-FQEVSTJZSA-N	-1	0	371.437	2.810	50	0		FFAARM
O=C([O-])[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc(Br)cn1	ZINC000217413262	526289967	/nfs/dbraw/zinc/28/99/67/526289967.db2.gz	TXNDPVMTFHCJFB-XDTLVQLUSA-N	-1	0	353.216	2.702	50	0		FFAARM
CC(C)(C)c1ccn(C2(C(=O)[O-])CCN(c3ncnc4[nH]ccc43)CC2)n1	ZINC000072427083	535132180	/nfs/dbraw/zinc/13/21/80/535132180.db2.gz	XCHRPEXAOBWCJB-UHFFFAOYSA-N	-1	0	368.441	2.532	50	0		FFAARM
CCOc1ccc(C(=O)N2C[C@H](C(=O)[O-])Oc3ccccc32)cc1OC	ZINC000013434068	535703656	/nfs/dbraw/zinc/70/36/56/535703656.db2.gz	RRNKOTWKSHJTFT-QGZVFWFLSA-N	-1	0	357.362	2.586	50	0		FFAARM
C[C@@H](NC(=O)CSc1nc(=O)cc([O-])n1C1CCCC1)c1ccco1	ZINC000102288772	570830347	/nfs/dbraw/zinc/83/03/47/570830347.db2.gz	WLRPVJWSCJXXLC-LLVKDONJSA-N	-1	0	363.439	2.627	50	0		FFAARM
O=C([O-])[C@@H]1COCCN(C(=O)OCC2c3ccccc3-c3ccccc32)C1	ZINC000307122451	571114607	/nfs/dbraw/zinc/11/46/07/571114607.db2.gz	LTFXJQSQUFXUSI-AWEZNQCLSA-N	-1	0	367.401	2.969	50	0		FFAARM
O=C(CC1CCCCC1)NCCNC(=O)c1ccc2[n-]c(=S)oc2c1	ZINC000118783578	571177044	/nfs/dbraw/zinc/17/70/44/571177044.db2.gz	IHYSLJPIELMQGD-UHFFFAOYSA-N	-1	0	361.467	2.933	50	0		FFAARM
O=C([O-])c1cccnc1N1CCO[C@H](c2cccc(OC(F)F)c2)C1	ZINC000647451745	730743530	/nfs/dbraw/zinc/74/35/30/730743530.db2.gz	GGQMUVDWNBAMEJ-AWEZNQCLSA-N	-1	0	350.321	2.959	50	0		FFAARM
C[C@@H]1OCCC[C@@H]1C(=O)N[C@@H](C(=O)[O-])c1ccccc1Br	ZINC000668295083	733103833	/nfs/dbraw/zinc/10/38/33/733103833.db2.gz	IZLRQVOKBAXQRC-OUJBWJOFSA-N	-1	0	356.216	2.506	50	0		FFAARM
Cc1c(C(=O)[O-])cnn1-c1ccc(C(=O)N2C[C@@H](C)OC(C)(C)C2)cc1	ZINC000137136926	971525895	/nfs/dbraw/zinc/52/58/95/971525895.db2.gz	KHSCQIPQHIABOJ-GFCCVEGCSA-N	-1	0	357.410	2.518	50	0		FFAARM
O=C([O-])c1ccccc1C(=O)N1CCN(C/C=C/c2ccccc2)CC1	ZINC000004990749	975541488	/nfs/dbraw/zinc/54/14/88/975541488.db2.gz	URLQRALSKKXTKO-RMKNXTFCSA-N	-1	0	350.418	2.856	50	0		FFAARM
C[C@@H](C(=O)[O-])c1cccc(NC(=O)[C@@H]2CCCN(C(=O)N3CCCC3)C2)c1	ZINC000263178029	980536011	/nfs/dbraw/zinc/53/60/11/980536011.db2.gz	GYHNTFUXXOKUTB-GDBMZVCRSA-N	-1	0	373.453	2.741	50	0		FFAARM
CO[C@@H]1C[C@H](CC(=O)[O-])N(C(=O)[C@@H]2C[C@@H]2c2cccc(C(F)(F)F)c2)C1	ZINC000263205105	980557685	/nfs/dbraw/zinc/55/76/85/980557685.db2.gz	ZAWKBQIDLVBQEO-KBUPBQIOSA-N	-1	0	371.355	2.900	50	0		FFAARM
O=C([O-])COc1ccccc1/C=C1/NC(=S)N(c2ccccc2F)C1=O	ZINC000104991233	1010194227	/nfs/dbraw/zinc/19/42/27/1010194227.db2.gz	CSHGROKWRZDSTL-UKTHLTGXSA-N	-1	0	372.377	2.551	50	0		FFAARM
CC[C@@]1(C(=O)[O-])CCCN(C(=O)CCCc2nc(-c3cccnc3)no2)C1	ZINC000091782325	1027047015	/nfs/dbraw/zinc/04/70/15/1027047015.db2.gz	SJRVVZIJAUULQX-LJQANCHMSA-N	-1	0	372.425	2.558	50	0		FFAARM
COc1ccc([C@H](C(=O)[O-])N(C)Cc2noc(C3CCC3)n2)cc1OC	ZINC001506403986	1059496759	/nfs/dbraw/zinc/49/67/59/1059496759.db2.gz	DJDPDOBBBQNFBA-MRXNPFEDSA-N	-1	0	361.398	2.612	50	0		FFAARM
O=C([O-])CN(c1ccccc1)S(=O)(=O)c1ccc(Br)cc1	ZINC000001194548	219387077	/nfs/dbraw/zinc/38/70/77/219387077.db2.gz	BMUZQUMOUUNMSO-UHFFFAOYSA-N	-1	0	370.224	2.729	50	0		FFAARM
O=C([O-])c1ccc(/C=C/C(=O)N2CCC(OC3CCOCC3)CC2)cc1	ZINC000328594978	223116459	/nfs/dbraw/zinc/11/64/59/223116459.db2.gz	HKZRPEQZAJHKFM-ZZXKWVIFSA-N	-1	0	359.422	2.585	50	0		FFAARM
CC(C)(C)OC(=O)N1C[C@@H](Oc2cc(F)c(F)cc2F)C[C@H]1C(=O)[O-]	ZINC000039954188	203779431	/nfs/dbraw/zinc/77/94/31/203779431.db2.gz	LLYNSCYHLPINDZ-UFBFGSQYSA-N	-1	0	361.316	2.945	50	0		FFAARM
CC(=O)OC[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)[O-]	ZINC000002555091	204043589	/nfs/dbraw/zinc/04/35/89/204043589.db2.gz	HSGIKRPBGCJRDB-GOSISDBHSA-N	-1	0	369.373	2.541	50	0		FFAARM
C[C@@H](O)[C@@H](C(=O)[O-])N(C)C(=O)OCC1c2ccccc2-c2ccccc21	ZINC000002389805	204036473	/nfs/dbraw/zinc/03/64/73/204036473.db2.gz	YBKRZKSVPNEMQK-XIKOKIGWSA-N	-1	0	355.390	2.701	50	0		FFAARM
Cc1ccc([C@@H]2NC(=O)N[C@@](O)(C(F)(F)F)C2=C([O-])c2cccs2)o1	ZINC000004101965	204120632	/nfs/dbraw/zinc/12/06/32/204120632.db2.gz	NICRJXXZPLAFMD-SUNKGSAMSA-N	-1	0	374.340	2.753	50	0		FFAARM
COc1cccc(N(CC(=O)[O-])S(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000004141502	204123457	/nfs/dbraw/zinc/12/34/57/204123457.db2.gz	GKHZNNJLUNMBPY-UHFFFAOYSA-N	-1	0	355.799	2.629	50	0		FFAARM
Cc1ccc(C)c(N2C[C@H](C(=O)Nc3cccc(C(=O)[O-])c3)CC2=O)c1	ZINC000004610543	204150276	/nfs/dbraw/zinc/15/02/76/204150276.db2.gz	XPAWFCLTBQNUFH-OAHLLOKOSA-N	-1	0	352.390	2.993	50	0		FFAARM
O=C([O-])c1ccc(NC(=O)CSc2nnc(-c3cccnc3)o2)cc1	ZINC000004753814	204161269	/nfs/dbraw/zinc/16/12/69/204161269.db2.gz	UEQHMTRYPNAKNU-UHFFFAOYSA-N	-1	0	356.363	2.561	50	0		FFAARM
COC(=O)c1ccccc1[N-]S(=O)(=O)c1cc(Cl)ccc1OC	ZINC000004809504	204164535	/nfs/dbraw/zinc/16/45/35/204164535.db2.gz	WZSBIBCQIXXOOC-UHFFFAOYSA-N	-1	0	355.799	2.936	50	0		FFAARM
O=C([O-])CSCC(=O)N1CCc2c3ccccc3[nH]c2[C@@H]1C(F)(F)F	ZINC000004389895	204136601	/nfs/dbraw/zinc/13/66/01/204136601.db2.gz	ZKIBSSZBNRZUDP-OAHLLOKOSA-N	-1	0	372.368	2.974	50	0		FFAARM
CCc1ccc(N(CC(=O)[O-])S(=O)(=O)c2cc(C)ccc2OC)cc1	ZINC000004869159	204171710	/nfs/dbraw/zinc/17/17/10/204171710.db2.gz	OAPUZMOPMDQRAV-UHFFFAOYSA-N	-1	0	363.435	2.846	50	0		FFAARM
COc1ccccc1[N-]S(=O)(=O)c1cc2c3c(c1)CCCN3C(=O)[C@H]2C	ZINC000005153979	204194379	/nfs/dbraw/zinc/19/43/79/204194379.db2.gz	PPNODIGRFZORJE-LBPRGKRZSA-N	-1	0	372.446	2.892	50	0		FFAARM
COc1ccccc1CN1C(=O)[C@]([O-])(C(F)(F)F)N=C1c1ccccc1	ZINC000005244346	204199526	/nfs/dbraw/zinc/19/95/26/204199526.db2.gz	CSAWEZXAQFISDP-KRWDZBQOSA-N	-1	0	364.323	2.735	50	0		FFAARM
CCOC(=O)c1ccc([N-]S(=O)(=O)c2cc(F)ccc2OC)cc1	ZINC000006480569	204249366	/nfs/dbraw/zinc/24/93/66/204249366.db2.gz	ALGIGSGCXYVZGX-UHFFFAOYSA-N	-1	0	353.371	2.812	50	0		FFAARM
O=C([O-])[C@@H]1C2CCC(CC2)[C@H]1C(=O)N1CCN(CCc2ccccc2)CC1	ZINC000006742628	204266055	/nfs/dbraw/zinc/26/60/55/204266055.db2.gz	XIVKBHMAJIFYJK-NTFDOXNWSA-N	-1	0	370.493	2.510	50	0		FFAARM
CCCCNS(=O)(=O)c1cccc([N-]S(=O)(=O)c2cccs2)c1	ZINC000007423512	204297958	/nfs/dbraw/zinc/29/79/58/204297958.db2.gz	BHULKLLFDBSUJF-UHFFFAOYSA-N	-1	0	374.509	2.627	50	0		FFAARM
Cc1nc2sccn2c(=O)c1S(=O)(=O)[N-]c1cccc(Cl)c1	ZINC000006859753	204277710	/nfs/dbraw/zinc/27/77/10/204277710.db2.gz	LHKUJEOZESPEHH-UHFFFAOYSA-N	-1	0	355.828	2.519	50	0		FFAARM
COc1ccc(C)cc1S(=O)(=O)[N-]c1ccc2c(c1)NC(=O)[C@H](C)O2	ZINC000007729418	204304594	/nfs/dbraw/zinc/30/45/94/204304594.db2.gz	CWFNTABHASKTEL-NSHDSACASA-N	-1	0	362.407	2.524	50	0		FFAARM
C[C@]1(c2ccco2)NC(=O)N([N-]C(=O)c2cc(Cl)sc2Cl)C1=O	ZINC000008748191	204344290	/nfs/dbraw/zinc/34/42/90/204344290.db2.gz	NHQFRSCSHUBYOY-CYBMUJFWSA-N	-1	0	374.205	2.760	50	0		FFAARM
CC(C)[C@H](NC(=O)Cn1ccc2ccc(Br)cc21)C(=O)[O-]	ZINC000036358538	205012619	/nfs/dbraw/zinc/01/26/19/205012619.db2.gz	SHNCFUHYWYLESY-AWEZNQCLSA-N	-1	0	353.216	2.629	50	0		FFAARM
CCS(=O)(=O)Nc1cnc(N(CC(C)C)CC(C)C)c(C(=O)[O-])c1	ZINC000035397512	204990171	/nfs/dbraw/zinc/99/01/71/204990171.db2.gz	XXKIQTIXXVTICU-UHFFFAOYSA-N	-1	0	357.476	2.660	50	0		FFAARM
CCc1nn2c(ncc3c2ccn(CCC(=O)[O-])c3=O)c1-c1ccccc1	ZINC000040387893	205068004	/nfs/dbraw/zinc/06/80/04/205068004.db2.gz	XOLWEYHXAXYZCY-UHFFFAOYSA-N	-1	0	362.389	2.748	50	0		FFAARM
COc1ccc(OC)c(S(=O)(=O)[N-]c2cccc(-n3cccn3)c2)c1	ZINC000045774275	205125320	/nfs/dbraw/zinc/12/53/20/205125320.db2.gz	GGQKTCAAJBGSSI-UHFFFAOYSA-N	-1	0	359.407	2.690	50	0		FFAARM
C[C@@H]1Sc2ccc(C(=O)N3[C@H](C(=O)[O-])C[C@@H]4CCCC[C@@H]43)cc2NC1=O	ZINC000299745777	205127898	/nfs/dbraw/zinc/12/78/98/205127898.db2.gz	SHLCCVGUYOEJAC-GVARAGBVSA-N	-1	0	374.462	2.977	50	0		FFAARM
O=C([O-])[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1cccc(CN2CCCC2=O)c1	ZINC000299751145	205133012	/nfs/dbraw/zinc/13/30/12/205133012.db2.gz	PRRZSSBNXHOCGO-JQHSSLGASA-N	-1	0	370.449	2.667	50	0		FFAARM
O=C([O-])COc1ccc(CCNC(=O)[C@H]2SCCc3ccccc32)cc1	ZINC000299750764	205133705	/nfs/dbraw/zinc/13/37/05/205133705.db2.gz	OHTMCOUFCPOKOQ-IBGZPJMESA-N	-1	0	371.458	2.839	50	0		FFAARM
COc1ccc(OC)c(NC(=O)c2c([O-])c3sccc3n(C)c2=O)c1	ZINC000049409448	205172072	/nfs/dbraw/zinc/17/20/72/205172072.db2.gz	NOFAUUXJISYOCP-UHFFFAOYSA-N	-1	0	360.391	2.575	50	0		FFAARM
Cc1ccc(C(=O)NC2CCN(C(=O)c3ccc([O-])c(Cl)c3)CC2)o1	ZINC000051463665	205184149	/nfs/dbraw/zinc/18/41/49/205184149.db2.gz	ANVHQPIMWLQRGC-UHFFFAOYSA-N	-1	0	362.813	2.982	50	0		FFAARM
Cc1nccn1CCCn1c2cc(C(=O)[O-])ccc2n(CC2CC2)c1=O	ZINC000055341237	205214996	/nfs/dbraw/zinc/21/49/96/205214996.db2.gz	WSWBUTMLCGDEIB-UHFFFAOYSA-N	-1	0	354.410	2.506	50	0		FFAARM
CCOc1ccc(S(=O)(=O)[N-]c2ccn(CCc3ccccn3)n2)cc1	ZINC000058297821	205270012	/nfs/dbraw/zinc/27/00/12/205270012.db2.gz	NSXYHYGRNACHTR-UHFFFAOYSA-N	-1	0	372.450	2.720	50	0		FFAARM
COc1ccc([C@@H]2CC(=O)Nc3c(C(=O)[O-])cn(-c4cc(C)on4)c32)cc1	ZINC000061718227	205286882	/nfs/dbraw/zinc/28/68/82/205286882.db2.gz	GTZZAWIWWWRSHK-ZDUSSCGKSA-N	-1	0	367.361	2.955	50	0		FFAARM
CS(=O)(=O)Cc1cccc(NC(=O)CC2(C(=O)[O-])CCCCCC2)c1	ZINC000058473426	205275575	/nfs/dbraw/zinc/27/55/75/205275575.db2.gz	ZEHMVIZXGNLJNW-UHFFFAOYSA-N	-1	0	367.467	2.985	50	0		FFAARM
O=C(Nc1ccccc1)c1c(=O)[nH]c2c(cnn2-c2ccc(F)cc2)c1[O-]	ZINC000065249928	205330282	/nfs/dbraw/zinc/33/02/82/205330282.db2.gz	KLHZGESJEJQCQO-UHFFFAOYSA-N	-1	0	364.336	2.811	50	0		FFAARM
O=c1ccc(-c2csc(S(=O)(=O)[N-]c3cc(F)ccc3F)c2)n[nH]1	ZINC000065119258	205318112	/nfs/dbraw/zinc/31/81/12/205318112.db2.gz	WTCZJIRECDSOPU-UHFFFAOYSA-N	-1	0	369.374	2.577	50	0		FFAARM
CCOc1ccc([N-]S(=O)(=O)c2c(CC)nc3sc(C)nn32)cc1	ZINC000065183883	205321666	/nfs/dbraw/zinc/32/16/66/205321666.db2.gz	MWRZOVRVXCREBG-UHFFFAOYSA-N	-1	0	366.468	2.861	50	0		FFAARM
CC[C@@H](C)C(=O)N1CCc2c(c(C(=O)[O-])nn2Cc2cccc(OC)c2)C1	ZINC000067692553	205383212	/nfs/dbraw/zinc/38/32/12/205383212.db2.gz	GPOFUFXBEFIXLT-CYBMUJFWSA-N	-1	0	371.437	2.569	50	0		FFAARM
CCn1ccc(-c2nnc(SCC(=O)[O-])n2-c2ccccc2Cl)n1	ZINC000067773430	205390391	/nfs/dbraw/zinc/39/03/91/205390391.db2.gz	HPGNMVJKHTUBHW-UHFFFAOYSA-N	-1	0	363.830	2.981	50	0		FFAARM
O=C([O-])c1cc(-c2ccsc2)cc(S(=O)(=O)N2CCSCC2)c1	ZINC000072166270	205494685	/nfs/dbraw/zinc/49/46/85/205494685.db2.gz	WNXNPRQGMKDDEO-UHFFFAOYSA-N	-1	0	369.489	2.851	50	0		FFAARM
CCn1cc(S(=O)(=O)N[C@@H]2CCC[C@H](C(F)(F)F)C2)cc1C(=O)[O-]	ZINC000236957127	206009850	/nfs/dbraw/zinc/00/98/50/206009850.db2.gz	MYPVEBJGBHGHMN-VHSXEESVSA-N	-1	0	368.377	2.606	50	0		FFAARM
CC[C@@H](C(=O)N1CCO[C@H](CC(=O)[O-])C1)c1cccc(C(F)(F)F)c1	ZINC000236954893	206009894	/nfs/dbraw/zinc/00/98/94/206009894.db2.gz	ARHMVXVMXOGXJD-ZIAGYGMSSA-N	-1	0	359.344	2.901	50	0		FFAARM
CCn1cc(S(=O)(=O)N[C@@H]2CCC[C@@H](C(F)(F)F)C2)cc1C(=O)[O-]	ZINC000236957051	206010344	/nfs/dbraw/zinc/01/03/44/206010344.db2.gz	MYPVEBJGBHGHMN-NXEZZACHSA-N	-1	0	368.377	2.606	50	0		FFAARM
CC(C)n1cc(Br)cc1C(=O)N[C@@]1(C(=O)[O-])CCSC1	ZINC000043511063	206052840	/nfs/dbraw/zinc/05/28/40/206052840.db2.gz	BFAYBRFQUFRWIY-ZDUSSCGKSA-N	-1	0	361.261	2.522	50	0		FFAARM
Cc1cc(C)n(Cc2cccc(C(=O)N(C[C@@H](C)C(=O)[O-])C3CC3)c2)n1	ZINC000237384070	206102286	/nfs/dbraw/zinc/10/22/86/206102286.db2.gz	UTKUZYXQXHNGJG-CYBMUJFWSA-N	-1	0	355.438	2.874	50	0		FFAARM
C[C@H](CC(=O)N1CCO[C@@H](CC(=O)[O-])C1)c1ccc(C(F)(F)F)cc1	ZINC000237538412	206106102	/nfs/dbraw/zinc/10/61/02/206106102.db2.gz	WGVZSJSKMQQKSZ-RISCZKNCSA-N	-1	0	359.344	2.901	50	0		FFAARM
C[C@]1(C(=O)[O-])CCN(C(=O)Cc2csc(Cc3ccc(F)cc3)n2)C1	ZINC000237644528	206106629	/nfs/dbraw/zinc/10/66/29/206106629.db2.gz	ZNLLCRZDUJTZRC-SFHVURJKSA-N	-1	0	362.426	2.739	50	0		FFAARM
Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)N2CCC[C@H](CCC(=O)[O-])C2)cc1	ZINC000237731641	206107110	/nfs/dbraw/zinc/10/71/10/206107110.db2.gz	IZDYYGJHULGZFJ-SJLPKXTDSA-N	-1	0	372.465	2.589	50	0		FFAARM
C[C@H](Oc1ccc(F)cc1Br)C(=O)N1CCC(C(=O)[O-])CC1	ZINC000237636691	206107630	/nfs/dbraw/zinc/10/76/30/206107630.db2.gz	PHGYMSAUMYCZHJ-VIFPVBQESA-N	-1	0	374.206	2.679	50	0		FFAARM
Cc1cc(C(=O)N2CCO[C@@H](CC(=O)[O-])C2)c(C)n1Cc1cccs1	ZINC000237700119	206107908	/nfs/dbraw/zinc/10/79/08/206107908.db2.gz	CWMLLNUNCWIPRI-AWEZNQCLSA-N	-1	0	362.451	2.530	50	0		FFAARM
Cc1c(C(=O)N2CCC[C@H]2C(=O)[O-])cnn1-c1cccc(C(F)(F)F)c1	ZINC000237755674	206108542	/nfs/dbraw/zinc/10/85/42/206108542.db2.gz	PXANDBHKTJCBCI-AWEZNQCLSA-N	-1	0	367.327	2.889	50	0		FFAARM
O=C([O-])[C@H]1CCCN1C(=O)c1csc(-c2cnn(-c3ccccc3)c2)n1	ZINC000238089614	206112964	/nfs/dbraw/zinc/11/29/64/206112964.db2.gz	RPKOLNLBHPVNBZ-OAHLLOKOSA-N	-1	0	368.418	2.685	50	0		FFAARM
O=C([O-])CCN(C[C@H]1CCCO1)C(=O)Cc1ccccc1C(F)(F)F	ZINC000238102642	206112434	/nfs/dbraw/zinc/11/24/34/206112434.db2.gz	RXZJDGIQJSDPHZ-CYBMUJFWSA-N	-1	0	359.344	2.730	50	0		FFAARM
O=C([O-])CN(C(=O)c1cc(N2CCCC2=O)cc(C(F)(F)F)c1)C1CC1	ZINC000238085829	206112701	/nfs/dbraw/zinc/11/27/01/206112701.db2.gz	VMCCHVWPXXSPPE-UHFFFAOYSA-N	-1	0	370.327	2.521	50	0		FFAARM
O=C([O-])[C@H](Cc1ccccc1)NC(=O)NCCc1c[nH]c2ccccc12	ZINC000002156096	206153017	/nfs/dbraw/zinc/15/30/17/206153017.db2.gz	WLVGAANSAFPEBB-SFHVURJKSA-N	-1	0	351.406	2.706	50	0	biogenic	FFAARM
COc1ccc(C)cc1S(=O)(=O)[N-]c1cc2c3c(c1)CCC(=O)N3CC2	ZINC000005153434	206190294	/nfs/dbraw/zinc/19/02/94/206190294.db2.gz	FWZUGVCSXGWUDU-UHFFFAOYSA-N	-1	0	372.446	2.640	50	0		FFAARM
CCO[C@@H]1C[C@@H](N(C)C(=O)c2ccc3c(c2)[n-]c(=S)[nH]c3=O)C12CCC2	ZINC000160541591	206228458	/nfs/dbraw/zinc/22/84/58/206228458.db2.gz	OROIFRRWOUFPOM-HUUCEWRRSA-N	-1	0	373.478	2.632	50	0		FFAARM
CCN1CCOc2ccc([N-]S(=O)(=O)c3ccc(C)s3)cc2C1=O	ZINC000008961619	206220217	/nfs/dbraw/zinc/22/02/17/206220217.db2.gz	KABPIHBWZSCRQQ-UHFFFAOYSA-N	-1	0	366.464	2.712	50	0		FFAARM
O=C([O-])c1cccc(NC(=S)NC(=O)COc2ccccc2Cl)c1	ZINC000004674793	206237984	/nfs/dbraw/zinc/23/79/84/206237984.db2.gz	GFFMDHDMMYMVHV-UHFFFAOYSA-N	-1	0	364.810	2.930	50	0		FFAARM
CCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](C(=O)[O-])[C@H](C)CC	ZINC000105397825	206240557	/nfs/dbraw/zinc/24/05/57/206240557.db2.gz	IYVYOUHROQHPGA-VNQPRFMTSA-N	-1	0	364.442	2.697	50	0		FFAARM
CCOC(=O)c1ccc(S(=O)(=O)Nc2cc(C(=O)[O-])ccc2C)cc1	ZINC000006328201	206241471	/nfs/dbraw/zinc/24/14/71/206241471.db2.gz	FZOJIBGDJDDAHR-UHFFFAOYSA-N	-1	0	363.391	2.671	50	0		FFAARM
COc1ccc(C(=O)[O-])cc1S(=O)(=O)N[C@H](C)c1ccc(F)cc1	ZINC000013069916	206299294	/nfs/dbraw/zinc/29/92/94/206299294.db2.gz	ZNXYLZHEXGNNFL-SNVBAGLBSA-N	-1	0	353.371	2.572	50	0		FFAARM
CC(=O)Nc1cc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2C)ccc1F	ZINC000023053508	206399587	/nfs/dbraw/zinc/39/95/87/206399587.db2.gz	UQRAGNCVRWIQRD-UHFFFAOYSA-N	-1	0	366.370	2.592	50	0		FFAARM
CCOc1ncccc1CNC(=O)c1ccc2c(c1)[n-]c(=S)[nH]c2=O	ZINC000040088311	220878525	/nfs/dbraw/zinc/87/85/25/220878525.db2.gz	WPXGUNUICKLJJO-UHFFFAOYSA-N	-1	0	356.407	2.722	50	0		FFAARM
COc1ccc2oc(C)c(C(=O)N(CCC(=O)[O-])C3CCOCC3)c2c1	ZINC000328594961	533354246	/nfs/dbraw/zinc/35/42/46/533354246.db2.gz	GXZIATBOWKPYCZ-UHFFFAOYSA-N	-1	0	361.394	2.846	50	0		FFAARM
O=C([O-])c1cc(NCc2ccc3c(c2)OCO3)ccc1N1CCOCC1	ZINC000002356730	132383380	/nfs/dbraw/zinc/38/33/80/132383380.db2.gz	CQFKRJZFDSRFJO-UHFFFAOYSA-N	-1	0	356.378	2.562	50	0		FFAARM
O=C([O-])C1(Oc2ccccc2F)CCN(c2ncnc3[nH]ccc32)CC1	ZINC000072454797	136148554	/nfs/dbraw/zinc/14/85/54/136148554.db2.gz	TXTIYWZHTJHHAB-UHFFFAOYSA-N	-1	0	356.357	2.600	50	0		FFAARM
Cc1cc(C)nc([N-]S(=O)(=O)c2ccc(NC(=O)c3ccco3)cc2)n1	ZINC000000634748	506224684	/nfs/dbraw/zinc/22/46/84/506224684.db2.gz	GWLPAWQBHJVCLE-UHFFFAOYSA-N	-1	0	372.406	2.740	50	0		FFAARM
CCOC(=O)c1c([O-])c2cc(Cl)cnc2n(Cc2ccccc2)c1=O	ZINC000000600817	506224991	/nfs/dbraw/zinc/22/49/91/506224991.db2.gz	JMLOKZZQNYIHNU-UHFFFAOYSA-N	-1	0	358.781	2.981	50	0		FFAARM
CCOC(=O)COc1cccc([N-]S(=O)(=O)c2ccccc2F)c1	ZINC000032095493	506228910	/nfs/dbraw/zinc/22/89/10/506228910.db2.gz	OVJNTXMOEZRIBX-UHFFFAOYSA-N	-1	0	353.371	2.568	50	0		FFAARM
COc1ccc(OC)c([C@@H]2N[C@H](C(=O)[O-])Cc3c4ccccc4[nH]c32)c1	ZINC000000754300	506229947	/nfs/dbraw/zinc/22/99/47/506229947.db2.gz	IQTPIYGSTAUKJL-LPHOPBHVSA-N	-1	0	352.390	2.873	50	0	biogenic	FFAARM
O=C(Nc1ccc(S(=O)(=O)[N-]c2ncccn2)cc1)c1ccccc1	ZINC000000800946	506233898	/nfs/dbraw/zinc/23/38/98/506233898.db2.gz	AAFWBBJBFBIFPB-UHFFFAOYSA-N	-1	0	354.391	2.530	50	0		FFAARM
CCOC(=O)[N-]S(=O)(=O)c1cnccc1Sc1cccc(C)c1	ZINC000000987826	506242589	/nfs/dbraw/zinc/24/25/89/506242589.db2.gz	FWBFWGSIPZDLNY-UHFFFAOYSA-N	-1	0	352.437	2.976	50	0		FFAARM
COc1cc(OC)cc(C(=O)NC(=S)Nc2ccc(C(=O)[O-])cc2)c1	ZINC000001159329	506252309	/nfs/dbraw/zinc/25/23/09/506252309.db2.gz	IEBPGEXXYSKKST-UHFFFAOYSA-N	-1	0	360.391	2.529	50	0		FFAARM
CCN1CCCn2cc(S(=O)(=O)[N-]c3cc(C)ccc3C)cc2C1=O	ZINC000065258751	506277494	/nfs/dbraw/zinc/27/74/94/506277494.db2.gz	QKPHJLRSCWNZKJ-UHFFFAOYSA-N	-1	0	361.467	2.772	50	0		FFAARM
CCCn1c(=O)c2ccc(C(=O)NCc3ccccn3)cc2[n-]c1=S	ZINC000003043461	506307763	/nfs/dbraw/zinc/30/77/63/506307763.db2.gz	RSNILSSVROQKTQ-UHFFFAOYSA-N	-1	0	354.435	2.794	50	0		FFAARM
O=C([O-])c1ccc(C(=O)c2ccc3c(c2)C(=O)N(c2ccncc2)C3=O)cc1	ZINC000003099975	506309999	/nfs/dbraw/zinc/30/99/99/506309999.db2.gz	PNTMAPSICIXAGQ-UHFFFAOYSA-N	-1	0	372.336	2.811	50	0		FFAARM
COc1cccc(-n2[nH][n-]c3c(=O)n(-c4ccc5c(c4)CCC5)c(=O)c2=3)c1	ZINC000033114692	506337369	/nfs/dbraw/zinc/33/73/69/506337369.db2.gz	LZCXMLMRZMLRSJ-MSOLQXFVSA-N	-1	0	362.389	2.682	50	0		FFAARM
O=C([O-])[C@@H]1CCCC[C@H]1C(=O)N1CCN(c2ccccc2Cl)CC1	ZINC000004749306	506393114	/nfs/dbraw/zinc/39/31/14/506393114.db2.gz	MKTQWEILLANZID-ZIAGYGMSSA-N	-1	0	350.846	2.880	50	0		FFAARM
CCCC[C@H](NC(=O)[C@H](C)Oc1ccc2c(C)cc(=O)oc2c1)C(=O)[O-]	ZINC000005235511	506430882	/nfs/dbraw/zinc/43/08/82/506430882.db2.gz	CKGWKEONMUYSQY-WFASDCNBSA-N	-1	0	361.394	2.628	50	0		FFAARM
Cc1c2c(nn1-c1ccccc1)c(N1CCC[C@H](C(=O)[O-])C1)nnc2C	ZINC000006751582	506503291	/nfs/dbraw/zinc/50/32/91/506503291.db2.gz	FSQMUSFZAPJBLX-AWEZNQCLSA-N	-1	0	351.410	2.733	50	0		FFAARM
O=C([O-])c1ccccc1C(=O)Nc1ccc(C(=O)NC[C@H]2CCCO2)cc1	ZINC000012138541	506822339	/nfs/dbraw/zinc/82/23/39/506822339.db2.gz	IBJHFVGJSRFKRE-OAHLLOKOSA-N	-1	0	368.389	2.546	50	0		FFAARM
Cc1csc(NC(=O)c2ccc3nc([N-]S(C)(=O)=O)sc3c2)n1	ZINC000012324100	506849735	/nfs/dbraw/zinc/84/97/35/506849735.db2.gz	DTZDWTKXWAKTKM-UHFFFAOYSA-N	-1	0	368.465	2.685	50	0		FFAARM
COC(=O)c1sc([N-]S(=O)(=O)c2ccc(C(C)=O)cc2)cc1C	ZINC000012525799	506872434	/nfs/dbraw/zinc/87/24/34/506872434.db2.gz	VUQYGWYHMWYPDV-UHFFFAOYSA-N	-1	0	353.421	2.847	50	0		FFAARM
O=C([O-])/C=C\C(=O)Nc1ccc(N2CCN(c3ccc(F)cc3)CC2)cc1	ZINC000013555420	506945544	/nfs/dbraw/zinc/94/55/44/506945544.db2.gz	IJZURFAHRIKADK-KTKRTIGZSA-N	-1	0	369.396	2.732	50	0		FFAARM
O=C([O-])[C@@H]1CC=CC[C@H]1C(=O)Nc1sc2c(c1C(=O)NC1CC1)CCC2	ZINC000017076637	507114434	/nfs/dbraw/zinc/11/44/34/507114434.db2.gz	ZAQVOIXDPXEAFA-VXGBXAGGSA-N	-1	0	374.462	2.735	50	0		FFAARM
C[C@@H](CC(=O)[O-])CC(=O)Nc1sc(Cc2ccccc2)cc1C(N)=O	ZINC000017074248	507115523	/nfs/dbraw/zinc/11/55/23/507115523.db2.gz	IILAHVKJDNHGII-LLVKDONJSA-N	-1	0	360.435	2.877	50	0		FFAARM
NC1=NC(=O)C(CCC[C@H](C(=O)[O-])c2ccc(Cl)c(Cl)c2)C(=O)N1	ZINC000019862505	507203060	/nfs/dbraw/zinc/20/30/60/507203060.db2.gz	TWEKHKOAMDTORE-QMMMGPOBSA-N	-1	0	372.208	2.968	50	0		FFAARM
CS(=O)(=O)c1ccc(NC(=O)CC2(CC(=O)[O-])CCCCC2)cc1	ZINC000024151112	507394320	/nfs/dbraw/zinc/39/43/20/507394320.db2.gz	QPTRGLAGUJXEFU-UHFFFAOYSA-N	-1	0	353.440	2.844	50	0		FFAARM
COc1cc(OC)c(S(=O)(=O)[N-]c2cccnc2)cc1Br	ZINC000024986840	507456411	/nfs/dbraw/zinc/45/64/11/507456411.db2.gz	SDHUGZDBPTVPJQ-UHFFFAOYSA-N	-1	0	373.228	2.662	50	0		FFAARM
COc1cc(C)c(S(=O)(=O)Nc2cccc(F)c2C(=O)[O-])cc1OC	ZINC000060707150	507574935	/nfs/dbraw/zinc/57/49/35/507574935.db2.gz	ILFKSJHOFWXVPY-UHFFFAOYSA-N	-1	0	369.370	2.650	50	0		FFAARM
CNC(=O)c1ccc(C)c(NC(=O)C[C@](C)(C(=O)[O-])c2ccccc2)c1	ZINC000027056660	507628678	/nfs/dbraw/zinc/62/86/78/507628678.db2.gz	CGZNVYGCROAGHC-FQEVSTJZSA-N	-1	0	354.406	2.726	50	0		FFAARM
CC1(C)[C@@H](C(=O)[O-])[C@@H]1C(=O)Nc1ccc(C(=O)NC2CC2)c(Cl)c1	ZINC000071284839	507700527	/nfs/dbraw/zinc/70/05/27/507700527.db2.gz	YHKFJQXZXOEINQ-CHWSQXEVSA-N	-1	0	350.802	2.528	50	0		FFAARM
Cc1ccc(F)c(OC2(C(=O)[O-])CCN(C(=O)[C@H]3CC3(F)F)CC2)c1	ZINC000072428347	507789312	/nfs/dbraw/zinc/78/93/12/507789312.db2.gz	TUFHJDPQODKLIT-LLVKDONJSA-N	-1	0	357.328	2.614	50	0		FFAARM
O=C([O-])CCc1cc2n(n1)CCCN(Cc1ccccc1OC(F)F)C2	ZINC000072429525	507789663	/nfs/dbraw/zinc/78/96/63/507789663.db2.gz	DQULSXQRMJGZCT-UHFFFAOYSA-N	-1	0	365.380	2.908	50	0		FFAARM
COc1cccc(OC[C@H]2CCCN(C(=O)CCc3cc(=O)[n-]o3)C2)c1	ZINC000072435967	507791211	/nfs/dbraw/zinc/79/12/11/507791211.db2.gz	ONOSKTZYHPAXJB-AWEZNQCLSA-N	-1	0	360.410	2.639	50	0		FFAARM
Cc1nn(C(C)C)c(C)c1S(=O)(=O)Nc1cc(C(=O)[O-])ccc1F	ZINC000075613103	508121400	/nfs/dbraw/zinc/12/14/00/508121400.db2.gz	OXSNACNAKRKGIJ-UHFFFAOYSA-N	-1	0	355.391	2.719	50	0		FFAARM
CC1CCN(S(=O)(=O)N2CCC[C@@H](c3cccc(C(=O)[O-])c3)C2)CC1	ZINC000095387457	508182895	/nfs/dbraw/zinc/18/28/95/508182895.db2.gz	VYNRAAONSRDCOA-QGZVFWFLSA-N	-1	0	366.483	2.541	50	0		FFAARM
Cc1sc2[nH]c(CCC(=O)Nc3cccc(C(=O)[O-])c3)nc(=O)c2c1C	ZINC000095424982	508185121	/nfs/dbraw/zinc/18/51/21/508185121.db2.gz	GHDSSSQXXFBKOV-UHFFFAOYSA-N	-1	0	371.418	2.871	50	0		FFAARM
O=C([O-])c1sc2ccccc2c1CNC(=O)C1(O)Cc2ccccc2C1	ZINC000095989514	508200462	/nfs/dbraw/zinc/20/04/62/508200462.db2.gz	DSEZJIOIIGICHW-UHFFFAOYSA-N	-1	0	367.426	2.746	50	0		FFAARM
CC(=O)N1CCc2cc(C(=O)Nc3ccc(/C=C\C(=O)[O-])cc3)ccc21	ZINC000096936626	508215703	/nfs/dbraw/zinc/21/57/03/508215703.db2.gz	MNTFUVZWCZSMFT-WTKPLQERSA-N	-1	0	350.374	2.946	50	0		FFAARM
O=S(=O)([N-]c1cccn2nc(C3CC3)nc12)c1cc(F)ccc1F	ZINC000097078241	508218801	/nfs/dbraw/zinc/21/88/01/508218801.db2.gz	CBROOYKMWZHZMW-UHFFFAOYSA-N	-1	0	350.350	2.686	50	0		FFAARM
C[C@@H]1c2cc(F)ccc2CCN1C(=O)c1ccc(N2CC(=O)N=C2[O-])cc1	ZINC000097578407	508226778	/nfs/dbraw/zinc/22/67/78/508226778.db2.gz	OQCJPQBWPGYZBD-GFCCVEGCSA-N	-1	0	367.380	2.641	50	0		FFAARM
Cc1cccc(Cn2[nH][n-]c3c(=O)n(-c4ccc(F)c(F)c4)c(=O)c2=3)c1	ZINC000101168173	508240879	/nfs/dbraw/zinc/24/08/79/508240879.db2.gz	FOPMKNFNBXRFIQ-HZPDHXFCSA-N	-1	0	356.332	2.767	50	0		FFAARM
C[C@@H](NC(=O)c1ccc2c(c1)[n-]c(=S)n(C)c2=O)c1cccc(F)c1	ZINC000102173301	508268943	/nfs/dbraw/zinc/26/89/43/508268943.db2.gz	KUVWCLVYVZDEBG-SNVBAGLBSA-N	-1	0	357.410	2.852	50	0		FFAARM
CC[C@H](C)N(Cc1ccccc1)C(=O)c1cc(C)c2c(=O)[n-]c(=O)nc-2[nH]1	ZINC000151544751	509040723	/nfs/dbraw/zinc/04/07/23/509040723.db2.gz	QDDYFTRDGXDUMN-ZDUSSCGKSA-N	-1	0	366.421	2.773	50	0		FFAARM
COCn1nc(C)c(S(=O)(=O)[N-]c2cccc(-c3cnco3)c2)c1C	ZINC000225611277	509380569	/nfs/dbraw/zinc/38/05/69/509380569.db2.gz	RMPNCCPXADEYOY-UHFFFAOYSA-N	-1	0	362.411	2.560	50	0		FFAARM
CC(C)c1ccc(-c2noc(CCC(=O)N3CCC[C@@H]3C(=O)[O-])n2)cc1	ZINC000236853389	509518471	/nfs/dbraw/zinc/51/84/71/509518471.db2.gz	PGSTUQIYIKEMBX-OAHLLOKOSA-N	-1	0	357.410	2.868	50	0		FFAARM
O=C([O-])[C@H](NC(=O)Cc1cc(-c2ccccc2)on1)c1ccccc1F	ZINC000170066749	509667216	/nfs/dbraw/zinc/66/72/16/509667216.db2.gz	CSNAKQHSLYYEGS-GOSISDBHSA-N	-1	0	354.337	2.965	50	0		FFAARM
O=C([O-])CCN(C(=O)/C=C/c1cccc2cccnc12)C1CCOCC1	ZINC000238072320	509814037	/nfs/dbraw/zinc/81/40/37/509814037.db2.gz	HKENCRHAOKXVQS-VOTSOKGWSA-N	-1	0	354.406	2.730	50	0		FFAARM
CCOCCOc1ccccc1C(=O)N1Cc2ccccc2C[C@H]1C(=O)[O-]	ZINC000244858572	509874311	/nfs/dbraw/zinc/87/43/11/509874311.db2.gz	VNPNQTVODDVQTP-SFHVURJKSA-N	-1	0	369.417	2.754	50	0		FFAARM
COc1cccc(NC(=O)C(C#N)=NNc2cc(C(=O)[O-])ccc2C)c1	ZINC000254612865	509909246	/nfs/dbraw/zinc/90/92/46/509909246.db2.gz	NXUUBGCVEKTPFV-UHFFFAOYSA-N	-1	0	352.350	2.632	50	0		FFAARM
O=C([O-])C1CCC(NC(=O)Cc2ccc(F)c(Br)c2)CC1	ZINC000261964734	510131024	/nfs/dbraw/zinc/13/10/24/510131024.db2.gz	AXLNFSQBVSHWIW-UHFFFAOYSA-N	-1	0	358.207	2.890	50	0		FFAARM
Cc1ccc(C(C)C)c(OCC(=O)N(CCC(=O)[O-])C2CCOCC2)c1	ZINC000408513283	513083438	/nfs/dbraw/zinc/08/34/38/513083438.db2.gz	LMLUOQKSZAPUQR-UHFFFAOYSA-N	-1	0	363.454	2.980	50	0		FFAARM
C[C@H](C(=O)[O-])N(C)C(=O)[C@@H](c1cccc(Br)c1)N1CCCC1	ZINC000408513537	513083710	/nfs/dbraw/zinc/08/37/10/513083710.db2.gz	VCRSHTUKJFJQGO-BXUZGUMPSA-N	-1	0	369.259	2.518	50	0		FFAARM
Cc1ccc2nc(-c3cccnc3)cc(C(=O)N(C)Cc3n[nH]c(=O)[n-]3)c2c1	ZINC000426358943	513913570	/nfs/dbraw/zinc/91/35/70/513913570.db2.gz	GNAKZJLKCQSOHT-UHFFFAOYSA-N	-1	0	374.404	2.701	50	0		FFAARM
CC(C)[C@H](CC(=O)[O-])NC(=O)N1CCN(C/C=C/c2ccccc2)CC1	ZINC000426535419	513972294	/nfs/dbraw/zinc/97/22/94/513972294.db2.gz	HPCKBIMOTDFYIN-YOCVDRLZSA-N	-1	0	359.470	2.526	50	0		FFAARM
COc1cc(C(=O)[O-])cc(C(=O)N2CCC(Cc3cccnc3)CC2)c1	ZINC000426555516	513979915	/nfs/dbraw/zinc/97/99/15/513979915.db2.gz	LUDVSAUZMKMSIV-UHFFFAOYSA-N	-1	0	354.406	2.883	50	0		FFAARM
CC(=O)c1cn(CC(=O)NC[C@H]2CC[C@H](C(=O)[O-])CC2)c2ccccc12	ZINC000238882069	518480333	/nfs/dbraw/zinc/48/03/33/518480333.db2.gz	CHIPAZMYAJZORL-SHTZXODSSA-N	-1	0	356.422	2.851	50	0		FFAARM
CCc1sc2ncn(CCCc3nnn[n-]3)c(=O)c2c1-c1ccccc1	ZINC000584904210	518532204	/nfs/dbraw/zinc/53/22/04/518532204.db2.gz	XHWFTGWXHPPCPW-UHFFFAOYSA-N	-1	0	366.450	2.833	50	0		FFAARM
CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)N[C@@H](C(=O)[O-])c1ccccc1	ZINC000236830058	519483474	/nfs/dbraw/zinc/48/34/74/519483474.db2.gz	UYKLCDQLPOXTSE-UYAOXDASSA-N	-1	0	364.401	2.893	50	0		FFAARM
CSCC[C@@H](NC(=O)Cc1csc(-c2ccccc2)n1)C(=O)[O-]	ZINC000080350702	525548382	/nfs/dbraw/zinc/54/83/82/525548382.db2.gz	ILKLLRNHSPUTKF-CYBMUJFWSA-N	-1	0	350.465	2.675	50	0		FFAARM
CCCCc1ccc(NC(=O)N2CCc3c(nc4cc[n-]n4c3=O)C2)cc1	ZINC000102990174	570841790	/nfs/dbraw/zinc/84/17/90/570841790.db2.gz	DDAYBFOKHBGYPM-UHFFFAOYSA-N	-1	0	365.437	2.955	50	0		FFAARM
Cc1nn(C(C)C)c(C)c1S(=O)(=O)[N-]c1cc(C(F)(F)F)[nH]n1	ZINC000084008507	571066383	/nfs/dbraw/zinc/06/63/83/571066383.db2.gz	XLKPMVBWNVDESG-UHFFFAOYSA-N	-1	0	351.354	2.624	50	0		FFAARM
Cc1nn(C)c(Cl)c1S(=O)(=O)[N-]c1nc2c(s1)c(C)ccc2C	ZINC000066249850	571134831	/nfs/dbraw/zinc/13/48/31/571134831.db2.gz	IGSOLZPISCKLKZ-UHFFFAOYSA-N	-1	0	370.887	3.409	50	0		FFAARM
N#C/C(=C/c1ccccc1OCC(=O)[O-])C(=O)Nc1ccc(F)cc1F	ZINC000071795539	571203386	/nfs/dbraw/zinc/20/33/86/571203386.db2.gz	LPXDYXITLXTBBK-GHXNOFRVSA-N	-1	0	358.300	2.974	50	0		FFAARM
COc1cc(F)ccc1O[C@H]1C[C@@H](C(=O)[O-])N(C(=O)OC(C)(C)C)C1	ZINC000203304249	571309533	/nfs/dbraw/zinc/30/95/33/571309533.db2.gz	AGGBIOVVEAWGCM-RYUDHWBXSA-N	-1	0	355.362	2.676	50	0		FFAARM
CC[C@H](C)C1C(=O)N=C(SCC(=O)Nc2ccc(OC)cc2)N=C1[O-]	ZINC000016662325	727826596	/nfs/dbraw/zinc/82/65/96/727826596.db2.gz	MFKZMGCCXBXAMI-JTQLQIEISA-N	-1	0	363.439	2.728	50	0		FFAARM
COc1ccc(NC(=O)/C(C#N)=C\c2ccccc2OCC(=O)[O-])cc1	ZINC000096669527	1012259308	/nfs/dbraw/zinc/25/93/08/1012259308.db2.gz	UUBJFBYIJHFBRA-UVTDQMKNSA-N	-1	0	352.346	2.704	50	0		FFAARM
COc1ccc(C)cc1[C@H](C(=O)[O-])N1CC[NH+](CCc2ccccc2)CC1	ZINC001506397873	1059490051	/nfs/dbraw/zinc/49/00/51/1059490051.db2.gz	FILXYWKMSIYVDG-OAQYLSRUSA-N	-1	0	368.477	2.990	50	0		FFAARM
Cc1ccc(-c2ccc(C(=O)[O-])c(N(C)CCN3CCOCC3)n2)s1	ZINC001529168221	1062199840	/nfs/dbraw/zinc/19/98/40/1062199840.db2.gz	ZTUCBRMBNDHURQ-UHFFFAOYSA-N	-1	0	361.467	2.585	50	0		FFAARM
COCc1nc2cc(NC(=O)Cc3ccccc3)cc(C(=O)[O-])c2n1C	ZINC000299799029	223102722	/nfs/dbraw/zinc/10/27/22/223102722.db2.gz	WYCPIPCBSBEGPS-UHFFFAOYSA-N	-1	0	353.378	2.599	50	0		FFAARM
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)[O-])CC2)c2ccccc12	ZINC000011566057	219920812	/nfs/dbraw/zinc/92/08/12/219920812.db2.gz	GZPYTHXUEWSHEH-UHFFFAOYSA-N	-1	0	363.435	2.724	50	0		FFAARM
O=C([O-])[C@@H](Cc1ccc(Cl)cc1)NS(=O)(=O)c1ccccc1Cl	ZINC000004040248	204117805	/nfs/dbraw/zinc/11/78/05/204117805.db2.gz	KKPGVOCNDFEBEZ-CYBMUJFWSA-N	-1	0	374.245	2.968	50	0		FFAARM
Cc1ccc(S(=O)(=O)N[C@H](Cc2ccc(Cl)cc2)C(=O)[O-])cc1	ZINC000004040318	204118032	/nfs/dbraw/zinc/11/80/32/204118032.db2.gz	JZOICEPXBNEDMH-OAHLLOKOSA-N	-1	0	353.827	2.623	50	0		FFAARM
CCOc1ccc(N(CC(=O)[O-])S(=O)(=O)c2ccc(F)cc2)cc1	ZINC000004258637	204130213	/nfs/dbraw/zinc/13/02/13/204130213.db2.gz	ZNPUJTXPEZRZAK-UHFFFAOYSA-N	-1	0	353.371	2.504	50	0		FFAARM
O=C([O-])C1[C@H](c2ccccc2)C(C(=O)OCCCO)[C@H]1c1ccccc1	ZINC000004410293	204138267	/nfs/dbraw/zinc/13/82/67/204138267.db2.gz	PCFRNRNCXSRKCS-YXWAVELNSA-N	-1	0	354.402	2.810	50	0		FFAARM
COc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccc(Cl)cc4)c=3c2=O)cc1	ZINC000004483531	204141187	/nfs/dbraw/zinc/14/11/87/204141187.db2.gz	IQHMSWNFNCCDSA-JKSUJKDBSA-N	-1	0	370.796	2.842	50	0		FFAARM
COc1ccccc1-n1nnc(C(=O)Nc2ccc(C(=O)[O-])cc2)c1C	ZINC000004511626	204143316	/nfs/dbraw/zinc/14/33/16/204143316.db2.gz	ARAVZRSGMBUQSL-UHFFFAOYSA-N	-1	0	352.350	2.535	50	0		FFAARM
COc1cc([C@@H]2[C@@H](C(=O)[O-])c3ccccc3C(=O)N2C)cc(OC)c1OC	ZINC000004563630	204147209	/nfs/dbraw/zinc/14/72/09/204147209.db2.gz	HZWXNYYVVCDQFJ-DLBZAZTESA-N	-1	0	371.389	2.708	50	0		FFAARM
CCOc1ccccc1NC(=O)[C@@H](Cc1cccc(C)c1)c1nnn[n-]1	ZINC000005444734	204209074	/nfs/dbraw/zinc/20/90/74/204209074.db2.gz	KCENNNQMIHADTE-HNNXBMFYSA-N	-1	0	351.410	2.872	50	0		FFAARM
COCCCNC(=O)c1ccccc1[N-]S(=O)(=O)c1ccc(C)cc1	ZINC000005684166	204221166	/nfs/dbraw/zinc/22/11/66/204221166.db2.gz	AMVNHHYEXVDHDN-UHFFFAOYSA-N	-1	0	362.451	2.562	50	0		FFAARM
O=C([O-])c1cc(N2C(=S)N=NC2c2ccc(O)cc2O)ccc1Cl	ZINC000006659228	204259486	/nfs/dbraw/zinc/25/94/86/204259486.db2.gz	XBLDYWOQRSMHEI-UHFFFAOYSA-N	-1	0	363.782	2.986	50	0		FFAARM
Cc1cccc([N-]S(=O)(=O)c2nnc(NC(=O)CC(C)C)s2)c1	ZINC000006778446	204269663	/nfs/dbraw/zinc/26/96/63/204269663.db2.gz	UXMDATRDPLDEQV-UHFFFAOYSA-N	-1	0	354.457	2.632	50	0		FFAARM
COc1ccc(Cl)cc1N1C(=O)C[C@@H](Nc2ccc(C(=O)[O-])cc2)C1=O	ZINC000006820073	204274644	/nfs/dbraw/zinc/27/46/44/204274644.db2.gz	CSRBRWCFIGJASX-CYBMUJFWSA-N	-1	0	374.780	2.791	50	0		FFAARM
O=C([O-])Cc1ccc(N[C@@H]2CC(=O)N(c3ccccc3Cl)C2=O)cc1	ZINC000006831292	204275245	/nfs/dbraw/zinc/27/52/45/204275245.db2.gz	CDWPREYWJLLLDA-CQSZACIVSA-N	-1	0	358.781	2.711	50	0		FFAARM
O=C([O-])[C@H]1CCCN(C(=O)Cn2ccc3c2cccc3Br)C1	ZINC000040282905	205065347	/nfs/dbraw/zinc/06/53/47/205065347.db2.gz	XJKDOSBLMYYJCT-NSHDSACASA-N	-1	0	365.227	2.727	50	0		FFAARM
Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)N1CC[C@H](C(=O)[O-])C1	ZINC000299741573	205123571	/nfs/dbraw/zinc/12/35/71/205123571.db2.gz	GMPCGFCIVYTUEA-AWEZNQCLSA-N	-1	0	361.829	2.748	50	0		FFAARM
C[C@]1(C(=O)[O-])CCN(C(=O)c2ccc(-n3ccc(C(F)(F)F)n3)cc2)C1	ZINC000299743406	205125116	/nfs/dbraw/zinc/12/51/16/205125116.db2.gz	KXGLSSBYBOTJJT-INIZCTEOSA-N	-1	0	367.327	2.828	50	0		FFAARM
Cc1oc(CNC(=O)c2ccccc2OC[C@H]2CCCO2)cc1C(=O)[O-]	ZINC000299747419	205125748	/nfs/dbraw/zinc/12/57/48/205125748.db2.gz	CYGLMFUZZPSQMN-CYBMUJFWSA-N	-1	0	359.378	2.774	50	0		FFAARM
Cc1nc(-c2ccc(C)cc2C)sc1C(=O)N1CCOC[C@H]1C(=O)[O-]	ZINC000299747293	205126230	/nfs/dbraw/zinc/12/62/30/205126230.db2.gz	CLTBMAZVNZEJST-AWEZNQCLSA-N	-1	0	360.435	2.661	50	0		FFAARM
Cc1oc(CNC(=O)C(C)(C)c2ccc3c(c2)OCCO3)cc1C(=O)[O-]	ZINC000299753564	205136575	/nfs/dbraw/zinc/13/65/75/205136575.db2.gz	YPYJUGVYSWYDFE-UHFFFAOYSA-N	-1	0	359.378	2.651	50	0		FFAARM
CN(C)c1ccc(NC(=O)CSc2nc(=O)c3sccc3[n-]2)cc1	ZINC000051317205	205182714	/nfs/dbraw/zinc/18/27/14/205182714.db2.gz	MJSBJAITMVMRFG-UHFFFAOYSA-N	-1	0	360.464	2.781	50	0		FFAARM
O=C([O-])[C@@H]1CC=CC[C@H]1C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1	ZINC000055150494	205208016	/nfs/dbraw/zinc/20/80/16/205208016.db2.gz	UNWMZUURJPDCDL-IAGOWNOFSA-N	-1	0	356.422	2.965	50	0		FFAARM
O=C(Nc1ccccn1)C1CCN(C(=O)c2ccc([O-])c(Cl)c2)CC1	ZINC000056990961	205234219	/nfs/dbraw/zinc/23/42/19/205234219.db2.gz	ISIYGEJYGFJTSD-UHFFFAOYSA-N	-1	0	359.813	2.932	50	0		FFAARM
Cc1ccnn1-c1cccc(NS(=O)(=O)c2ccc(C)c(C(=O)[O-])c2)c1	ZINC000058364454	205273066	/nfs/dbraw/zinc/27/30/66/205273066.db2.gz	GSCQLYDQZKGGGT-UHFFFAOYSA-N	-1	0	371.418	2.988	50	0		FFAARM
COc1ccc(S(=O)(=O)N2CCc3ccc(Cl)cc32)cc1C(=O)[O-]	ZINC000058495839	205276441	/nfs/dbraw/zinc/27/64/41/205276441.db2.gz	JPDRSHXPKCUECF-UHFFFAOYSA-N	-1	0	367.810	2.798	50	0		FFAARM
O=c1ccc(-c2csc(S(=O)(=O)[N-]c3ccc(F)cc3F)c2)n[nH]1	ZINC000065119290	205318364	/nfs/dbraw/zinc/31/83/64/205318364.db2.gz	KTDUBTIBPSXGBT-UHFFFAOYSA-N	-1	0	369.374	2.577	50	0		FFAARM
CCn1cc(-c2nnc(SCC(=O)[O-])n2-c2cccc(Cl)c2)cn1	ZINC000065372494	205341708	/nfs/dbraw/zinc/34/17/08/205341708.db2.gz	FLDSBQQNTZITDJ-UHFFFAOYSA-N	-1	0	363.830	2.981	50	0		FFAARM
Cn1nc(C(=O)[O-])c2c1CCN(C(=O)[C@H](c1ccccc1)C1CCCC1)C2	ZINC000067788784	205393068	/nfs/dbraw/zinc/39/30/68/205393068.db2.gz	CKXGOHUEGCBNQB-GOSISDBHSA-N	-1	0	367.449	2.977	50	0		FFAARM
CC1(C)[C@@H](C(=O)[O-])[C@@H]1C(=O)Nc1ccccc1C(=O)NCc1ccco1	ZINC000071286471	205425465	/nfs/dbraw/zinc/42/54/65/205425465.db2.gz	NOFWFTOHAHKXJQ-HUUCEWRRSA-N	-1	0	356.378	2.505	50	0		FFAARM
O=C([O-])C[C@@H]1COCCN1C(=O)c1ccc(Cn2ccc3ccccc32)o1	ZINC000072435012	205549081	/nfs/dbraw/zinc/54/90/81/205549081.db2.gz	RJTPKVXATVLPTO-OAHLLOKOSA-N	-1	0	368.389	2.598	50	0		FFAARM
Cn1c2ccccc2c([O-])c(C(=O)NC23CC4CC(CC(C4)C2)C3)c1=O	ZINC000100602526	205945800	/nfs/dbraw/zinc/94/58/00/205945800.db2.gz	QLDNBIVVQAXUGG-UHFFFAOYSA-N	-1	0	352.434	2.943	50	0		FFAARM
O=c1c2[n-][nH]n(Cc3cccc(Cl)c3)c=2c(=O)n1-c1ccc(F)cc1	ZINC000101167049	205953191	/nfs/dbraw/zinc/95/31/91/205953191.db2.gz	MRIWLHKSNCGDJN-LSDHHAIUSA-N	-1	0	358.760	2.973	50	0		FFAARM
CC[C@@H](Cc1cccc(Br)c1)C(=O)N1CC[C@@H](C(=O)[O-])C1	ZINC000237019390	206063381	/nfs/dbraw/zinc/06/33/81/206063381.db2.gz	KXXCGFYKZOAGDK-QWHCGFSZSA-N	-1	0	354.244	2.951	50	0		FFAARM
COc1ccc(S(=O)(=O)Nc2cccc(F)c2C(=O)[O-])cc1Cl	ZINC000047202417	206080015	/nfs/dbraw/zinc/08/00/15/206080015.db2.gz	SBNPTLQAZUUFLO-UHFFFAOYSA-N	-1	0	359.762	2.987	50	0		FFAARM
CC(=O)Nc1cccc(NS(=O)(=O)c2cc(C(=O)[O-])c(C)cc2C)c1	ZINC000045946408	206081030	/nfs/dbraw/zinc/08/10/30/206081030.db2.gz	OGPTVKFPHABSHO-UHFFFAOYSA-N	-1	0	362.407	2.761	50	0		FFAARM
Cc1csc(N2CCC(C(=O)NCc3ccc(C(=O)[O-])cc3)CC2)n1	ZINC000237643043	206106934	/nfs/dbraw/zinc/10/69/34/206106934.db2.gz	HTINVELMNYVQBG-UHFFFAOYSA-N	-1	0	359.451	2.683	50	0		FFAARM
C[C@]1(C(=O)[O-])CCN(C(=O)[C@@H]2C[C@@H]2c2cccc(Br)c2)C1	ZINC000237647245	206107397	/nfs/dbraw/zinc/10/73/97/206107397.db2.gz	QZYCNZYTEKGAQQ-IOASZLSFSA-N	-1	0	352.228	2.876	50	0		FFAARM
O=C([O-])[C@H]1Cc2ccccc2CN1C(=O)c1ccc(C(=O)c2cc[nH]c2)cc1	ZINC000238043150	206113289	/nfs/dbraw/zinc/11/32/89/206113289.db2.gz	MOBIBDNUXOMZHR-LJQANCHMSA-N	-1	0	374.396	2.897	50	0		FFAARM
O=C([O-])CCN(C[C@@H]1CCCO1)C(=O)c1cc(Br)ccc1F	ZINC000238091659	206113507	/nfs/dbraw/zinc/11/35/07/206113507.db2.gz	QSMOQQXCMDIKKT-NSHDSACASA-N	-1	0	374.206	2.684	50	0		FFAARM
Cc1nn(-c2ccc(F)cc2)c(C)c1CC(=O)N1CCCC[C@@H]1C(=O)[O-]	ZINC000136472767	206130897	/nfs/dbraw/zinc/13/08/97/206130897.db2.gz	FDARZMDJLKDOMU-QGZVFWFLSA-N	-1	0	359.401	2.636	50	0		FFAARM
O=C([O-])[C@H]1CC=CC[C@H]1C(=O)Nc1ccc(C(=O)N2CCCCC2)cc1	ZINC000000794633	206134560	/nfs/dbraw/zinc/13/45/60/206134560.db2.gz	XLQUTUSBPFBIPN-SJORKVTESA-N	-1	0	356.422	2.918	50	0		FFAARM
CC1(C)[C@H]2CC[C@]1(C)C(=O)N([N-]C(=O)c1cc(Cl)ccc1O)C2=O	ZINC000002054354	206152919	/nfs/dbraw/zinc/15/29/19/206152919.db2.gz	NRQAGOUXTIHAPO-APPDUMDISA-N	-1	0	350.802	2.502	50	0		FFAARM
CC(C)COc1ccc(C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)[O-])cc1	ZINC000002153585	206153115	/nfs/dbraw/zinc/15/31/15/206153115.db2.gz	JKNPRANEKMMEMO-SFHVURJKSA-N	-1	0	357.406	2.853	50	0	biogenic	FFAARM
CCOc1cc(/C=C2\SC(=O)N(CCCC(=O)[O-])C2=O)ccc1O	ZINC000002408500	206153529	/nfs/dbraw/zinc/15/35/29/206153529.db2.gz	OTHSLGXIRKHKKY-LCYFTJDESA-N	-1	0	351.380	2.692	50	0		FFAARM
CC1(C)CC[C@H](CC(=O)[N-]S(=O)(=O)c2cnccn2)c2ccccc21	ZINC000152508613	206190738	/nfs/dbraw/zinc/19/07/38/206190738.db2.gz	JAHYJQWVXFFAMS-CYBMUJFWSA-N	-1	0	359.451	2.527	50	0		FFAARM
O=C([O-])[C@H]1[C@H]2C=C[C@]3(CN(C(c4ccccc4)c4ccccc4)C(=O)[C@H]13)O2	ZINC000005219308	206191856	/nfs/dbraw/zinc/19/18/56/206191856.db2.gz	QDKJBAZDSXUQIO-BZDHPDOMSA-N	-1	0	361.397	2.643	50	0		FFAARM
CCCn1c2ccccc2c([O-])c(C(=O)N=c2[nH]c3ccccc3[nH]2)c1=O	ZINC000103354601	206234609	/nfs/dbraw/zinc/23/46/09/206234609.db2.gz	IGRIKIGENQXDBY-UHFFFAOYSA-N	-1	0	362.389	2.668	50	0		FFAARM
CCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](C(=O)[O-])[C@@H](C)CC	ZINC000004760627	206237625	/nfs/dbraw/zinc/23/76/25/206237625.db2.gz	IYVYOUHROQHPGA-CWRNSKLLSA-N	-1	0	364.442	2.697	50	0		FFAARM
CN(C)S(=O)(=O)c1ccc(SCc2ccccc2)c(C(=O)[O-])c1	ZINC000013190433	206301279	/nfs/dbraw/zinc/30/12/79/206301279.db2.gz	OFZWJOLUYXTWBB-UHFFFAOYSA-N	-1	0	351.449	2.927	50	0		FFAARM
CN(c1ccccc1)S(=O)(=O)c1ccc(Br)c(C(=O)[O-])c1	ZINC000013345375	206301438	/nfs/dbraw/zinc/30/14/38/206301438.db2.gz	UCSNMZHAIVBBJK-UHFFFAOYSA-N	-1	0	370.224	2.972	50	0		FFAARM
COc1ccc(CC(=O)NCc2n[n-]c(=S)n2-c2ccccc2)cc1	ZINC000013524391	206302804	/nfs/dbraw/zinc/30/28/04/206302804.db2.gz	HGMNZWWSGSPAMK-UHFFFAOYSA-N	-1	0	354.435	2.797	50	0		FFAARM
COC(=O)C[C@H](c1ccsc1)c1c(=O)nc2ccc(Cl)cn2c1[O-]	ZINC000205974907	206337946	/nfs/dbraw/zinc/33/79/46/206337946.db2.gz	YPQLDMLVLCRIRO-LLVKDONJSA-N	-1	0	364.810	2.810	50	0		FFAARM
Cc1ccc(Cc2ccccc2C(=O)N2CCOC[C@@H]2CC(=O)[O-])cc1	ZINC000219320681	206382933	/nfs/dbraw/zinc/38/29/33/206382933.db2.gz	VBLJAJHOMZYXJX-SFHVURJKSA-N	-1	0	353.418	2.902	50	0		FFAARM
C[C@@H]1CN([C@H](c2cccs2)c2sc3ncnn3c2[O-])C[C@@H](C)O1	ZINC000022610177	206388079	/nfs/dbraw/zinc/38/80/79/206388079.db2.gz	QTDKDDVKZDKMQU-CKYFFXLPSA-N	-1	0	350.469	2.757	50	0		FFAARM
Cc1cc(NS(=O)(=O)c2c[nH]c(C(=O)[O-])c2)ccc1Br	ZINC000021799387	206361450	/nfs/dbraw/zinc/36/14/50/206361450.db2.gz	DPDPJRWKHVKGNT-UHFFFAOYSA-N	-1	0	359.201	2.585	50	0		FFAARM
CCc1cc(N2CCc3nc(-c4ccc(C(=O)[O-])cc4)[nH]c3C2)nc(C)n1	ZINC000218783486	132273200	/nfs/dbraw/zinc/27/32/00/132273200.db2.gz	LJLHLSKYDRHSKP-UHFFFAOYSA-N	-1	0	363.421	2.998	50	0		FFAARM
CC1(C)[C@H](C(=O)[O-])[C@H]1C(=O)Nc1ccc2c(c1)N(C(=O)C1CC1)CCC2	ZINC000071285604	136138797	/nfs/dbraw/zinc/13/87/97/136138797.db2.gz	NHAQLKDPSRCBOA-HOTGVXAUSA-N	-1	0	356.422	2.671	50	0		FFAARM
CC(N[C@H](C)c1ccccc1)=C1C(=O)[N-]C(=O)N(Cc2ccccc2)C1=O	ZINC000101038008	222260253	/nfs/dbraw/zinc/26/02/53/222260253.db2.gz	CAUIGXDAFLGOLN-QFVIEVDGSA-N	-1	0	363.417	2.890	50	0		FFAARM
CCOC(=O)CCc1c(C(=O)OCc2ccccc2)[nH]c(C)c1C(=O)[O-]	ZINC000000639942	506226525	/nfs/dbraw/zinc/22/65/25/506226525.db2.gz	NXKCFOWQOKNEDU-UHFFFAOYSA-N	-1	0	359.378	2.874	50	0		FFAARM
CCOC(=O)c1ccccc1[N-]S(=O)(=O)c1ccc(OC)c(OC)c1	ZINC000000647776	506226632	/nfs/dbraw/zinc/22/66/32/506226632.db2.gz	FHAZSAVNVZDUAO-UHFFFAOYSA-N	-1	0	365.407	2.681	50	0		FFAARM
Cc1cccc(C(=O)Nc2ccc(S(=O)(=O)[N-]c3ncccn3)cc2)c1	ZINC000000800957	506233877	/nfs/dbraw/zinc/23/38/77/506233877.db2.gz	JMDUBVISIWRTHN-UHFFFAOYSA-N	-1	0	368.418	2.838	50	0		FFAARM
O=C([O-])c1cccnc1S[C@H]1CC(=O)N(c2ccccc2Cl)C1=O	ZINC000000864993	506236651	/nfs/dbraw/zinc/23/66/51/506236651.db2.gz	CUXULQVPZZCWTB-LBPRGKRZSA-N	-1	0	362.794	2.857	50	0		FFAARM
CC1=C(C)C[C@H](C(=O)N2CCN(Cc3ccccc3)CC2)[C@@H](C(=O)[O-])C1	ZINC000000894859	506239112	/nfs/dbraw/zinc/23/91/12/506239112.db2.gz	HQKSZMPYLDTIRF-OALUTQOASA-N	-1	0	356.466	2.778	50	0		FFAARM
O=C1OCc2cc([N-]S(=O)(=O)c3ccc(Br)s3)ccc21	ZINC000001080701	506247652	/nfs/dbraw/zinc/24/76/52/506247652.db2.gz	IHQWFBQKIIFWFJ-UHFFFAOYSA-N	-1	0	374.237	2.982	50	0		FFAARM
CCOC(CCn1c(=O)c2cc3c(cc2[n-]c1=S)OCO3)OCC	ZINC000002974131	506304908	/nfs/dbraw/zinc/30/49/08/506304908.db2.gz	MBXRJLLKVRBNJV-UHFFFAOYSA-N	-1	0	352.412	2.577	50	0		FFAARM
CCNC(=O)C1(c2ccc([N-]S(=O)(=O)c3cccs3)cc2)CC1	ZINC000033115461	506338807	/nfs/dbraw/zinc/33/88/07/506338807.db2.gz	JOFCKVRFFZMXNU-UHFFFAOYSA-N	-1	0	350.465	2.717	50	0		FFAARM
Cc1cn(C)c(CC(=O)N2CCN(c3cccc(C)c3)[C@@H](C)C2)c1C(=O)[O-]	ZINC000008607752	506661045	/nfs/dbraw/zinc/66/10/45/506661045.db2.gz	ZWHPYUFFNJLUAV-INIZCTEOSA-N	-1	0	369.465	2.620	50	0		FFAARM
O=C([O-])c1ccc(OCc2nnnn2-c2cccc(C(F)(F)F)c2)cc1	ZINC000012428914	506861318	/nfs/dbraw/zinc/86/13/18/506861318.db2.gz	ZROAGYPJHFMLIB-UHFFFAOYSA-N	-1	0	364.283	2.958	50	0		FFAARM
CC(C)(C)C(=O)CNC(=O)c1ccccc1[N-]S(=O)(=O)c1ccccc1	ZINC000012561064	506878059	/nfs/dbraw/zinc/87/80/59/506878059.db2.gz	VAZLTSRCEPKKBY-UHFFFAOYSA-N	-1	0	374.462	2.832	50	0		FFAARM
Cc1cc(C)c(OCC(=O)N(C)Cc2nc(=O)c3sccc3[n-]2)c(C)c1	ZINC000012757722	506896799	/nfs/dbraw/zinc/89/67/99/506896799.db2.gz	PHMXQIJKFMRXIE-UHFFFAOYSA-N	-1	0	371.462	2.947	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)c1cccc(CN2CCCC2=O)c1)c1ccccc1	ZINC000013427920	506941950	/nfs/dbraw/zinc/94/19/50/506941950.db2.gz	OIBJWFUUKBFGTG-GOSISDBHSA-N	-1	0	366.417	2.755	50	0		FFAARM
O=C([O-])C1CCN(c2nc3ccccc3n(Cc3ccccc3)c2=O)CC1	ZINC000045795978	507022115	/nfs/dbraw/zinc/02/21/15/507022115.db2.gz	USUVHLIJKLMYCM-UHFFFAOYSA-N	-1	0	363.417	2.746	50	0		FFAARM
O=C(CCCC1=Nc2ccccc2S(=O)(=O)[N-]1)NCc1cccs1	ZINC000015729552	507055309	/nfs/dbraw/zinc/05/53/09/507055309.db2.gz	VMRWFRSRDPEPPN-UHFFFAOYSA-N	-1	0	363.464	2.557	50	0		FFAARM
Cc1ccc(S(=O)(=O)N(C)c2ccc(O[C@H](C)C(=O)[O-])cc2)cc1C	ZINC000022141504	507281038	/nfs/dbraw/zinc/28/10/38/507281038.db2.gz	FEZKJLVVIYKZOW-CQSZACIVSA-N	-1	0	363.435	2.980	50	0		FFAARM
COc1cc(OC)cc(-n2c(=O)c3[n-][nH]n(-c4ccc(C)cc4)c=3c2=O)c1	ZINC000023125755	507331247	/nfs/dbraw/zinc/33/12/47/507331247.db2.gz	BNHGYFLQPZBBCY-IAGOWNOFSA-N	-1	0	366.377	2.510	50	0		FFAARM
O=C(N=c1[nH]c2ccccc2[nH]1)c1cc(=O)c(OCc2ccccc2)c[n-]1	ZINC000071281138	507700895	/nfs/dbraw/zinc/70/08/95/507700895.db2.gz	ZLHGANZMRYMKJT-UHFFFAOYSA-N	-1	0	360.373	2.504	50	0		FFAARM
COCCNS(=O)(=O)c1cc(C(=O)[O-])cc(-c2ccc(Cl)cc2)c1	ZINC000071776790	507715814	/nfs/dbraw/zinc/71/58/14/507715814.db2.gz	LTAQYZXLAMROFG-UHFFFAOYSA-N	-1	0	369.826	2.630	50	0		FFAARM
COc1ccc(C2=NO[C@@](CC(=O)Nc3ccccc3F)(C(=O)[O-])C2)cc1	ZINC000072404106	507783109	/nfs/dbraw/zinc/78/31/09/507783109.db2.gz	WCSCTYMLHVPKAM-IBGZPJMESA-N	-1	0	372.352	2.811	50	0		FFAARM
Cc1nccc(-c2ccccc2)c1C(=O)N1CCc2[nH]cnc2[C@@H]1C(=O)[O-]	ZINC000072428606	507788940	/nfs/dbraw/zinc/78/89/40/507788940.db2.gz	BSVODFXCSGOWLF-GOSISDBHSA-N	-1	0	362.389	2.604	50	0		FFAARM
Cc1cccc(OC2(C(=O)[O-])CCN(C(=O)NCc3ccco3)CC2)c1	ZINC000072481456	507797821	/nfs/dbraw/zinc/79/78/21/507797821.db2.gz	ZBDBTJWGWJEBGH-UHFFFAOYSA-N	-1	0	358.394	2.796	50	0		FFAARM
Cc1csc2nc(COc3ccc(C(=O)[O-])cc3Cl)cc(=O)n12	ZINC000078623797	507890608	/nfs/dbraw/zinc/89/06/08/507890608.db2.gz	DUMZLHNLVALSIZ-UHFFFAOYSA-N	-1	0	350.783	2.995	50	0		FFAARM
COc1cccc([C@@H]2CN(C(=O)c3cc(C)oc3C)C[C@H]2C(=O)[O-])c1OC	ZINC000091365040	507982454	/nfs/dbraw/zinc/98/24/54/507982454.db2.gz	KCIWNPYCKWLHFO-JKSUJKDBSA-N	-1	0	373.405	2.854	50	0		FFAARM
COc1cc(F)c(C(=O)N2C[C@@H](c3ccccc3)[C@H](C(=O)[O-])C2)c(F)c1	ZINC000091595503	507995194	/nfs/dbraw/zinc/99/51/94/507995194.db2.gz	KTABJGOPRVVHFE-UONOGXRCSA-N	-1	0	361.344	2.914	50	0		FFAARM
COc1ccccc1[C@@H]1CN(C(=O)COc2cccc(F)c2)C[C@H]1C(=O)[O-]	ZINC000092099056	508043218	/nfs/dbraw/zinc/04/32/18/508043218.db2.gz	QIZGENRNXKBMNI-DLBZAZTESA-N	-1	0	373.380	2.540	50	0		FFAARM
COc1ccc([N-]S(=O)(=O)c2cc(-c3cc[nH]n3)oc2C)cc1F	ZINC000075519003	508113284	/nfs/dbraw/zinc/11/32/84/508113284.db2.gz	CXEXTHIJDIOBKC-UHFFFAOYSA-N	-1	0	351.359	2.927	50	0		FFAARM
Cc1nn(C)c(C)c1[C@@H](C)C(=O)NC[C@H](Cc1ccc(C)cc1)C(=O)[O-]	ZINC000095425427	508184870	/nfs/dbraw/zinc/18/48/70/508184870.db2.gz	HUTOUQWHIMVNBW-DYVFJYSZSA-N	-1	0	357.454	2.509	50	0		FFAARM
Cc1noc(C)c1[C@@H](C(=O)[O-])N(C)Cc1cnn(-c2ccc(F)cc2)c1	ZINC000095530158	508197107	/nfs/dbraw/zinc/19/71/07/508197107.db2.gz	RGMGNIKWLKXMOF-KRWDZBQOSA-N	-1	0	358.373	2.874	50	0		FFAARM
O=C([O-])C1CCN(c2nccc3nc(N4CCCCCC4)ncc32)CC1	ZINC000096124715	508207492	/nfs/dbraw/zinc/20/74/92/508207492.db2.gz	RYMWHXWJJLNXOS-UHFFFAOYSA-N	-1	0	355.442	2.706	50	0		FFAARM
C[C@H](Oc1cccc(/C=C\C(=O)c2ccc3c(c2)NC(=O)CO3)c1)C(=O)[O-]	ZINC000096291706	508212744	/nfs/dbraw/zinc/21/27/44/508212744.db2.gz	FDCFKRULMPFQBH-HWPRWLFBSA-N	-1	0	367.357	2.766	50	0		FFAARM
O=c1c2[n-][nH]n(Cc3cccc(F)c3)c=2c(=O)n1-c1ccc(F)c(F)c1	ZINC000101418119	508241431	/nfs/dbraw/zinc/24/14/31/508241431.db2.gz	NJSMIBPSWNKKPB-LSDHHAIUSA-N	-1	0	360.295	2.597	50	0		FFAARM
COc1cccc(-n2[nH][n-]c3c(=O)n(-c4ccc(C)c(C)c4)c(=O)c2=3)c1	ZINC000102820651	508286244	/nfs/dbraw/zinc/28/62/44/508286244.db2.gz	GLQNSHWKFXFICN-SJORKVTESA-N	-1	0	350.378	2.810	50	0		FFAARM
Cc1c[nH]c(CN2CCC(Oc3ccc4ncccc4c3)(C(=O)[O-])CC2)n1	ZINC000077322188	508300684	/nfs/dbraw/zinc/30/06/84/508300684.db2.gz	GEYBZFWMAIYRNE-UHFFFAOYSA-N	-1	0	366.421	2.765	50	0		FFAARM
CCCn1ccnc1CN1CCC(C(=O)[O-])(n2ccc(C(C)(C)C)n2)CC1	ZINC000077470887	508320687	/nfs/dbraw/zinc/32/06/87/508320687.db2.gz	RDRNGSSJEISIOM-UHFFFAOYSA-N	-1	0	373.501	2.863	50	0		FFAARM
CC(C)(C)c1cc(CNc2nccc(-c3cc(C(=O)[O-])ccn3)n2)[nH]n1	ZINC000077522861	508327639	/nfs/dbraw/zinc/32/76/39/508327639.db2.gz	FKUMNDLXJHUKRV-UHFFFAOYSA-N	-1	0	352.398	2.870	50	0		FFAARM
O=C([O-])[C@@H]1CCCN(S(=O)(=O)Cc2ccc(Cl)c(Cl)c2)C1	ZINC000226087355	509395699	/nfs/dbraw/zinc/39/56/99/509395699.db2.gz	CFWBQGMHJVKTNL-SNVBAGLBSA-N	-1	0	352.239	2.620	50	0		FFAARM
Cc1nc(C(=O)[N-]S(=O)(=O)c2cc3c(c(Cl)c2)O[C@@H](C)C3)cs1	ZINC000170628847	509686736	/nfs/dbraw/zinc/68/67/36/509686736.db2.gz	QAMRDNDOFKPPED-ZETCQYMHSA-N	-1	0	372.855	2.547	50	0		FFAARM
C[C@@H]1CC[C@H](CCC(=O)[N-]S(=O)(=O)c2ccc(F)c3ncccc23)O1	ZINC000170645637	509695274	/nfs/dbraw/zinc/69/52/74/509695274.db2.gz	IUXIAFDJLXYMDI-VXGBXAGGSA-N	-1	0	366.414	2.527	50	0		FFAARM
COCc1ccc(C(=O)[N-]S(=O)(=O)Cc2ccc(Cl)c(F)c2)cc1	ZINC000241124245	509843319	/nfs/dbraw/zinc/84/33/19/509843319.db2.gz	JGQVIUKUOJSVEY-UHFFFAOYSA-N	-1	0	371.817	2.885	50	0		FFAARM
Cc1cc(C(=O)N(Cc2ccccc2)C[C@@H](C)C(=O)[O-])c2cnn(C)c2n1	ZINC000190667896	510273836	/nfs/dbraw/zinc/27/38/36/510273836.db2.gz	HQCRGYFSAHIXJF-CYBMUJFWSA-N	-1	0	366.421	2.640	50	0		FFAARM
O=C(NCc1cccnc1OCC(F)(F)F)c1s[n-]c(=O)c1Cl	ZINC000283107443	511238408	/nfs/dbraw/zinc/23/84/08/511238408.db2.gz	XQDXKTRERDKLMH-UHFFFAOYSA-N	-1	0	367.736	2.768	50	0		FFAARM
Cc1c(C(=O)[O-])cccc1S(=O)(=O)N1C[C@@H]2CCC(=O)c3cccc1c32	ZINC000274283523	511780206	/nfs/dbraw/zinc/78/02/06/511780206.db2.gz	ILTBNRYCSAQZIQ-LBPRGKRZSA-N	-1	0	371.414	2.962	50	0		FFAARM
O=C([O-])CCN(C(=O)c1ccc(OC(F)(F)F)cc1)C1CCOCC1	ZINC000408513245	513083463	/nfs/dbraw/zinc/08/34/63/513083463.db2.gz	FMEGXPJXMWVSAJ-UHFFFAOYSA-N	-1	0	361.316	2.681	50	0		FFAARM
CC(=O)c1ccc(NC(=O)N2CCC[C@H](c3ccn(CC(=O)[O-])n3)C2)cc1	ZINC000426415231	513934152	/nfs/dbraw/zinc/93/41/52/513934152.db2.gz	BBZZRIMHOMVTJI-HNNXBMFYSA-N	-1	0	370.409	2.582	50	0		FFAARM
O=C([O-])Cn1ccc([C@H]2CCCN(C(=O)c3cnc4ccccc4c3)C2)n1	ZINC000426503085	513962316	/nfs/dbraw/zinc/96/23/16/513962316.db2.gz	SJELIGZIXJZHDJ-HNNXBMFYSA-N	-1	0	364.405	2.536	50	0		FFAARM
O=C([O-])C[C@H]1CN(C(=O)/C=C\c2cccc(OC3CCCC3)c2)CCO1	ZINC000606441114	521069018	/nfs/dbraw/zinc/06/90/18/521069018.db2.gz	FNINPSQRHZXSBJ-GIFJBRJJSA-N	-1	0	359.422	2.723	50	0		FFAARM
CCC[C@H](C)c1cc([N-]S(=O)(=O)c2ccc(C(=O)OC)cc2)n[nH]1	ZINC000079106547	521071607	/nfs/dbraw/zinc/07/16/07/521071607.db2.gz	YTPZLAWYBHBNNF-NSHDSACASA-N	-1	0	351.428	2.901	50	0		FFAARM
CC[C@H](Cc1ccccc1Br)C(=O)N1CC[C@@H](C(=O)[O-])C1	ZINC000269174706	522315449	/nfs/dbraw/zinc/31/54/49/522315449.db2.gz	JFTXSXGVGIJUMI-DGCLKSJQSA-N	-1	0	354.244	2.951	50	0		FFAARM
C[C@@H](Oc1ccc(NC(=O)[C@H]2OCCc3ccccc32)cc1F)C(=O)[O-]	ZINC000630258902	522746018	/nfs/dbraw/zinc/74/60/18/522746018.db2.gz	VBYZBSYGGZLDFJ-DIFFPNOSSA-N	-1	0	359.353	2.930	50	0		FFAARM
COCc1c(C(=O)N2CCO[C@@H](CC(=O)[O-])C2)sc2cccc(F)c21	ZINC000262407464	522897292	/nfs/dbraw/zinc/89/72/92/522897292.db2.gz	BPJFJZIWMYTBFE-JTQLQIEISA-N	-1	0	367.398	2.503	50	0		FFAARM
COc1cccc([C@H]2C[C@@H]2C(=O)NCc2ccc(OC)c(C(=O)[O-])c2)c1	ZINC000299752556	524183531	/nfs/dbraw/zinc/18/35/31/524183531.db2.gz	UOQSGCROFATVFO-CVEARBPZSA-N	-1	0	355.390	2.822	50	0		FFAARM
COc1ccc(Nc2ccccc2C(=O)N2CCO[C@H](CC(=O)[O-])C2)cc1	ZINC000269061529	524715069	/nfs/dbraw/zinc/71/50/69/524715069.db2.gz	ZWRDGHZJEQTDKP-MRXNPFEDSA-N	-1	0	370.405	2.755	50	0		FFAARM
Cc1nccn1CCCC(=O)N1C[C@@H](c2ccccc2C)[C@H](C(=O)[O-])C1	ZINC000091593009	527392872	/nfs/dbraw/zinc/39/28/72/527392872.db2.gz	PNYZTQOVDOROBT-ZWKOTPCHSA-N	-1	0	355.438	2.607	50	0		FFAARM
O=C([O-])[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(C(F)(F)F)nc1	ZINC000192683361	571212074	/nfs/dbraw/zinc/21/20/74/571212074.db2.gz	AHZKLVOSUYJUFS-ZDUSSCGKSA-N	-1	0	350.296	2.752	50	0		FFAARM
O=S(=O)(/C=C/c1ccccc1Cl)[N-]c1ncn(-c2ccccn2)n1	ZINC000095457210	728480462	/nfs/dbraw/zinc/48/04/62/728480462.db2.gz	WDNGQQCOMGTHJQ-CSKARUKUSA-N	-1	0	361.814	2.728	50	0		FFAARM
O=S(=O)([N-]c1ccc2ncccc2c1)c1cnn(C2CCOCC2)c1	ZINC000135923283	728739044	/nfs/dbraw/zinc/73/90/44/728739044.db2.gz	XYUVIILMNPNXHK-UHFFFAOYSA-N	-1	0	358.423	2.584	50	0		FFAARM
Cc1cc(C)c(S(=O)(=O)N2CCc3ccc(F)c(C(=O)[O-])c3C2)s1	ZINC000663288356	732409699	/nfs/dbraw/zinc/40/96/99/732409699.db2.gz	GVGRSCSJMWRDEO-UHFFFAOYSA-N	-1	0	369.439	2.949	50	0		FFAARM
CCn1ncc(NC(=O)NCc2cccc(C(=O)[O-])c2)c1C(F)(F)F	ZINC000669505594	733239340	/nfs/dbraw/zinc/23/93/40/733239340.db2.gz	MRGPWXVJMDRGFR-UHFFFAOYSA-N	-1	0	356.304	2.942	50	0		FFAARM
O=C([O-])c1ccccc1NNS(=O)(=O)c1cc(Cl)ccc1Cl	ZINC000951726979	740444776	/nfs/dbraw/zinc/44/47/76/740444776.db2.gz	RWSITNZIXRQLFK-UHFFFAOYSA-N	-1	0	361.206	2.997	50	0		FFAARM
O=C([O-])C1(NC(=O)N2CCO[C@H](c3ccc(Cl)cc3)C2)CCCC1	ZINC000827969375	939220139	/nfs/dbraw/zinc/22/01/39/939220139.db2.gz	DOPLKYJMOVRLPV-AWEZNQCLSA-N	-1	0	352.818	2.820	50	0		FFAARM
CCN(C(=O)c1ccc(C(=O)[O-])cc1F)[C@H]1CCN(c2ccccc2)C1=O	ZINC000262462426	973348569	/nfs/dbraw/zinc/34/85/69/973348569.db2.gz	VYKVRAHBIVZIRP-KRWDZBQOSA-N	-1	0	370.380	2.792	50	0		FFAARM
COCc1n[n-]c(=NC(=O)c2cc(C)nc3c2cnn3C2CCCC2)s1	ZINC000606672289	992750440	/nfs/dbraw/zinc/75/04/40/992750440.db2.gz	GNTUEKGZUFUYOW-UHFFFAOYSA-N	-1	0	372.454	2.527	50	0		FFAARM
Cc1nc2cc(=O)[n-]n2c(C)c1CC(=O)N[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC000828537600	1011275099	/nfs/dbraw/zinc/27/50/99/1011275099.db2.gz	XKZGCTNKNGWLCS-CHWSQXEVSA-N	-1	0	368.359	2.608	50	0		FFAARM
O=C(N[C@H]1CCCN(CC(F)(F)F)C1=O)c1ccc2ccccc2c1O	ZINC000155595828	1022267728	/nfs/dbraw/zinc/26/77/28/1022267728.db2.gz	HNQPRRLGEJAMCY-AWEZNQCLSA-N	-1	0	366.339	2.829	50	0		FFAARM
COc1ccc2c(c1)[C@@H](C(=O)N[C@@H](c1nnn[n-]1)c1ccccc1)CCC2	ZINC000655391590	1025208786	/nfs/dbraw/zinc/20/87/86/1025208786.db2.gz	XJQSOWDIHHFYCQ-FUHWJXTLSA-N	-1	0	363.421	2.534	50	0		FFAARM
CN(C[C@H]1CCN(c2ccccc2)C1)S(=O)(=O)c1ccccc1C(=O)[O-]	ZINC001506422273	1059512038	/nfs/dbraw/zinc/51/20/38/1059512038.db2.gz	RALPHFVLHZKYEF-OAHLLOKOSA-N	-1	0	374.462	2.532	50	0		FFAARM
COc1ccc([C@H](C(=O)[O-])N(C)Cc2nc3cc(F)ccc3[nH]2)cc1OC	ZINC001529142935	1062184542	/nfs/dbraw/zinc/18/45/42/1062184542.db2.gz	XVIXNEONDKWQKY-GOSISDBHSA-N	-1	0	373.384	2.977	50	0		FFAARM
O=C1N2CCSC2=N[C@@]1([N-]c1nc2ccccc2s1)C(F)(F)F	ZINC000002504108	204042508	/nfs/dbraw/zinc/04/25/08/204042508.db2.gz	BLAKWGKBMRBZAO-GFCCVEGCSA-N	-1	0	358.370	2.912	50	0		FFAARM
CC(C)N1c2ccccc2[C@@]([N-]C(=O)C(F)(F)F)(C(F)(F)F)C1=O	ZINC000002503880	204043091	/nfs/dbraw/zinc/04/30/91/204043091.db2.gz	KYVCBPOBAHLAPA-LBPRGKRZSA-N	-1	0	354.250	2.878	50	0		FFAARM
CC(=O)Nc1cccc(Oc2ccc3c(c2)C(=O)N(CCC(=O)[O-])C3=O)c1	ZINC000002881644	204066345	/nfs/dbraw/zinc/06/63/45/204066345.db2.gz	JWKSMNPNVFLFKA-UHFFFAOYSA-N	-1	0	368.345	2.508	50	0		FFAARM
O=C([O-])[C@H]1C[C@@H]1C(=O)Nc1ccc(C(O)(C(F)(F)F)C(F)(F)F)cc1	ZINC000002571060	204045201	/nfs/dbraw/zinc/04/52/01/204045201.db2.gz	QCBAODFXUVDXOG-IUCAKERBSA-N	-1	0	371.233	2.658	50	0		FFAARM
O=C1NC(c2ccccc2)=N[C@@]1([N-]c1ccc(Cl)cn1)C(F)(F)F	ZINC000004718009	204158343	/nfs/dbraw/zinc/15/83/43/204158343.db2.gz	NLTIAFOPZHZEPC-CQSZACIVSA-N	-1	0	354.719	2.982	50	0		FFAARM
COc1ccc(-c2noc(C[N-]C(=O)C(Cl)(Cl)Cl)n2)cc1	ZINC000004858673	204170253	/nfs/dbraw/zinc/17/02/53/204170253.db2.gz	AFCWWJJCAAZOQV-UHFFFAOYSA-N	-1	0	350.589	2.732	50	0		FFAARM
CCOc1ccc(S(=O)(=O)N(CC(=O)[O-])Cc2ccccc2)cc1C	ZINC000004841701	204167596	/nfs/dbraw/zinc/16/75/96/204167596.db2.gz	QGKAATPIKNSENI-UHFFFAOYSA-N	-1	0	363.435	2.669	50	0		FFAARM
O=C([O-])[C@H](NS(=O)(=O)c1ccc(Br)cc1)c1ccccc1	ZINC000005555178	204214398	/nfs/dbraw/zinc/21/43/98/204214398.db2.gz	AAMMHGXIMZVDDB-CYBMUJFWSA-N	-1	0	370.224	2.553	50	0		FFAARM
COc1cccc2c(=O)c(C(=O)[O-])c(-c3ccc4c(c3)OCO4)n(C)c12	ZINC000005670034	204219623	/nfs/dbraw/zinc/21/96/23/204219623.db2.gz	XRZGGSVENTZQFG-UHFFFAOYSA-N	-1	0	353.330	2.641	50	0		FFAARM
COc1ccc(C[C@@H](C(=O)Nc2cc(C)ccc2C)c2nnn[n-]2)cc1	ZINC000005682094	204220605	/nfs/dbraw/zinc/22/06/05/204220605.db2.gz	QNOICPGXUJRLSU-MRXNPFEDSA-N	-1	0	351.410	2.790	50	0		FFAARM
CCOC(=O)c1c(C)n(C)c(C)c1S(=O)(=O)[N-]c1cccc(C)c1	ZINC000006887615	204279795	/nfs/dbraw/zinc/27/97/95/204279795.db2.gz	RRVHQSZJVSFKML-UHFFFAOYSA-N	-1	0	350.440	2.928	50	0		FFAARM
Cc1csc2nc(C)c(S(=O)(=O)[N-]c3cc(C)cc(C)c3)c(=O)n12	ZINC000006784760	204270112	/nfs/dbraw/zinc/27/01/12/204270112.db2.gz	ISELDJBVJZBRFN-UHFFFAOYSA-N	-1	0	363.464	2.790	50	0		FFAARM
CCOC(=O)c1cc(S(=O)(=O)[N-]c2ccc(OC)c(Cl)c2)cn1C	ZINC000006800614	204272102	/nfs/dbraw/zinc/27/21/02/204272102.db2.gz	OGVCAFOLOGVXQG-UHFFFAOYSA-N	-1	0	372.830	2.665	50	0		FFAARM
COc1ccc([N-]S(=O)(=O)c2ccc(C(=O)N3CCCC3)s2)cc1	ZINC000009748372	204382520	/nfs/dbraw/zinc/38/25/20/204382520.db2.gz	GKKFSELHDDUFFJ-UHFFFAOYSA-N	-1	0	366.464	2.794	50	0		FFAARM
CCn1c(=O)c2ccc(C(=O)NOCc3ccccc3)cc2[n-]c1=S	ZINC000010319327	204393917	/nfs/dbraw/zinc/39/39/17/204393917.db2.gz	OZBCVNGLNYTANH-UHFFFAOYSA-N	-1	0	355.419	2.941	50	0		FFAARM
O=C([O-])c1ccccc1C(=O)Nc1ccc(C(=O)NC[C@@H]2CCCO2)cc1	ZINC000012138540	204433041	/nfs/dbraw/zinc/43/30/41/204433041.db2.gz	IBJHFVGJSRFKRE-HNNXBMFYSA-N	-1	0	368.389	2.546	50	0		FFAARM
O=C([O-])[C@@H]1CC=CC[C@H]1C(=O)Nc1ccccc1C(=O)N1CCCCC1	ZINC000013466558	204531320	/nfs/dbraw/zinc/53/13/20/204531320.db2.gz	XDRCEVQBCNZWTL-HUUCEWRRSA-N	-1	0	356.422	2.918	50	0		FFAARM
CCOC(=O)c1cnc(NC(=O)N2CCOc3ccc(Cl)cc3C2)[n-]1	ZINC000023398916	204805552	/nfs/dbraw/zinc/80/55/52/204805552.db2.gz	ICSZFYPKWQWUHB-UHFFFAOYSA-N	-1	0	364.789	2.666	50	0		FFAARM
CC(C)[C@@H](NS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)C(=O)[O-]	ZINC000036293810	205008224	/nfs/dbraw/zinc/00/82/24/205008224.db2.gz	IGSDVRVGWMUAPT-SNVBAGLBSA-N	-1	0	359.753	2.746	50	0		FFAARM
COc1cc(NC(=O)Cc2ccccc2C(=O)[O-])c(C(C)=O)cc1OC	ZINC000070666283	205024897	/nfs/dbraw/zinc/02/48/97/205024897.db2.gz	AFCZKVUIQWGHSU-UHFFFAOYSA-N	-1	0	357.362	2.786	50	0	biogenic	FFAARM
C[C@H]1CCCN(S(=O)(=O)Nc2cc(C(=O)[O-])cc(C(F)(F)F)c2)C1	ZINC000072015909	205032622	/nfs/dbraw/zinc/03/26/22/205032622.db2.gz	XQKXOEUANONMPO-VIFPVBQESA-N	-1	0	366.361	2.792	50	0		FFAARM
CCCOc1cc(S(=O)(=O)N2CCC(C(=O)[O-])CC2)ccc1Cl	ZINC000041095900	205088725	/nfs/dbraw/zinc/08/87/25/205088725.db2.gz	RBQCIQMODWLUIT-UHFFFAOYSA-N	-1	0	361.847	2.614	50	0		FFAARM
Cc1cccc(CSc2ncc(Cl)c(C(=O)NCCC(=O)[O-])n2)c1	ZINC000041154678	205090545	/nfs/dbraw/zinc/09/05/45/205090545.db2.gz	DUKVAFTXGYBMEW-UHFFFAOYSA-N	-1	0	365.842	2.935	50	0		FFAARM
O=C([O-])[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(C(=O)c2cc[nH]c2)cc1	ZINC000299743831	205124785	/nfs/dbraw/zinc/12/47/85/205124785.db2.gz	MOBIBDNUXOMZHR-IBGZPJMESA-N	-1	0	374.396	2.897	50	0		FFAARM
O=C([O-])CCCOc1ccc(CNC(=O)c2ncoc2[C@@H]2CCCO2)cc1	ZINC000299747318	205126580	/nfs/dbraw/zinc/12/65/80/205126580.db2.gz	CPHYVIDUVVKEJC-HNNXBMFYSA-N	-1	0	374.393	2.700	50	0		FFAARM
C[C@]1(C(=O)[O-])CCN(C(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)C1	ZINC000299746272	205127046	/nfs/dbraw/zinc/12/70/46/205127046.db2.gz	WGLAKHHJBKONIC-ZENOOKHLSA-N	-1	0	352.228	2.876	50	0		FFAARM
C[C@@H]1Sc2ccc(C(=O)N3[C@@H]4CCCC[C@H]4C[C@H]3C(=O)[O-])cc2NC1=O	ZINC000299745775	205128207	/nfs/dbraw/zinc/12/82/07/205128207.db2.gz	SHLCCVGUYOEJAC-AZHAFVHUSA-N	-1	0	374.462	2.977	50	0		FFAARM
CCCCOCN(C(=O)CS(=O)(=O)[O-])c1c(CC)cccc1CC	ZINC000043215007	205103023	/nfs/dbraw/zinc/10/30/23/205103023.db2.gz	ZPLBIPFYPKPMFB-UHFFFAOYSA-N	-1	0	357.472	2.806	50	0		FFAARM
C[C@@H](NC(=O)CCc1ccc(C(=O)[O-])cc1)c1ccc2c(c1)NC(=O)CO2	ZINC000299748367	205129083	/nfs/dbraw/zinc/12/90/83/205129083.db2.gz	HDBGQBOVQPOKAN-GFCCVEGCSA-N	-1	0	368.389	2.526	50	0		FFAARM
O=C([O-])[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)Cc1cc2ccccc2[nH]c1=O	ZINC000299753758	205134511	/nfs/dbraw/zinc/13/45/11/205134511.db2.gz	ZFUMTDNEOZKCTF-COXVUDFISA-N	-1	0	354.406	2.727	50	0		FFAARM
O=C([O-])[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)C[C@H]1Sc2ccccc2NC1=O	ZINC000299750602	205132753	/nfs/dbraw/zinc/13/27/53/205132753.db2.gz	OASVCKBLNVIKIT-ATVPRXPUSA-N	-1	0	374.462	2.734	50	0		FFAARM
COCCn1c(=O)n(Cc2ccc(Cl)s2)c2cc(C(=O)[O-])ccc21	ZINC000055089567	205206773	/nfs/dbraw/zinc/20/67/73/205206773.db2.gz	LMTFPZFDNYHQRW-UHFFFAOYSA-N	-1	0	366.826	2.911	50	0		FFAARM
O=C([O-])c1cn(C[C@H](O)Cc2ccccc2)cc(Oc2ccccc2)c1=O	ZINC000055245284	205211683	/nfs/dbraw/zinc/21/16/83/205211683.db2.gz	QEVAOQZNLXGNBO-MRXNPFEDSA-N	-1	0	365.385	2.942	50	0		FFAARM
COc1ccc(NC(C)=O)c([N-]S(=O)(=O)c2ccc(F)cc2C)c1	ZINC000057121944	205234871	/nfs/dbraw/zinc/23/48/71/205234871.db2.gz	UNVGZDQXIYHOPE-UHFFFAOYSA-N	-1	0	352.387	2.902	50	0		FFAARM
COc1cc([N-]S(=O)(=O)c2ccc(F)c(F)c2F)ccc1NC(C)=O	ZINC000055616137	205221456	/nfs/dbraw/zinc/22/14/56/205221456.db2.gz	NYLBBDUDJMSIDH-UHFFFAOYSA-N	-1	0	374.340	2.872	50	0		FFAARM
CC(=O)NCCc1ccc(S(=O)(=O)[N-]c2ccc(C)c(C)c2)s1	ZINC000058173051	205254818	/nfs/dbraw/zinc/25/48/18/205254818.db2.gz	UMFMCFOVCWMFBU-UHFFFAOYSA-N	-1	0	352.481	2.844	50	0		FFAARM
COc1ccc([C@H]2CC(=O)Nc3c(C(=O)[O-])cn(-c4cc(C)on4)c32)cc1	ZINC000061718228	205286485	/nfs/dbraw/zinc/28/64/85/205286485.db2.gz	GTZZAWIWWWRSHK-CYBMUJFWSA-N	-1	0	367.361	2.955	50	0		FFAARM
Cc1cc(-n2cc(C(=O)[O-])c3c2[C@H](c2ccc(O)cc2)CC(=O)N3)no1	ZINC000061717683	205286916	/nfs/dbraw/zinc/28/69/16/205286916.db2.gz	LNTWVWMEFOVSAQ-LBPRGKRZSA-N	-1	0	353.334	2.652	50	0		FFAARM
CCc1cccc([N-]S(=O)(=O)c2cc(-c3ccc(=O)[nH]n3)cs2)c1	ZINC000065119376	205317938	/nfs/dbraw/zinc/31/79/38/205317938.db2.gz	MZKYETBIRCVNOR-UHFFFAOYSA-N	-1	0	361.448	2.862	50	0		FFAARM
CCc1nn2c(nc(C)c2S(=O)(=O)[N-]c2ccc(F)c(F)c2)s1	ZINC000065183777	205321831	/nfs/dbraw/zinc/32/18/31/205321831.db2.gz	PISLNGRGZMRFKA-UHFFFAOYSA-N	-1	0	358.395	2.741	50	0		FFAARM
COc1ccc(C)cc1-n1c(SCC(=O)[O-])nnc1-c1ccncc1	ZINC000065455218	205351259	/nfs/dbraw/zinc/35/12/59/205351259.db2.gz	DTVRAEBITUCWLR-UHFFFAOYSA-N	-1	0	356.407	2.823	50	0		FFAARM
COc1ccc([C@@H]2CC(=O)Nc3nn4c(nc(C)cc4C)c32)cc1C(=O)[O-]	ZINC000065370819	205340345	/nfs/dbraw/zinc/34/03/45/205340345.db2.gz	NZHXYMOZIKDAND-LBPRGKRZSA-N	-1	0	366.377	2.527	50	0		FFAARM
CCn1cc(-c2nnc(SCC(=O)[O-])n2[C@@H](C)c2ccccc2)cn1	ZINC000067433542	205371518	/nfs/dbraw/zinc/37/15/18/205371518.db2.gz	ZUYRSZJEXVCMRZ-LBPRGKRZSA-N	-1	0	357.439	2.948	50	0		FFAARM
CCn1nc(C(=O)[O-])c2c1CCN(C(=O)CCc1c[nH]c3ccccc13)C2	ZINC000067842647	205396193	/nfs/dbraw/zinc/39/61/93/205396193.db2.gz	QCDJJYUXAWXEMO-UHFFFAOYSA-N	-1	0	366.421	2.600	50	0		FFAARM
O=C([O-])CCc1ccc(NC(=O)Cn2ccc(=O)c3ccccc32)cc1	ZINC000095425532	205756206	/nfs/dbraw/zinc/75/62/06/205756206.db2.gz	DHBWOUJMWGYRNB-UHFFFAOYSA-N	-1	0	350.374	2.657	50	0		FFAARM
CC(=O)c1[n-]n(-c2ccccc2C)c2c(O)n(-c3ccc(C)cc3)c(=O)c1-2	ZINC000100741964	205947768	/nfs/dbraw/zinc/94/77/68/205947768.db2.gz	QFZJMGYATJXYAD-PKOBYXMFSA-N	-1	0	361.401	2.627	50	0		FFAARM
CCOc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccccc4F)c=3c2=O)cc1	ZINC000101417801	205961096	/nfs/dbraw/zinc/96/10/96/205961096.db2.gz	XQXWODUDKCZOQL-IAGOWNOFSA-N	-1	0	368.368	2.718	50	0		FFAARM
CCO[C@H](C)c1nc(CC(=O)N2CCC[C@@H](CCC(=O)[O-])C2)cs1	ZINC000236918322	206001518	/nfs/dbraw/zinc/00/15/18/206001518.db2.gz	TUOXSMAGIRQADX-OLZOCXBDSA-N	-1	0	354.472	2.887	50	0		FFAARM
CCn1cc(Br)cc1C(=O)N1CCC[C@@H](CCC(=O)[O-])C1	ZINC000043584445	206058099	/nfs/dbraw/zinc/05/80/99/206058099.db2.gz	FNEBTLDLUCMDGC-NSHDSACASA-N	-1	0	357.248	2.988	50	0		FFAARM
Cc1ccc(C(=O)[O-])cc1S(=O)(=O)Nc1ccccc1-n1cccn1	ZINC000047991916	206081207	/nfs/dbraw/zinc/08/12/07/206081207.db2.gz	VDSMJODQBZJIMP-UHFFFAOYSA-N	-1	0	357.391	2.680	50	0		FFAARM
COc1ccc([C@H]2CCCCCN2C(=O)CN2CCC[C@@H]2C(=O)[O-])cc1	ZINC000237370622	206101286	/nfs/dbraw/zinc/10/12/86/206101286.db2.gz	SBAGCOZGVRZKAK-QZTJIDSGSA-N	-1	0	360.454	2.688	50	0		FFAARM
C[C@H](Oc1ccc(F)cc1Br)C(=O)N1CCC[C@@H](C(=O)[O-])C1	ZINC000237637008	206107303	/nfs/dbraw/zinc/10/73/03/206107303.db2.gz	BHYUUTHVFAXUDA-VHSXEESVSA-N	-1	0	374.206	2.679	50	0		FFAARM
Cc1ccccc1-c1nc(C(=O)N(CC(=O)[O-])C2CCOCC2)cs1	ZINC000237700895	206107636	/nfs/dbraw/zinc/10/76/36/206107636.db2.gz	ZMBJZEQKJPEODC-UHFFFAOYSA-N	-1	0	360.435	2.824	50	0		FFAARM
O=C([O-])CCN(C[C@H]1CCCO1)C(=O)c1ccc(Br)c(F)c1	ZINC000238105941	206113449	/nfs/dbraw/zinc/11/34/49/206113449.db2.gz	DWNMXPSJWGPGNW-LLVKDONJSA-N	-1	0	374.206	2.684	50	0		FFAARM
O=C([O-])C[C@@H]1CN(C(=O)[C@@H]2C[C@@H]2c2cccc(Cl)c2Cl)CCO1	ZINC000238196730	206114331	/nfs/dbraw/zinc/11/43/31/206114331.db2.gz	FTHODCZSPUCXTO-YUSALJHKSA-N	-1	0	358.221	2.799	50	0		FFAARM
Cc1ccc2nc(CSCC(=O)NCc3ccc(C(=O)[O-])cc3)cn2c1	ZINC000237905249	206109425	/nfs/dbraw/zinc/10/94/25/206109425.db2.gz	HIXSNZSPWAJXBH-UHFFFAOYSA-N	-1	0	369.446	2.891	50	0		FFAARM
Cc1ccc2cc(C(=O)N(CCC(=O)[O-])C3CCOCC3)c(C)nc2c1	ZINC000237887134	206109745	/nfs/dbraw/zinc/10/97/45/206109745.db2.gz	ONHKCJWXMLGKQB-UHFFFAOYSA-N	-1	0	356.422	2.948	50	0		FFAARM
Cc1ccc(-n2ncc(C(=O)N3CC[C@@H](C(=O)[O-])C3)c2C(F)(F)F)cc1	ZINC000237842895	206110178	/nfs/dbraw/zinc/11/01/78/206110178.db2.gz	OJTWWUBKUQFNDZ-LLVKDONJSA-N	-1	0	367.327	2.746	50	0		FFAARM
O=C([N-]S(=O)(=O)Cc1c(F)cccc1F)[C@@H]1CSc2ccccc21	ZINC000132744968	206128743	/nfs/dbraw/zinc/12/87/43/206128743.db2.gz	TWOZFKRDZUOTMU-LLVKDONJSA-N	-1	0	369.414	2.800	50	0		FFAARM
O=C([O-])[C@@H]1CC=CC[C@@H]1C(=O)Nc1ccc(C(=O)Nc2ccccn2)cc1	ZINC000000794588	206134021	/nfs/dbraw/zinc/13/40/21/206134021.db2.gz	YWBYNQIDGROGDX-JKSUJKDBSA-N	-1	0	365.389	2.939	50	0		FFAARM
Cc1oc2c(cc3c(C)c(CCC(=O)NCC(=O)[O-])c(=O)oc3c2C)c1C	ZINC000002156938	206153349	/nfs/dbraw/zinc/15/33/49/206153349.db2.gz	DIIDIDGCLPVLAU-UHFFFAOYSA-N	-1	0	371.389	2.906	50	0	biogenic	FFAARM
O=C([O-])[C@@H]1CC=CC[C@@H]1C(=O)NCCc1csc(-c2cccnc2)n1	ZINC000004167063	206171374	/nfs/dbraw/zinc/17/13/74/206171374.db2.gz	FHDIIOLXXLEGLF-LSDHHAIUSA-N	-1	0	357.435	2.531	50	0		FFAARM
Cc1n[n-]c(SCC(=O)N(c2ccccc2)c2ccccc2)nc1=O	ZINC000005021678	206188171	/nfs/dbraw/zinc/18/81/71/206188171.db2.gz	GUWFTFXCWKABCQ-UHFFFAOYSA-N	-1	0	352.419	2.930	50	0		FFAARM
O=S(=O)([N-]c1ccc(-c2cn3c(n2)SCC3)cc1)c1cccnc1	ZINC000005084135	206188175	/nfs/dbraw/zinc/18/81/75/206188175.db2.gz	LGPFQXLAXPLXFV-UHFFFAOYSA-N	-1	0	358.448	2.852	50	0		FFAARM
CS(=O)(=O)[N-]c1ccccc1C(=O)OCC(=O)c1ccc(Cl)cc1	ZINC000005574777	206196919	/nfs/dbraw/zinc/19/69/19/206196919.db2.gz	DBFNQQXSHHDRJQ-UHFFFAOYSA-N	-1	0	367.810	2.751	50	0		FFAARM
Cc1ccc(S(=O)(=O)[N-]c2ccccc2C(N)=O)c(Br)c1	ZINC000012536171	206292763	/nfs/dbraw/zinc/29/27/63/206292763.db2.gz	PSUAIJKIQWWVQC-UHFFFAOYSA-N	-1	0	369.240	2.657	50	0		FFAARM
CCCN(Cc1nc(=O)c2sccc2[n-]1)C(=O)c1cc(C(C)=O)c[nH]1	ZINC000012764797	206294974	/nfs/dbraw/zinc/29/49/74/206294974.db2.gz	DBYIIUKYZCXQTG-UHFFFAOYSA-N	-1	0	358.423	2.568	50	0		FFAARM
CCN(CC)c1ccc([N-]S(=O)(=O)c2cnc(NC(C)=O)s2)cc1	ZINC000016623946	206318409	/nfs/dbraw/zinc/31/84/09/206318409.db2.gz	XIXTXJNICFJXTK-UHFFFAOYSA-N	-1	0	368.484	2.749	50	0		FFAARM
COc1ccc(C)cc1S(=O)(=O)[N-]c1ccc2c(c1)N(C(C)=O)CC2	ZINC000013697044	206304923	/nfs/dbraw/zinc/30/49/23/206304923.db2.gz	VWPSHQKOZNUGJE-UHFFFAOYSA-N	-1	0	360.435	2.713	50	0		FFAARM
CC[C@]1(C(=O)[O-])CCC[N@H+](Cc2cc(Cl)ccc2OCC(=O)[O-])C1	ZINC000215421677	206347931	/nfs/dbraw/zinc/34/79/31/206347931.db2.gz	GDGPHOBRLKLWFS-KRWDZBQOSA-N	-1	0	355.818	2.880	50	0		FFAARM
COc1cccc([C@@H](C)N(C)C(=O)c2ccc(N3CC(=O)N=C3[O-])cc2)c1	ZINC000215812064	206352055	/nfs/dbraw/zinc/35/20/55/206352055.db2.gz	DDSTUYDWOHEUMK-CYBMUJFWSA-N	-1	0	367.405	2.585	50	0		FFAARM
CC1(C)c2sc(=O)[nH]c2S[C@H](C(=O)[O-])[C@H]1C(=O)c1ccc(F)cc1	ZINC000032594635	206511241	/nfs/dbraw/zinc/51/12/41/206511241.db2.gz	UWUHFWYLCGSROY-KOLCDFICSA-N	-1	0	367.423	2.911	50	0		FFAARM
Cn1cc(Br)cc1C(=O)N1[C@@H]2CCCC[C@@H]2C[C@H]1C(=O)[O-]	ZINC000252368054	251309047	/nfs/dbraw/zinc/30/90/47/251309047.db2.gz	IWTBQHFADKVOPH-XWIASGKRSA-N	-1	0	355.232	2.646	50	0		FFAARM
O=C([O-])c1cccnc1N1CCC[C@@]2(CCC(=O)N(C3CCCC3)C2)C1	ZINC000077470220	132185859	/nfs/dbraw/zinc/18/58/59/132185859.db2.gz	XLWRUKAWZFOVGY-HXUWFJFHSA-N	-1	0	357.454	2.931	50	0		FFAARM
Cc1cc(C)nc(N2CCC(C(=O)[O-])(n3ccc(C(C)(C)C)n3)CC2)n1	ZINC000072409329	136145279	/nfs/dbraw/zinc/14/52/79/136145279.db2.gz	ICUZXTBOTUVTOL-UHFFFAOYSA-N	-1	0	357.458	2.668	50	0		FFAARM
O=C([O-])c1ccc(N2CCC(c3cc(N4CCCC4)ncn3)CC2)nc1	ZINC000072435985	136147265	/nfs/dbraw/zinc/14/72/65/136147265.db2.gz	BUSSEJYNNUTKDV-UHFFFAOYSA-N	-1	0	353.426	2.554	50	0		FFAARM
Cc1ccc(N2CCC(Oc3ccc4c(c3)CCC4)(C(=O)[O-])CC2)nn1	ZINC000072435324	136147349	/nfs/dbraw/zinc/14/73/49/136147349.db2.gz	XHDJCJCGYROYEP-UHFFFAOYSA-N	-1	0	353.422	2.776	50	0		FFAARM
Cc1ccnc([N-]S(=O)(=O)c2ccc(NC(=O)CC(C)(C)C)cc2)n1	ZINC000000892619	506238088	/nfs/dbraw/zinc/23/80/88/506238088.db2.gz	MUOKABMNVGELSC-UHFFFAOYSA-N	-1	0	362.455	2.961	50	0		FFAARM
CC[C@@H](C(=O)Nc1ccc(S(=O)(=O)[N-]C(C)=O)cc1)c1ccccc1	ZINC000001088662	506248140	/nfs/dbraw/zinc/24/81/40/506248140.db2.gz	MMIQEAZQBGGRID-QGZVFWFLSA-N	-1	0	360.435	2.644	50	0		FFAARM
COc1ccc([C@@H](C)NC(=O)c2c(=O)[nH]c3ccsc3c2[O-])cc1OC	ZINC000065215591	506269733	/nfs/dbraw/zinc/26/97/33/506269733.db2.gz	AWMXKTDTNPCQGZ-SECBINFHSA-N	-1	0	374.418	2.803	50	0		FFAARM
O=C(NC1CCCC1)c1ccc2c(c1)[n-]c(=S)n(C[C@@H]1CCCO1)c2=O	ZINC000002971825	506305732	/nfs/dbraw/zinc/30/57/32/506305732.db2.gz	DKRXBHYTCJTOOZ-AWEZNQCLSA-N	-1	0	373.478	2.910	50	0		FFAARM
COc1ccc(/C=C/C(=O)[O-])cc1S(=O)(=O)N(C)c1cccc(C)c1	ZINC000065667803	506343540	/nfs/dbraw/zinc/34/35/40/506343540.db2.gz	ONDYUOOFRTYLFO-CSKARUKUSA-N	-1	0	361.419	2.927	50	0		FFAARM
O=C([O-])[C@@H]1CC=CC[C@@H]1C(=O)N1CCN(C/C=C\c2ccccc2)CC1	ZINC000033456247	506356658	/nfs/dbraw/zinc/35/66/58/506356658.db2.gz	JLTLXEFNRIBPCX-OSDWJDLUSA-N	-1	0	354.450	2.511	50	0		FFAARM
CCCCOc1ccc(-c2nnc(CCC(=O)N(C)CC)c(=O)[n-]2)cc1	ZINC000034763358	506370845	/nfs/dbraw/zinc/37/08/45/506370845.db2.gz	NIPROIGTONHFFV-UHFFFAOYSA-N	-1	0	358.442	2.834	50	0		FFAARM
CCN(Cc1ccccc1)c1ncc(NS(=O)(=O)CC)cc1C(=O)[O-]	ZINC000035397224	506381850	/nfs/dbraw/zinc/38/18/50/506381850.db2.gz	RXXFNWCUKJWIHI-UHFFFAOYSA-N	-1	0	363.439	2.568	50	0		FFAARM
O=C([O-])c1cnn2c1nc(-c1ccc3c(c1)OCO3)cc2C(F)(F)F	ZINC000005771038	506456132	/nfs/dbraw/zinc/45/61/32/506456132.db2.gz	MFTKXLWIOZZZDD-UHFFFAOYSA-N	-1	0	351.240	2.842	50	0		FFAARM
CN1c2ccc([N-]S(=O)(=O)c3cccs3)cc2OCC(C)(C)C1=O	ZINC000009165441	506684820	/nfs/dbraw/zinc/68/48/20/506684820.db2.gz	UXOKQFGLANCETD-UHFFFAOYSA-N	-1	0	366.464	2.930	50	0		FFAARM
CC1(C)COc2ccc([N-]S(=O)(=O)c3cccs3)cc2NC1=O	ZINC000009173176	506685439	/nfs/dbraw/zinc/68/54/39/506685439.db2.gz	BZWBMZCBCLFBCO-UHFFFAOYSA-N	-1	0	352.437	2.906	50	0		FFAARM
Cc1cc(C)cc(OCC(=O)N(C)Cc2nc(=O)c3sccc3[n-]2)c1	ZINC000010720973	506751723	/nfs/dbraw/zinc/75/17/23/506751723.db2.gz	KQHKKCBGDUFPLB-UHFFFAOYSA-N	-1	0	357.435	2.639	50	0		FFAARM
CCN1C[C@@H](CN(C)Cc2nc(=O)c3sccc3[n-]2)Oc2ccccc21	ZINC000012526679	506872550	/nfs/dbraw/zinc/87/25/50/506872550.db2.gz	CQHFSISWUXOPBS-CYBMUJFWSA-N	-1	0	370.478	2.704	50	0		FFAARM
COc1ccccc1[C@@H](C)NC(=O)COc1ccc(C(=O)[O-])cc1OC	ZINC000013420245	506941780	/nfs/dbraw/zinc/94/17/80/506941780.db2.gz	GJTQMQOPHMXKRJ-GFCCVEGCSA-N	-1	0	359.378	2.658	50	0		FFAARM
CS(=O)(=O)[N-]c1nc2ccc(NC(=O)Cc3cccs3)cc2s1	ZINC000015861978	507065027	/nfs/dbraw/zinc/06/50/27/507065027.db2.gz	GFJQDWLOGXPRSO-UHFFFAOYSA-N	-1	0	367.477	2.911	50	0		FFAARM
Cc1ccc(C(=O)Nc2ccc(S(=O)(=O)[N-]c3ncccn3)cc2)s1	ZINC000016024994	507070281	/nfs/dbraw/zinc/07/02/81/507070281.db2.gz	FUVZXFUUMCVBGD-UHFFFAOYSA-N	-1	0	374.447	2.900	50	0		FFAARM
O=C1[N-]N(c2ccc(Br)cc2)C(=O)/C1=C\c1ccc(O)cc1	ZINC000017242869	507119012	/nfs/dbraw/zinc/11/90/12/507119012.db2.gz	PBWCUPGEZOQYSN-ZROIWOOFSA-N	-1	0	359.179	2.616	50	0		FFAARM
O=S(=O)([N-]CCNc1ncc(C(F)(F)F)cc1Cl)C(F)(F)F	ZINC000020366446	507218250	/nfs/dbraw/zinc/21/82/50/507218250.db2.gz	HOYFEYGNUAXKAD-UHFFFAOYSA-N	-1	0	371.690	2.605	50	0		FFAARM
C[C@H](NC(=O)Cc1csc(-c2cccc(Br)c2)n1)C(=O)[O-]	ZINC000020734036	507233763	/nfs/dbraw/zinc/23/37/63/507233763.db2.gz	MJGHWHFWSSFKAG-QMMMGPOBSA-N	-1	0	369.240	2.704	50	0		FFAARM
CCc1ccc(-n2c(=O)c3[n-][nH]n(-c4cccc(OC)c4)c=3c2=O)cc1	ZINC000023125650	507330770	/nfs/dbraw/zinc/33/07/70/507330770.db2.gz	WPMHZJKBDGKCQS-DLBZAZTESA-N	-1	0	350.378	2.755	50	0		FFAARM
COCCNC(=O)c1ccccc1[N-]S(=O)(=O)c1ccc(Cl)s1	ZINC000024347489	507403938	/nfs/dbraw/zinc/40/39/38/507403938.db2.gz	GHQYANYSCBXMJK-UHFFFAOYSA-N	-1	0	374.871	2.579	50	0		FFAARM
O=C(NC[C@@H]1CCCO1)c1nn(-c2ccccc2C(F)(F)F)cc1[O-]	ZINC000060617211	507566993	/nfs/dbraw/zinc/56/69/93/507566993.db2.gz	MQPUBVBVGMXDRZ-JTQLQIEISA-N	-1	0	355.316	2.506	50	0		FFAARM
O=C([O-])c1ccccc1[C@@H]1CCN(C(=O)c2ccc(-n3cnnc3)cc2)C1	ZINC000072140405	507757151	/nfs/dbraw/zinc/75/71/51/507757151.db2.gz	UYOWOBOLEAXFKE-OAHLLOKOSA-N	-1	0	362.389	2.595	50	0		FFAARM
Cc1noc(CCCNC(=O)c2cc(Cl)cc(Br)c2[O-])n1	ZINC000072311904	507775020	/nfs/dbraw/zinc/77/50/20/507775020.db2.gz	IONIQLXQIBNUHJ-UHFFFAOYSA-N	-1	0	374.622	2.862	50	0		FFAARM
Cc1cc(C)c(C)c2occ(CC(=O)N3CCc4[nH]cnc4[C@@H]3C(=O)[O-])c21	ZINC000072428282	507788923	/nfs/dbraw/zinc/78/89/23/507788923.db2.gz	BGNQWBJQVFVSPK-GOSISDBHSA-N	-1	0	367.405	2.834	50	0		FFAARM
O=C([O-])[C@@H]1c2nc[nH]c2CCN1C(=O)c1ccc(Oc2ccccc2)o1	ZINC000072470795	507795649	/nfs/dbraw/zinc/79/56/49/507795649.db2.gz	GRLCOTNXKRFEBJ-INIZCTEOSA-N	-1	0	353.334	2.619	50	0		FFAARM
CCOc1ccc(-c2ccnc(N(C)Cc3ccon3)n2)cc1C(=O)[O-]	ZINC000072475493	507795907	/nfs/dbraw/zinc/79/59/07/507795907.db2.gz	AKJVHLVGKIYPMX-UHFFFAOYSA-N	-1	0	354.366	2.865	50	0		FFAARM
O=C([O-])C[C@@H]1COCCN1C(=O)c1ccc(CSc2ccccc2)o1	ZINC000072475646	507796182	/nfs/dbraw/zinc/79/61/82/507796182.db2.gz	DHAWBDRLWKJYPE-CYBMUJFWSA-N	-1	0	361.419	2.888	50	0		FFAARM
O=C1OCCN1c1cccc([N-]S(=O)(=O)c2ccc(F)cc2F)c1	ZINC000031720113	507821283	/nfs/dbraw/zinc/82/12/83/507821283.db2.gz	DJWKTZHPLVIQST-UHFFFAOYSA-N	-1	0	354.334	2.722	50	0		FFAARM
Cc1nn(C)c(C(=O)N2C[C@@H](c3ccccc3C)[C@H](C(=O)[O-])C2)c1Cl	ZINC000091620046	507996284	/nfs/dbraw/zinc/99/62/84/507996284.db2.gz	DVWZJCZNWOUADO-UONOGXRCSA-N	-1	0	361.829	2.631	50	0		FFAARM
Cc1c(Cl)c(C(=O)N2C[C@@H](c3ccccc3C)[C@H](C(=O)[O-])C2)nn1C	ZINC000091625735	507997920	/nfs/dbraw/zinc/99/79/20/507997920.db2.gz	WBHDZABTODJQKV-UONOGXRCSA-N	-1	0	361.829	2.631	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)CCn2cnc3ccccc32)C[C@H]1c1ccccc1	ZINC000091663866	508000266	/nfs/dbraw/zinc/00/02/66/508000266.db2.gz	FPUZHNGVSXLWAB-DLBZAZTESA-N	-1	0	363.417	2.753	50	0		FFAARM
COc1cc([C@@H]2SC(C)(C)[C@@H](C(=O)[O-])N2C(C)=O)cc(OC)c1OC	ZINC000075251821	508092297	/nfs/dbraw/zinc/09/22/97/508092297.db2.gz	NPCUMDXXMDXQSI-CABCVRRESA-N	-1	0	369.439	2.538	50	0		FFAARM
CC1=C(C(=O)N2CCC[C@H](c3cccc(C(=O)[O-])c3)C2)SC2=NCCN12	ZINC000095367304	508177424	/nfs/dbraw/zinc/17/74/24/508177424.db2.gz	ISUCGDGAPOPFQP-HNNXBMFYSA-N	-1	0	371.462	2.741	50	0		FFAARM
O=C([O-])[C@@H]1CCCN1CC(=O)NCCC(c1ccccc1)c1ccccc1	ZINC000095428046	508184984	/nfs/dbraw/zinc/18/49/84/508184984.db2.gz	LFMHPTDMEKHSEV-FQEVSTJZSA-N	-1	0	366.461	2.874	50	0		FFAARM
C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N1CCC[C@@H](c2nnn[n-]2)C1	ZINC000095432774	508185005	/nfs/dbraw/zinc/18/50/05/508185005.db2.gz	BOFLRDAYHMWEKU-UONOGXRCSA-N	-1	0	357.458	2.671	50	0		FFAARM
COc1cccc2c1OC[C@]1(C(=O)[O-])CN(C(=O)c3cccc(F)c3)C[C@H]21	ZINC000095524334	508195688	/nfs/dbraw/zinc/19/56/88/508195688.db2.gz	QSRSEAKXBDCSIO-FOIQADDNSA-N	-1	0	371.364	2.537	50	0		FFAARM
COc1ccc(CNC(=O)[C@@H](C)Oc2ccc(F)c(F)c2)cc1C(=O)[O-]	ZINC000095969564	508199909	/nfs/dbraw/zinc/19/99/09/508199909.db2.gz	BLEPQCRJRYLUJA-SNVBAGLBSA-N	-1	0	365.332	2.755	50	0		FFAARM
COC(=O)C[C@@H](c1ccc(SC)cc1)c1c([O-])nc2ccccn2c1=O	ZINC000096118070	508206768	/nfs/dbraw/zinc/20/67/68/508206768.db2.gz	ZHEWSGBLHBZAEJ-AWEZNQCLSA-N	-1	0	370.430	2.817	50	0		FFAARM
C[C@@H](Oc1cccc(/C=C\C(=O)c2ccc3c(c2)NC(=O)CO3)c1)C(=O)[O-]	ZINC000096291707	508213030	/nfs/dbraw/zinc/21/30/30/508213030.db2.gz	FDCFKRULMPFQBH-SMYYYNMVSA-N	-1	0	367.357	2.766	50	0		FFAARM
Cc1ccc(NC(=O)c2c[nH]nc2S(=O)(=O)[N-]c2ccccc2)cc1F	ZINC000096361064	508213440	/nfs/dbraw/zinc/21/34/40/508213440.db2.gz	NFGFLHONANXQBP-UHFFFAOYSA-N	-1	0	374.397	2.910	50	0		FFAARM
O=c1c2[n-][nH]n(-c3cccc(F)c3)c=2c(=O)n1-c1ccc2c(c1)CCC2	ZINC000096500405	508214600	/nfs/dbraw/zinc/21/46/00/508214600.db2.gz	KWFFTOLQYSTKOC-SJORKVTESA-N	-1	0	350.353	2.812	50	0		FFAARM
COc1ccc(S(=O)(=O)c2c[n-]c3c(F)cccc3c2=O)cc1OC	ZINC000096511488	508214629	/nfs/dbraw/zinc/21/46/29/508214629.db2.gz	GIBITLJOGFKFCN-UHFFFAOYSA-N	-1	0	363.366	2.930	50	0		FFAARM
O=c1c2[n-][nH]n(-c3ccc(F)cc3)c=2c(=O)n1-c1ccc2c(c1)CCC2	ZINC000096500408	508214739	/nfs/dbraw/zinc/21/47/39/508214739.db2.gz	AOJNWZILBPWJHN-IRXDYDNUSA-N	-1	0	350.353	2.812	50	0		FFAARM
CSCCc1nc(-c2cc(C3CC3)nc3onc(C)c32)n(CC(=O)[O-])n1	ZINC000097631886	508227582	/nfs/dbraw/zinc/22/75/82/508227582.db2.gz	CADADVHHPBRQOJ-UHFFFAOYSA-N	-1	0	373.438	2.657	50	0		FFAARM
CCOc1ccc(S(=O)(=O)[N-]C(=O)/C=C\c2ccc3c(c2)CCO3)cc1	ZINC000098042591	508232787	/nfs/dbraw/zinc/23/27/87/508232787.db2.gz	OWWGGOKKIBPAIA-WMZJFQQLSA-N	-1	0	373.430	2.539	50	0		FFAARM
O=c1cc(CSc2nnnn2-c2ccccc2)[n-]n1-c1ccccc1	ZINC000100070089	508238089	/nfs/dbraw/zinc/23/80/89/508238089.db2.gz	WEOJQYSASGGRLU-UHFFFAOYSA-N	-1	0	350.407	2.846	50	0		FFAARM
CCc1ccc(-n2c(=O)c3[n-][nH]n(Cc4cccc(OC)c4)c=3c2=O)cc1	ZINC000101168037	508240845	/nfs/dbraw/zinc/24/08/45/508240845.db2.gz	FLHXHDCMVVSUNQ-ZWKOTPCHSA-N	-1	0	364.405	2.751	50	0		FFAARM
CCOc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccccc4C)c=3c2=O)cc1	ZINC000101417737	508241413	/nfs/dbraw/zinc/24/14/13/508241413.db2.gz	VIOVSNWSXDKUJK-ROUUACIJSA-N	-1	0	364.405	2.887	50	0		FFAARM
CCn1c(=O)c2ccc(C(=O)NCCc3ccccc3F)cc2[n-]c1=S	ZINC000102178176	508269179	/nfs/dbraw/zinc/26/91/79/508269179.db2.gz	JGWWZWGPABKARP-UHFFFAOYSA-N	-1	0	371.437	2.817	50	0		FFAARM
Cc1ccc(C(=O)Nc2ccc(C(=O)N3CCC(C(=O)[O-])CC3)cc2)o1	ZINC000124775459	508883012	/nfs/dbraw/zinc/88/30/12/508883012.db2.gz	KQZVCZIQIKVESW-UHFFFAOYSA-N	-1	0	356.378	2.777	50	0		FFAARM
CN(C)c1ccccc1N(C)S(=O)(=O)c1cc(C(=O)[O-])cc(F)c1F	ZINC000160310721	508967998	/nfs/dbraw/zinc/96/79/98/508967998.db2.gz	FSXUGYOVOXSMPM-UHFFFAOYSA-N	-1	0	370.377	2.554	50	0		FFAARM
COc1cccc(CN(C)Cc2ccc3nonc3c2)c1O[C@H](C)C(=O)[O-]	ZINC000215196766	509243784	/nfs/dbraw/zinc/24/37/84/509243784.db2.gz	DFJHYMBYHIQWKF-GFCCVEGCSA-N	-1	0	371.393	2.715	50	0		FFAARM
Cn1cc(Br)cc1C(=O)N1[C@H](C(=O)[O-])C[C@H]2CCCC[C@@H]21	ZINC000220942008	509304559	/nfs/dbraw/zinc/30/45/59/509304559.db2.gz	IWTBQHFADKVOPH-CDMKHQONSA-N	-1	0	355.232	2.646	50	0		FFAARM
O=C([O-])CCC(=O)N1N=C(c2ccc[nH]2)C[C@H]1c1cnc2ccccc2n1	ZINC000225504446	509374140	/nfs/dbraw/zinc/37/41/40/509374140.db2.gz	LRLORWYUUNUHQA-KRWDZBQOSA-N	-1	0	363.377	2.500	50	0		FFAARM
CC(C)(CC(=O)N[C@H]1CCN(c2ccccc2Br)C1)C(=O)[O-]	ZINC000236796212	509504202	/nfs/dbraw/zinc/50/42/02/509504202.db2.gz	JIPUVQBDXRFVLA-NSHDSACASA-N	-1	0	369.259	2.645	50	0		FFAARM
Cc1cc(C(=O)N[C@](C)(COc2ccccc2)C(=O)[O-])nn1C(C)(C)C	ZINC000170671719	509711443	/nfs/dbraw/zinc/71/14/43/509711443.db2.gz	LFUHGTDQDZJZJM-LJQANCHMSA-N	-1	0	359.426	2.599	50	0		FFAARM
CC(C)(C(=O)[O-])n1cc(NC(=O)c2ccc(N3CCCCCC3)nc2)cn1	ZINC000192990020	509727825	/nfs/dbraw/zinc/72/78/25/509727825.db2.gz	CSXJJNVSQYXITH-UHFFFAOYSA-N	-1	0	371.441	2.731	50	0		FFAARM
O=C([O-])CCN(C(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1)C1CCOCC1	ZINC000238068903	509812563	/nfs/dbraw/zinc/81/25/63/509812563.db2.gz	BCNJWUBNIBODFL-JKSUJKDBSA-N	-1	0	351.830	2.926	50	0		FFAARM
Cc1nc(C)n(-c2ccc(C(=O)N3[C@@H]4CCCC[C@H]4C[C@H]3C(=O)[O-])cc2)n1	ZINC000252510663	509847426	/nfs/dbraw/zinc/84/74/26/509847426.db2.gz	BCRWEPCBZUZZOZ-JQHSSLGASA-N	-1	0	368.437	2.742	50	0		FFAARM
CC[C@@H](C)[C@@H](NC(=O)CCc1nc(-c2cccc3[nH]ccc32)no1)C(=O)[O-]	ZINC000252552897	509852376	/nfs/dbraw/zinc/85/23/76/509852376.db2.gz	VEWGJRXPIOULQD-PIGZYNQJSA-N	-1	0	370.409	2.766	50	0		FFAARM
O=C(N[C@@H](c1cccs1)[C@H]1C[C@@H](O)C1)c1[n-]c(=O)nc2ccccc21	ZINC000253534788	509885932	/nfs/dbraw/zinc/88/59/32/509885932.db2.gz	CXZIYHXVSXXAFN-JRPNMDOOSA-N	-1	0	355.419	2.639	50	0		FFAARM
O=C([O-])[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1scnc1C1CC1	ZINC000190771948	510335326	/nfs/dbraw/zinc/33/53/26/510335326.db2.gz	TUKLDJSMSVYWTI-AWEZNQCLSA-N	-1	0	355.419	2.928	50	0		FFAARM
O=S(=O)([N-]c1nnc(CC2CCCCC2)o1)c1ccc2c(c1)CCO2	ZINC000194897941	510581420	/nfs/dbraw/zinc/58/14/20/510581420.db2.gz	TZFXRGSUHLMRMK-UHFFFAOYSA-N	-1	0	363.439	2.928	50	0		FFAARM
C[C@@H]1Cc2cc(S(=O)(=O)[N-]c3nnc(CC4CCCC4)o3)ccc2O1	ZINC000194901616	510582854	/nfs/dbraw/zinc/58/28/54/510582854.db2.gz	UXWIIWNZBTYLNX-LLVKDONJSA-N	-1	0	363.439	2.927	50	0		FFAARM
O=C([O-])Cn1ccc([C@@H]2CCCN(C(=O)CCCc3ccc(F)cc3)C2)n1	ZINC000426361895	513915152	/nfs/dbraw/zinc/91/51/52/513915152.db2.gz	FRHQSBJYDSDOQU-MRXNPFEDSA-N	-1	0	373.428	2.836	50	0		FFAARM
O=C([O-])C1(NC(=O)c2ccc(CN3CCc4ccccc4C3)o2)CCC1	ZINC000426549034	513977430	/nfs/dbraw/zinc/97/74/30/513977430.db2.gz	AVUCBTVIGMILFT-UHFFFAOYSA-N	-1	0	354.406	2.575	50	0		FFAARM
Cc1ccc(C)c(CC(=O)N2CCC[C@@H](c3ccn(CC(=O)[O-])n3)C2)c1	ZINC000426563509	513981897	/nfs/dbraw/zinc/98/18/97/513981897.db2.gz	SAVFAUQJXPHNQW-MRXNPFEDSA-N	-1	0	355.438	2.533	50	0		FFAARM
CN(Cc1cc(C(C)(C)C)n[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)[O-]	ZINC000426685294	514015130	/nfs/dbraw/zinc/01/51/30/514015130.db2.gz	LWTKEMWZJPXOAZ-HNNXBMFYSA-N	-1	0	358.442	2.545	50	0		FFAARM
CC(C)c1cnc(-c2cccc(C(=O)NCCc3n[n-]c(=N)s3)c2)nc1	ZINC000584892088	518526815	/nfs/dbraw/zinc/52/68/15/518526815.db2.gz	NBKNNDJXEQBPKJ-UHFFFAOYSA-N	-1	0	368.466	2.673	50	0		FFAARM
CCOc1cc(C(=O)N[C@@H]2CCc3ccccc32)ccc1OCC(=O)[O-]	ZINC000268933948	520664878	/nfs/dbraw/zinc/66/48/78/520664878.db2.gz	ZSUVFUHRPNNEKU-MRXNPFEDSA-N	-1	0	355.390	2.966	50	0		FFAARM
O=C([O-])[C@@H]1CC[C@@H](c2ccccc2)N1C(=O)c1cnc(C(F)(F)F)nc1	ZINC000621589239	522953010	/nfs/dbraw/zinc/95/30/10/522953010.db2.gz	RDKCGTKSJGEPIG-STQMWFEESA-N	-1	0	365.311	2.926	50	0		FFAARM
O=C([O-])c1ccc2nc(/C=C\c3cn(C[C@@H]4CCOC4)nn3)ccc2c1	ZINC000630950306	523267989	/nfs/dbraw/zinc/26/79/89/523267989.db2.gz	CFULCOVZJVKCBC-ZFDPJTLLSA-N	-1	0	350.378	2.731	50	0		FFAARM
COc1ccc(CCC(=O)N2Cc3ccccc3C[C@H]2C(=O)[O-])cc1F	ZINC000268935671	523921999	/nfs/dbraw/zinc/92/19/99/523921999.db2.gz	GDTXCQKSULLEAG-KRWDZBQOSA-N	-1	0	357.381	2.805	50	0		FFAARM
C[C@@H]1CCc2c(sc(NC(=O)[C@@H]3CCCC[C@H]3C(=O)[O-])c2C(N)=O)C1	ZINC000239402965	524723556	/nfs/dbraw/zinc/72/35/56/524723556.db2.gz	RIVQMHSILJEIBU-GMTAPVOTSA-N	-1	0	364.467	2.801	50	0		FFAARM
O=C([O-])C[C@H]1CN(C(=O)CCc2cccc(OC3CCCC3)c2)CCO1	ZINC000269045024	527636180	/nfs/dbraw/zinc/63/61/80/527636180.db2.gz	SCTIQZLWVWUCGV-SFHVURJKSA-N	-1	0	361.438	2.643	50	0		FFAARM
COc1ccc(/C=C/C(=O)[O-])cc1S(=O)(=O)N1CCCc2ccccc21	ZINC000001171022	536594163	/nfs/dbraw/zinc/59/41/63/536594163.db2.gz	QYDIWGSKJVKXPF-PKNBQFBNSA-N	-1	0	373.430	2.935	50	0		FFAARM
Cc1ccnc([N-]S(=O)(=O)c2cc(C)c(Br)cc2C)c1	ZINC000036638861	571133482	/nfs/dbraw/zinc/13/34/82/571133482.db2.gz	CSGZUULODDBSMJ-UHFFFAOYSA-N	-1	0	355.257	3.570	50	0		FFAARM
Cc1nn(-c2ccc(C)cc2)c(C)c1S(=O)(=O)[N-]c1ccc(C)cn1	ZINC000064947001	571134880	/nfs/dbraw/zinc/13/48/80/571134880.db2.gz	NPEVGQJWOSKDDL-UHFFFAOYSA-N	-1	0	356.451	3.302	50	0		FFAARM
O=S(=O)([N-]c1nccc2sccc21)c1cnn(C2CCOCC2)c1	ZINC000160906396	728926968	/nfs/dbraw/zinc/92/69/68/728926968.db2.gz	VQCFGZWTXBCYEO-UHFFFAOYSA-N	-1	0	364.452	2.645	50	0		FFAARM
O=C([O-])CNc1ccccc1C(=O)N1CCSC[C@H]1c1cccnc1	ZINC000065460849	728156731	/nfs/dbraw/zinc/15/67/31/728156731.db2.gz	GVIRREXDXVANBW-INIZCTEOSA-N	-1	0	357.435	2.508	50	0		FFAARM
Cc1n[nH]c(C)c1[C@H](NC(=O)CCc1nc2ccccc2s1)C(=O)[O-]	ZINC000067954621	728185909	/nfs/dbraw/zinc/18/59/09/728185909.db2.gz	MEFBWZWODYWTQV-INIZCTEOSA-N	-1	0	358.423	2.511	50	0		FFAARM
Cc1cc(C(=O)NC[C@H](CC(=O)[O-])c2ccc(Cl)cc2)c(=O)[nH]c1C	ZINC000095362988	728480436	/nfs/dbraw/zinc/48/04/36/728480436.db2.gz	JLEMRCOMIJTVCG-ZDUSSCGKSA-N	-1	0	362.813	2.633	50	0		FFAARM
Nc1ccc([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2)c(C(F)(F)F)c1	ZINC000325006864	729757979	/nfs/dbraw/zinc/75/79/79/729757979.db2.gz	ATJRXRPNWGQOFB-UHFFFAOYSA-N	-1	0	361.301	2.997	50	0		FFAARM
CCc1nc(N)sc1C(=O)N1CC[C@@H](Cc2ccc(C(=O)[O-])cc2)C1	ZINC000072473226	845555584	/nfs/dbraw/zinc/55/55/84/845555584.db2.gz	BMIWFSSJKMYRLQ-LBPRGKRZSA-N	-1	0	359.451	2.691	50	0		FFAARM
O=C([O-])[C@@H](NC(=O)[C@@H]1C[C@@H]1c1cccc(C(F)(F)F)c1)[C@@H]1CCCOC1	ZINC000262705298	939066962	/nfs/dbraw/zinc/06/69/62/939066962.db2.gz	AKOKVMLNINLOGP-NGFQHRJXSA-N	-1	0	371.355	2.805	50	0		FFAARM
COC(=O)CCCCC([O-])=C1C(=O)CC(C)(C)[C@@H](c2cc(C)no2)C1=O	ZINC000105304185	975847933	/nfs/dbraw/zinc/84/79/33/975847933.db2.gz	UYYRYVLWZLNLTI-IRXDYDNUSA-N	-1	0	363.410	2.553	50	0		FFAARM
Cc1ccc([N-]S(=O)(=O)c2cnn(C3CCOCC3)c2)c2cccnc12	ZINC000193127388	1001716630	/nfs/dbraw/zinc/71/66/30/1001716630.db2.gz	LEZZCJPECCOLAP-UHFFFAOYSA-N	-1	0	372.450	2.892	50	0		FFAARM
Cc1nc2ccccc2n1CCC(=O)N[C@H](Cc1ccccc1)C(=O)[O-]	ZINC000952988622	1011046204	/nfs/dbraw/zinc/04/62/04/1011046204.db2.gz	JWULTXOVHZADCJ-QGZVFWFLSA-N	-1	0	351.406	2.547	50	0		FFAARM
COc1ccc(CN2CCN(c3cc(C)cc(C)c3)C(=O)C2)cc1C(=O)[O-]	ZINC000072148579	1019827206	/nfs/dbraw/zinc/82/72/06/1019827206.db2.gz	LTXRGFWASRXOAY-UHFFFAOYSA-N	-1	0	368.433	2.859	50	0		FFAARM
COc1ccc2c(c1)[C@@H](C(=O)N[C@H](c1nnn[n-]1)c1ccccc1)CCC2	ZINC000655391592	1025208506	/nfs/dbraw/zinc/20/85/06/1025208506.db2.gz	XJQSOWDIHHFYCQ-WMZOPIPTSA-N	-1	0	363.421	2.534	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)C2(C(F)(F)F)CCOCC2)C[C@H]1c1ccccc1	ZINC000659149600	1025958443	/nfs/dbraw/zinc/95/84/43/1025958443.db2.gz	GOBMNMJMMWOVPW-UONOGXRCSA-N	-1	0	371.355	2.672	50	0		FFAARM
CN(C)c1cc(NC(=O)N2CCC(c3ccccc3C(=O)[O-])CC2)ncn1	ZINC000669504943	1027966817	/nfs/dbraw/zinc/96/68/17/1027966817.db2.gz	IMHKDWQTYGVHCB-UHFFFAOYSA-N	-1	0	369.425	2.652	50	0		FFAARM
CN(Cc1nc(=O)c2sccc2[n-]1)C(=O)C=Cc1cc(CO)cs1	ZINC001506418545	1059507293	/nfs/dbraw/zinc/50/72/93/1059507293.db2.gz	ZOPWROGMADUVMN-NSCUHMNNSA-N	-1	0	361.448	2.623	50	0		FFAARM
O=C(NCc1ccccc1F)c1c([O-])c2cccc3c2n(c1=O)CCC3	ZINC000001299767	203997701	/nfs/dbraw/zinc/99/77/01/203997701.db2.gz	YWEMDKSNCLENPM-UHFFFAOYSA-N	-1	0	352.365	2.722	50	0		FFAARM
COC(=O)[C@H](CC(=O)[O-])NC(=O)OCC1c2ccccc2-c2ccccc21	ZINC000002509858	204042817	/nfs/dbraw/zinc/04/28/17/204042817.db2.gz	UEUZUMRMWJUEMK-KRWDZBQOSA-N	-1	0	369.373	2.541	50	0		FFAARM
O=C([O-])C[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)c1ccc(F)cc1	ZINC000002634454	204048216	/nfs/dbraw/zinc/04/82/16/204048216.db2.gz	BBXNQFYDOZLGRX-CQSZACIVSA-N	-1	0	357.790	2.973	50	0		FFAARM
O=C([O-])c1ccccc1S[C@H]1CC(=O)N(c2ccc3c(c2)OCO3)C1=O	ZINC000002696649	204051578	/nfs/dbraw/zinc/05/15/78/204051578.db2.gz	GLVBTYQZFJNXBR-HNNXBMFYSA-N	-1	0	371.370	2.538	50	0		FFAARM
Cc1n[nH]c(C)c1S(=O)(=O)[N-]c1c(C)nn(Cc2ccccc2C)c1C	ZINC000002804321	204059807	/nfs/dbraw/zinc/05/98/07/204059807.db2.gz	PHANCZIRKJSILP-UHFFFAOYSA-N	-1	0	373.482	2.997	50	0		FFAARM
COc1ccc(Cc2nnc([N-]S(=O)(=O)c3ccccc3)s2)cc1	ZINC000002815983	204060776	/nfs/dbraw/zinc/06/07/76/204060776.db2.gz	QCXWBMZVLJCKHF-UHFFFAOYSA-N	-1	0	361.448	2.938	50	0	in-vitro	FFAARM
O=C([O-])CCCCCC[C@H]1C(=O)NC(=O)N1CC[C@H](O)C1CCCCC1	ZINC000003779983	204110548	/nfs/dbraw/zinc/11/05/48/204110548.db2.gz	ZIDQIOZJEJFMOH-HOTGVXAUSA-N	-1	0	368.474	2.663	50	0	in-vitro	FFAARM
COc1ccc([C@H](CC(=O)[O-])NC(=O)COc2ccc(C)cc2)cc1OC	ZINC000003626938	204109582	/nfs/dbraw/zinc/10/95/82/204109582.db2.gz	JQCVNOVDPXPNES-INIZCTEOSA-N	-1	0	373.405	2.723	50	0		FFAARM
O=C([O-])c1cc2n(n1)[C@H](C(F)(F)F)C[C@H](c1ccc3c(c1)OCO3)N2	ZINC000004664611	204153010	/nfs/dbraw/zinc/15/30/10/204153010.db2.gz	XLRYNLAQFRRTLC-PELKAZGASA-N	-1	0	355.272	2.970	50	0		FFAARM
O=C([O-])CCCCCC[C@@H]1C(=O)NC(=O)N1CC[C@H](O)C1CCCCC1	ZINC000004257978	204129509	/nfs/dbraw/zinc/12/95/09/204129509.db2.gz	ZIDQIOZJEJFMOH-CVEARBPZSA-N	-1	0	368.474	2.663	50	0	in-vitro	FFAARM
CCOc1ccc(N2C[C@@H](C(=O)Nc3cccc(C(=O)[O-])c3)CC2=O)cc1	ZINC000004385201	204136445	/nfs/dbraw/zinc/13/64/45/204136445.db2.gz	MGKFCYOYPKXYGZ-AWEZNQCLSA-N	-1	0	368.389	2.775	50	0		FFAARM
COc1cccc([C@@H]2[C@H](C(=O)[O-])c3cc(OC)c(OC)cc3C(=O)N2C)c1	ZINC000004563431	204147178	/nfs/dbraw/zinc/14/71/78/204147178.db2.gz	OBUCYFWXYBYFPV-QZTJIDSGSA-N	-1	0	371.389	2.708	50	0		FFAARM
COc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc2c(c1)CC(=O)N2	ZINC000005403035	204207174	/nfs/dbraw/zinc/20/71/74/204207174.db2.gz	NQNLLUOLZREELC-UHFFFAOYSA-N	-1	0	352.799	2.644	50	0		FFAARM
CCOc1ccccc1NC(=O)[C@H](Cc1ccc(OC)cc1)c1nnn[n-]1	ZINC000005444743	204209201	/nfs/dbraw/zinc/20/92/01/204209201.db2.gz	ACLISOJUKUBDAC-OAHLLOKOSA-N	-1	0	367.409	2.572	50	0		FFAARM
COc1ccc(C[C@@H](C(=O)Nc2ccc(C)cc2C)c2nnn[n-]2)cc1	ZINC000005489129	204211056	/nfs/dbraw/zinc/21/10/56/204211056.db2.gz	CNDUFYMDOLIOKC-MRXNPFEDSA-N	-1	0	351.410	2.790	50	0		FFAARM
Cc1cc(C)cc(NS(=O)(=O)c2ccc(NC(=O)/C=C/C(=O)[O-])cc2)c1	ZINC000005557707	204215097	/nfs/dbraw/zinc/21/50/97/204215097.db2.gz	SSZNEZSSPXKHTK-BQYQJAHWSA-N	-1	0	374.418	2.684	50	0		FFAARM
CCc1ccc(C(=O)COC(=O)c2ccccc2[N-]S(C)(=O)=O)cc1	ZINC000005573740	204216338	/nfs/dbraw/zinc/21/63/38/204216338.db2.gz	KHSUJPQVKXIVMT-UHFFFAOYSA-N	-1	0	361.419	2.660	50	0		FFAARM
CC(=O)c1[n-]n(-c2ccc(C)cc2)c2c(O)n(-c3ccc(C)cc3)c(=O)c1-2	ZINC000004862891	204170691	/nfs/dbraw/zinc/17/06/91/204170691.db2.gz	DFPRLVSTULKADY-MJGOQNOKSA-N	-1	0	361.401	2.627	50	0		FFAARM
O=C([O-])C[C@H](NCc1ccco1)C(=O)Nc1ccccc1Br	ZINC000004978274	204181954	/nfs/dbraw/zinc/18/19/54/204181954.db2.gz	ZKHOKALYEIGHCA-ZDUSSCGKSA-N	-1	0	367.199	2.614	50	0		FFAARM
O=C([O-])C[C@@H](NC1=NS(=O)(=O)c2ccccc21)c1ccc(Cl)cc1	ZINC000006787266	204269961	/nfs/dbraw/zinc/26/99/61/204269961.db2.gz	YMINENMWBIFFFZ-CYBMUJFWSA-N	-1	0	364.810	2.595	50	0		FFAARM
COc1ccc([N-]S(=O)(=O)c2ccccc2Br)cc1O	ZINC000009376024	204366339	/nfs/dbraw/zinc/36/63/39/204366339.db2.gz	AHVSPGCLYZYLRS-UHFFFAOYSA-N	-1	0	358.213	2.964	50	0		FFAARM
O=C([O-])c1cccc(CN2C(=S)N=NC2c2ccc3c(c2)OCO3)c1	ZINC000012322889	204451897	/nfs/dbraw/zinc/45/18/97/204451897.db2.gz	BEHWLOCQOSHYBO-UHFFFAOYSA-N	-1	0	355.375	2.709	50	0		FFAARM
CCOC(=O)c1c(CC)[nH]nc1S(=O)(=O)[N-]c1cccc(CC)c1	ZINC000033256062	204961670	/nfs/dbraw/zinc/96/16/70/204961670.db2.gz	ARIXFMGXBRCJNN-UHFFFAOYSA-N	-1	0	351.428	2.512	50	0		FFAARM
CCOc1ccc(S(=O)(=O)N2c3ccccc3C[C@@H]2C)cc1C(=O)[O-]	ZINC000071837540	205030777	/nfs/dbraw/zinc/03/07/77/205030777.db2.gz	UEQNUOSRKRPRIX-LBPRGKRZSA-N	-1	0	361.419	2.923	50	0		FFAARM
COc1ccc(S(=O)(=O)[N-]c2cnc(N3CCCC3)nc2)cc1Cl	ZINC000077196701	205037830	/nfs/dbraw/zinc/03/78/30/205037830.db2.gz	ZKJNSUHSAGHFGW-UHFFFAOYSA-N	-1	0	368.846	2.540	50	0		FFAARM
COc1cc2c(cc1OC)[C@@H](CC(=O)[O-])N(C(=O)c1ccoc1C)CC2	ZINC000299742652	205125214	/nfs/dbraw/zinc/12/52/14/205125214.db2.gz	ICAGESDFAONBKQ-OAHLLOKOSA-N	-1	0	359.378	2.820	50	0		FFAARM
Cc1cc(O[C@H](C)C(=O)N(CCC(=O)[O-])C2CCOCC2)ccc1Cl	ZINC000299747217	205126402	/nfs/dbraw/zinc/12/64/02/205126402.db2.gz	CKCNWGVOXGUAFV-CYBMUJFWSA-N	-1	0	369.845	2.898	50	0		FFAARM
CCOc1cc(-c2ccccc2)sc1C(=O)N1CCO[C@H](C(=O)[O-])C1	ZINC000299747151	205126469	/nfs/dbraw/zinc/12/64/69/205126469.db2.gz	CDJVCIRWLPQQBS-AWEZNQCLSA-N	-1	0	361.419	2.739	50	0		FFAARM
CN(Cc1ccc(C(=O)[O-])cc1)C(=O)CCc1ccc2c(c1)OCCO2	ZINC000299745712	205127814	/nfs/dbraw/zinc/12/78/14/205127814.db2.gz	SBHJQESHJVWHEV-UHFFFAOYSA-N	-1	0	355.390	2.747	50	0		FFAARM
O=C([O-])C[C@H]1COCCN1C(=O)c1cccc(NCc2ccc(F)cc2)c1	ZINC000055061028	205205723	/nfs/dbraw/zinc/20/57/23/205205723.db2.gz	MZOZVIBXZBSBTM-SFHVURJKSA-N	-1	0	372.396	2.754	50	0		FFAARM
CCC(CC)n1c(=O)n(Cc2nnc(C3CC3)o2)c2cc(C(=O)[O-])cnc21	ZINC000055225079	205211551	/nfs/dbraw/zinc/21/15/51/205211551.db2.gz	FQKGZUSHQHPWNE-UHFFFAOYSA-N	-1	0	371.397	2.566	50	0		FFAARM
O=C([O-])c1cc(S(=O)(=O)Nc2ccccc2Cl)cc2c1OCCO2	ZINC000057115576	205235043	/nfs/dbraw/zinc/23/50/43/205235043.db2.gz	ZYONITVSNIAZLY-UHFFFAOYSA-N	-1	0	369.782	2.610	50	0		FFAARM
Cc1cccc(C)c1[N-]S(=O)(=O)c1cc(-c2ccc(=O)[nH]n2)cs1	ZINC000065119293	205317835	/nfs/dbraw/zinc/31/78/35/205317835.db2.gz	JDHLTFSQLOPRML-UHFFFAOYSA-N	-1	0	361.448	2.916	50	0		FFAARM
CCn1nc(-c2csc(S(=O)(=O)[N-]c3ccccc3)c2)ccc1=O	ZINC000065129068	205318603	/nfs/dbraw/zinc/31/86/03/205318603.db2.gz	JAJBQNCVBZDYHQ-UHFFFAOYSA-N	-1	0	361.448	2.793	50	0		FFAARM
CSc1cccc([N-]S(=O)(=O)c2c(C)nc3sc(C)nn32)c1	ZINC000065183622	205322150	/nfs/dbraw/zinc/32/21/50/205322150.db2.gz	XJVVAFNGMBTIMQ-UHFFFAOYSA-N	-1	0	354.482	2.930	50	0		FFAARM
C[C@H](NC(=O)CSc1nc2[nH]c(=O)cc([O-])c2s1)c1ccccc1	ZINC000065362041	205337854	/nfs/dbraw/zinc/33/78/54/205337854.db2.gz	BNZQAEVLJBQKMH-VIFPVBQESA-N	-1	0	361.448	2.660	50	0		FFAARM
Cc1cccc(-c2ccc(C(=O)N3CCn4nc(C(=O)[O-])cc4C3)o2)c1	ZINC000065374057	205341107	/nfs/dbraw/zinc/34/11/07/205341107.db2.gz	JUBMEPRVGMOUGI-UHFFFAOYSA-N	-1	0	351.362	2.806	50	0		FFAARM
O=C([O-])c1cc([C@@H]2CC(=O)Nc3cc(N4CCOC4=O)ccc32)ccc1O	ZINC000065380791	205342029	/nfs/dbraw/zinc/34/20/29/205342029.db2.gz	VWMUSVYUBJSAQP-ZDUSSCGKSA-N	-1	0	368.345	2.521	50	0		FFAARM
O=C([O-])CSc1nnc(Cc2c[nH]c3ccccc23)n1-c1cccnc1	ZINC000067855649	205398004	/nfs/dbraw/zinc/39/80/04/205398004.db2.gz	NBCBRRZRMXIPST-UHFFFAOYSA-N	-1	0	365.418	2.911	50	0		FFAARM
O=C([O-])c1cc(C2=CCCCC2)cc(S(=O)(=O)NC[C@H]2CCCO2)c1	ZINC000071770976	205446747	/nfs/dbraw/zinc/44/67/47/205446747.db2.gz	NJKSDPKTGPPKAD-MRXNPFEDSA-N	-1	0	365.451	2.800	50	0		FFAARM
CC1(C)[C@H](C(=O)[O-])[C@H]1C(=O)Nc1cccc(C(=O)Nc2ccccn2)c1	ZINC000071285788	205425050	/nfs/dbraw/zinc/42/50/50/205425050.db2.gz	ZGQUQGRADZIJNE-GJZGRUSLSA-N	-1	0	353.378	2.629	50	0		FFAARM
Cc1n[nH]c(C)c1CCCNc1nccc(-c2cc(C(=O)[O-])ccn2)n1	ZINC000072424519	205540424	/nfs/dbraw/zinc/54/04/24/205540424.db2.gz	NQKKCEUVYCIYNR-UHFFFAOYSA-N	-1	0	352.398	2.621	50	0		FFAARM
COc1cc(C(=O)Nc2cc(C(=O)[O-])ccc2F)c([N+](=O)[O-])cc1OC	ZINC000095349596	205723137	/nfs/dbraw/zinc/72/31/37/205723137.db2.gz	SGQYUBBXVCLRDO-UHFFFAOYSA-N	-1	0	364.285	2.702	50	0		FFAARM
O=C([O-])c1ccc(OCCNC(=O)Cc2coc(-c3ccccc3)n2)cc1	ZINC000095464499	205761066	/nfs/dbraw/zinc/76/10/66/205761066.db2.gz	XHOQCPZVTPFGTG-UHFFFAOYSA-N	-1	0	366.373	2.778	50	0		FFAARM
CC(C)Cn1c2ccccc2c([O-])c(C(=O)NCc2ccccn2)c1=O	ZINC000100670473	205946469	/nfs/dbraw/zinc/94/64/69/205946469.db2.gz	PVXZFYTYJYJTMD-UHFFFAOYSA-N	-1	0	351.406	2.688	50	0		FFAARM
C[C@H](CCc1ccccc1)NC(=O)c1ccc2c(c1)[n-]c(=S)n(C)c2=O	ZINC000102176351	205970642	/nfs/dbraw/zinc/97/06/42/205970642.db2.gz	AGONZKHSEBBNLW-CYBMUJFWSA-N	-1	0	367.474	2.973	50	0		FFAARM
CC[C@H](C)[C@H](NC(=O)c1ccc(CN2C[C@@H](C)O[C@H](C)C2)cc1)C(=O)[O-]	ZINC000236990662	206028013	/nfs/dbraw/zinc/02/80/13/206028013.db2.gz	LYYQMWIQKAKXBA-BORJPKMPSA-N	-1	0	362.470	2.525	50	0		FFAARM
C[C@H](CC(=O)N1CCO[C@H](CC(=O)[O-])C1)c1ccccc1C(F)(F)F	ZINC000237539154	206106301	/nfs/dbraw/zinc/10/63/01/206106301.db2.gz	YTXHGXRYPXMVLD-VXGBXAGGSA-N	-1	0	359.344	2.901	50	0		FFAARM
Cc1noc(-c2ccc(C(=O)N3[C@H](C(=O)[O-])C[C@H]4CCCC[C@@H]43)cc2)n1	ZINC000237745647	206106913	/nfs/dbraw/zinc/10/69/13/206106913.db2.gz	IERWBAYNEFRYMF-PMPSAXMXSA-N	-1	0	355.394	2.903	50	0		FFAARM
O=C([O-])[C@H]1Cc2ccccc2CN1C(=O)CCc1nc(C2CCCC2)no1	ZINC000238027498	206112826	/nfs/dbraw/zinc/11/28/26/206112826.db2.gz	NEPDBDAMDZOTOE-MRXNPFEDSA-N	-1	0	369.421	2.698	50	0		FFAARM
O=C([O-])[C@H]1CCCN1C(=O)C1CCN(c2nc3ccccc3s2)CC1	ZINC000238064012	206113009	/nfs/dbraw/zinc/11/30/09/206113009.db2.gz	BZMHHGOKGDMHSY-CQSZACIVSA-N	-1	0	359.451	2.588	50	0		FFAARM
O=C([O-])CN(C(=O)[C@H]1C[C@H]1c1cccc(C(F)(F)F)c1)C1CCOCC1	ZINC000238105714	206113522	/nfs/dbraw/zinc/11/35/22/206113522.db2.gz	LWCHWTCZLNNJBI-GJZGRUSLSA-N	-1	0	371.355	2.901	50	0		FFAARM
O=C([O-])[C@H]1CN(C(=O)c2ccc(-c3ccc(Cl)cc3)s2)CCO1	ZINC000238129750	206114836	/nfs/dbraw/zinc/11/48/36/206114836.db2.gz	OYSJFBJINICCKL-GFCCVEGCSA-N	-1	0	351.811	2.994	50	0		FFAARM
O=C([O-])CCN(Cc1cccc(F)c1F)C(=O)[C@H]1CC12CCOCC2	ZINC000238148599	206115413	/nfs/dbraw/zinc/11/54/13/206115413.db2.gz	CGGMKQGVIJMRSV-CYBMUJFWSA-N	-1	0	353.365	2.585	50	0		FFAARM
COc1cccc(C2(C(=O)NCc3nc(C(=O)[O-])cs3)CCCC2)c1	ZINC000124374217	206115728	/nfs/dbraw/zinc/11/57/28/206115728.db2.gz	VVQFTLIPVOXSKB-UHFFFAOYSA-N	-1	0	360.435	2.978	50	0		FFAARM
Cc1ccc2nc(C)c(C(=O)N(CCC(=O)[O-])C[C@H]3CCCO3)cc2c1	ZINC000237897731	206109739	/nfs/dbraw/zinc/10/97/39/206109739.db2.gz	UGMPHTRQAMDHEF-MRXNPFEDSA-N	-1	0	356.422	2.948	50	0		FFAARM
O=C([O-])CN(C(=O)c1cnc(-c2cccs2)s1)C1CCOCC1	ZINC000238114883	206112440	/nfs/dbraw/zinc/11/24/40/206112440.db2.gz	PWLYMQLJAKJWNQ-UHFFFAOYSA-N	-1	0	352.437	2.577	50	0		FFAARM
O=C([O-])Cn1ccc(NC(=O)[C@H]2C[C@@H]2c2ccccc2C(F)(F)F)n1	ZINC000122743409	206112694	/nfs/dbraw/zinc/11/26/94/206112694.db2.gz	DBUPVBCRYQFTNT-MNOVXSKESA-N	-1	0	353.300	2.729	50	0		FFAARM
O=C([O-])c1ccc(NC2=C(Cl)C(=O)N(c3ccc(F)cc3)C2=O)cc1	ZINC000000957115	206143167	/nfs/dbraw/zinc/14/31/67/206143167.db2.gz	MXQBLOYPTDYRCC-UHFFFAOYSA-N	-1	0	360.728	2.960	50	0		FFAARM
O=S(=O)([N-]c1cccc(-c2ccc3nncn3n2)c1)c1cccs1	ZINC000004270268	206173283	/nfs/dbraw/zinc/17/32/83/206173283.db2.gz	BBMPWMZNDHWAGI-UHFFFAOYSA-N	-1	0	357.420	2.654	50	0		FFAARM
COc1ccccc1[N-]S(=O)(=O)c1cccc(NC(=O)CSC)c1	ZINC000007777045	206209701	/nfs/dbraw/zinc/20/97/01/206209701.db2.gz	MBOVKMAVLXOPRO-UHFFFAOYSA-N	-1	0	366.464	2.798	50	0		FFAARM
CCOC(=O)c1ccc(S(=O)(=O)[N-]c2ccsc2C(=O)OC)cc1	ZINC000007230202	206244433	/nfs/dbraw/zinc/24/44/33/206244433.db2.gz	RZIOOBUXKGATDE-UHFFFAOYSA-N	-1	0	369.420	2.512	50	0		FFAARM
CCCC[C@@H](NC(=O)[C@@H](CCC)NC(=O)OCc1ccccc1)C(=O)[O-]	ZINC000004760573	206237527	/nfs/dbraw/zinc/23/75/27/206237527.db2.gz	XPRXIIXCLWGYHA-HZPDHXFCSA-N	-1	0	364.442	2.841	50	0		FFAARM
CCCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C(=O)[O-])C(C)C	ZINC000004760610	206238669	/nfs/dbraw/zinc/23/86/69/206238669.db2.gz	SPAQWPZGFYWELB-HOTGVXAUSA-N	-1	0	364.442	2.697	50	0		FFAARM
CC(=O)Nc1ncc(S(=O)(=O)[N-]c2cccc(C(F)(F)F)c2)s1	ZINC000012379808	206290820	/nfs/dbraw/zinc/29/08/20/206290820.db2.gz	QLKVTGQGDRAYCK-UHFFFAOYSA-N	-1	0	365.358	2.921	50	0		FFAARM
O=C([O-])[C@@H]1CC=CC[C@H]1C(=O)Nc1cccc(I)c1	ZINC000013012564	206300160	/nfs/dbraw/zinc/30/01/60/206300160.db2.gz	HUTIEOAQYBWKQB-VXGBXAGGSA-N	-1	0	371.174	2.897	50	0		FFAARM
COc1ccc(/C=C/C(=O)[O-])cc1S(=O)(=O)[N-]c1cc(F)cc(F)c1	ZINC000013278613	206301781	/nfs/dbraw/zinc/30/17/81/206301781.db2.gz	YJZOBBAJTOENCC-HWKANZROSA-N	-1	0	369.345	2.872	50	0		FFAARM
COC(=O)C[C@@H](c1ccc(Cl)cc1)c1c(=O)nc2ccccn2c1[O-]	ZINC000205976302	206337841	/nfs/dbraw/zinc/33/78/41/206337841.db2.gz	ZKAISWBXSGUSNL-ZDUSSCGKSA-N	-1	0	358.781	2.749	50	0		FFAARM
COc1cccc([C@H](C)N(C)C(=O)c2ccc(N3CC(=O)N=C3[O-])cc2)c1	ZINC000215812012	206352809	/nfs/dbraw/zinc/35/28/09/206352809.db2.gz	DDSTUYDWOHEUMK-ZDUSSCGKSA-N	-1	0	367.405	2.585	50	0		FFAARM
CC(C)c1ccc(CCCC(=O)N[C@@H]2COCC[C@@H]2OCC(=O)[O-])cc1	ZINC000222574051	206418643	/nfs/dbraw/zinc/41/86/43/206418643.db2.gz	QOTMRRZOOODVIF-MSOLQXFVSA-N	-1	0	363.454	2.508	50	0		FFAARM
CN(Cc1cccc(Cl)c1)C(=O)CC[C@@]1(CCC(=O)[O-])CCC(=O)N1	ZINC000222290725	206413961	/nfs/dbraw/zinc/41/39/61/206413961.db2.gz	ZLLZAARWFHOCSQ-GOSISDBHSA-N	-1	0	366.845	2.592	50	0		FFAARM
COc1cc(C)c(Cl)cc1S(=O)(=O)[N-]c1ccccc1C(N)=O	ZINC000252492310	206575833	/nfs/dbraw/zinc/57/58/33/206575833.db2.gz	MIJSDNYZPDRPET-UHFFFAOYSA-N	-1	0	354.815	2.557	50	0		FFAARM
Cc1cn(C)c(CC(=O)N2CCN(c3cccc(C)c3C)CC2)c1C(=O)[O-]	ZINC000008607762	132843683	/nfs/dbraw/zinc/84/36/83/132843683.db2.gz	DYCNBOHUKZUMTJ-UHFFFAOYSA-N	-1	0	369.465	2.540	50	0		FFAARM
C[C@@H]1CCCCN1c1ccc(C(N)=O)cc1NC(=O)c1ncccc1[O-]	ZINC000055224720	136126156	/nfs/dbraw/zinc/12/61/56/136126156.db2.gz	BUFFDFVGGRSSBG-GFCCVEGCSA-N	-1	0	354.410	2.517	50	0		FFAARM
CC1CCN(c2ccc(NS(=O)(=O)c3c[nH]c(C(=O)[O-])c3)cc2)CC1	ZINC000071844466	136141255	/nfs/dbraw/zinc/14/12/55/136141255.db2.gz	PFCWVNWBKQNZHX-UHFFFAOYSA-N	-1	0	363.439	2.750	50	0		FFAARM
Cc1cnn(C2(C(=O)[O-])CCN(c3ncnc4c(C)csc43)CC2)c1	ZINC000072409479	136145385	/nfs/dbraw/zinc/14/53/85/136145385.db2.gz	LWEAKYVOLSBNNX-UHFFFAOYSA-N	-1	0	357.439	2.585	50	0		FFAARM
COc1ccc(NC(=O)N2CCC[C@H](c3ccn(CC(=O)[O-])n3)C2)c(C)c1	ZINC000426397438	263574955	/nfs/dbraw/zinc/57/49/55/263574955.db2.gz	OLYAIINHYDUABD-AWEZNQCLSA-N	-1	0	372.425	2.696	50	0		FFAARM
COc1cccc2c1N(S(=O)(=O)c1cc(C(=O)[O-])cs1)CCC2	ZINC000032085920	506227714	/nfs/dbraw/zinc/22/77/14/506227714.db2.gz	NPEPOKLEGKRIMZ-UHFFFAOYSA-N	-1	0	353.421	2.596	50	0		FFAARM
Cc1ccnc([N-]S(=O)(=O)c2ccc(NC(=O)c3cccs3)cc2)n1	ZINC000000852699	506236435	/nfs/dbraw/zinc/23/64/35/506236435.db2.gz	AOHIUNTVRBNRFV-UHFFFAOYSA-N	-1	0	374.447	2.900	50	0		FFAARM
COc1ccc(-c2csc3ncn([C@@H](C)C(=O)[O-])c(=O)c23)cc1OC	ZINC000000958734	506242410	/nfs/dbraw/zinc/24/24/10/506242410.db2.gz	RNZDYHBUDJWLCY-VIFPVBQESA-N	-1	0	360.391	2.788	50	0		FFAARM
NC(=O)c1sccc1[N-]S(=O)(=O)c1ccc(Cl)c(Cl)c1	ZINC000001026190	506243997	/nfs/dbraw/zinc/24/39/97/506243997.db2.gz	HFNCHMHRJZKVAL-UHFFFAOYSA-N	-1	0	351.236	2.955	50	0		FFAARM
CSc1nc([N-]S(=O)(=O)c2cc(C)c(Cl)cc2Cl)nn1C	ZINC000001023945	506244228	/nfs/dbraw/zinc/24/42/28/506244228.db2.gz	FUTNMQPJCMSDAL-UHFFFAOYSA-N	-1	0	367.283	2.953	50	0		FFAARM
COc1ccc(C(=O)Nc2ccon2)cc1S(=O)(=O)[N-]c1ccccc1	ZINC000001078126	506248533	/nfs/dbraw/zinc/24/85/33/506248533.db2.gz	ZUYNSBFGMRCEDS-UHFFFAOYSA-N	-1	0	373.390	2.736	50	0		FFAARM
CC(=O)c1c(C)[nH]c(C([O-])=CS(=O)(=O)Cc2ccccc2F)c1C	ZINC000040156618	506475789	/nfs/dbraw/zinc/47/57/89/506475789.db2.gz	FGGFOGPQHXCRKT-UHFFFAOYSA-N	-1	0	351.399	2.771	50	0		FFAARM
CN(Cc1nc(=O)c2sccc2[n-]1)C(=O)NCCc1ccc(F)cc1	ZINC000032794770	506295781	/nfs/dbraw/zinc/29/57/81/506295781.db2.gz	NPNWXFLZDNHQCQ-UHFFFAOYSA-N	-1	0	360.414	2.508	50	0		FFAARM
CCOC(=O)c1cccc(NS(=O)(=O)c2ccc(F)c(C(=O)[O-])c2)c1	ZINC000035336553	506380245	/nfs/dbraw/zinc/38/02/45/506380245.db2.gz	DFNMMSQEDIYTLN-UHFFFAOYSA-N	-1	0	367.354	2.501	50	0		FFAARM
O=C(Nc1ccc(CCN2CCOCC2)cc1)c1c([O-])cc(F)cc1F	ZINC000066048685	506417427	/nfs/dbraw/zinc/41/74/27/506417427.db2.gz	CVNJZWOVYYOGBI-UHFFFAOYSA-N	-1	0	362.376	2.797	50	0		FFAARM
Cc1nc(C(=O)[O-])c(C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nc1C	ZINC000005440393	506442233	/nfs/dbraw/zinc/44/22/33/506442233.db2.gz	VFLDXMJBUDQMFN-UHFFFAOYSA-N	-1	0	350.718	2.606	50	0		FFAARM
Cn1ccnc1[C@H](NC(=O)Cc1ccccc1C(=O)[O-])c1ccc(F)cc1	ZINC000040158778	506477857	/nfs/dbraw/zinc/47/78/57/506477857.db2.gz	PJROEYNGAMOLKM-GOSISDBHSA-N	-1	0	367.380	2.706	50	0		FFAARM
COc1ccccc1[N-]S(=O)(=O)c1ccc2c(c1)CCCN2C(C)=O	ZINC000007323217	506552419	/nfs/dbraw/zinc/55/24/19/506552419.db2.gz	DKAUKWFHXPEVTB-UHFFFAOYSA-N	-1	0	360.435	2.795	50	0		FFAARM
CCN1CCc2c3ccccc3[nH]c2[C@@H]1c1c(O)nc([O-])n(C(C)C)c1=O	ZINC000009042440	506680207	/nfs/dbraw/zinc/68/02/07/506680207.db2.gz	GNLQNDLTPGVJGS-KRWDZBQOSA-N	-1	0	368.437	2.684	50	0	biogenic	FFAARM
O=C([O-])[C@H]1CCC(=O)N(Cc2ccccc2)[C@H]1c1ccc2c(c1)OCO2	ZINC000012336763	506850675	/nfs/dbraw/zinc/85/06/75/506850675.db2.gz	QZLGYHOJUHNZKB-KXBFYZLASA-N	-1	0	353.374	2.980	50	0		FFAARM
Cc1nnc(SCC(=O)Nc2ccccc2Oc2ccccc2)[n-]c1=O	ZINC000012555189	506878317	/nfs/dbraw/zinc/87/83/17/506878317.db2.gz	PUDCSRAUUUUMIX-UHFFFAOYSA-N	-1	0	368.418	2.996	50	0		FFAARM
COc1ccc(OC)c(CN2CCN(c3ccccc3C(=O)[O-])CC2)c1	ZINC000012608033	506883888	/nfs/dbraw/zinc/88/38/88/506883888.db2.gz	HBJOODAZRQJWQA-UHFFFAOYSA-N	-1	0	356.422	2.724	50	0		FFAARM
CCOc1cc(/C=C2\SC(=O)N(C)C2=O)ccc1O[C@H](C)C(=O)[O-]	ZINC000012629255	506885980	/nfs/dbraw/zinc/88/59/80/506885980.db2.gz	PZYNRPQLKSKNSU-PGEKAQRJSA-N	-1	0	351.380	2.603	50	0		FFAARM
COc1cc2c(cc1OC)[C@H](CC(=O)[O-])N(C(=O)c1ccc(C)o1)CC2	ZINC000013182813	506932023	/nfs/dbraw/zinc/93/20/23/506932023.db2.gz	NJLSYSSXBZSZRO-AWEZNQCLSA-N	-1	0	359.378	2.820	50	0		FFAARM
COc1ccc([C@H](CC(=O)[O-])NC(=O)c2ccc(OC)cc2OC)cc1	ZINC000013187459	506933013	/nfs/dbraw/zinc/93/30/13/506933013.db2.gz	XMEBSLHKBQBLCM-INIZCTEOSA-N	-1	0	359.378	2.658	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)c1cccc(N2CCCC2=O)c1)c1ccccc1	ZINC000013427904	506941136	/nfs/dbraw/zinc/94/11/36/506941136.db2.gz	YNTFWXQJZNCNPP-QGZVFWFLSA-N	-1	0	352.390	2.759	50	0		FFAARM
O=C([O-])c1ccc(NC(=O)c2cccc(NC(=O)[C@H]3CCCO3)c2)cc1	ZINC000013843269	506958950	/nfs/dbraw/zinc/95/89/50/506958950.db2.gz	DRMKYSZOZMGCJZ-MRXNPFEDSA-N	-1	0	354.362	2.755	50	0		FFAARM
CN(C)c1cccc(O[C@H]2C[C@@H](C(=O)[O-])N(C(=O)OC(C)(C)C)C2)c1	ZINC000014632478	506996255	/nfs/dbraw/zinc/99/62/55/506996255.db2.gz	MNVAFNQGORGUKW-GJZGRUSLSA-N	-1	0	350.415	2.594	50	0		FFAARM
COc1ccccc1[N-]S(=O)(=O)c1ccc(C(=O)N2CCCC2)cc1	ZINC000015344414	507034463	/nfs/dbraw/zinc/03/44/63/507034463.db2.gz	SEYWNHPPUUIXPS-UHFFFAOYSA-N	-1	0	360.435	2.732	50	0		FFAARM
Cc1ccc(C)c(S(=O)(=O)[N-]c2ccccc2C(=O)N2CCOCC2)c1	ZINC000022960424	507321913	/nfs/dbraw/zinc/32/19/13/507321913.db2.gz	ZKEZGXAJIFLJCT-UHFFFAOYSA-N	-1	0	374.462	2.577	50	0		FFAARM
Cc1nc2sc([C@H](c3cccc(Cl)c3)N3CCOCC3)c([O-])n2n1	ZINC000023157755	507335823	/nfs/dbraw/zinc/33/58/23/507335823.db2.gz	JAELKPWETXHFKH-ZDUSSCGKSA-N	-1	0	364.858	2.880	50	0		FFAARM
O=S(=O)([N-]c1cnn(Cc2cccnc2)c1)c1ccc(Cl)cc1F	ZINC000058209161	507385600	/nfs/dbraw/zinc/38/56/00/507385600.db2.gz	WTYVRCAAODSUMG-UHFFFAOYSA-N	-1	0	366.805	2.920	50	0		FFAARM
Cc1ccc(F)c(NS(=O)(=O)c2ccc(OCC(=O)[O-])c(C)c2)c1	ZINC000058368544	507408925	/nfs/dbraw/zinc/40/89/25/507408925.db2.gz	ZTJSJBVXYVVYFS-UHFFFAOYSA-N	-1	0	353.371	2.707	50	0		FFAARM
O=C([O-])c1ccc(Cl)c(S(=O)(=O)N2CCc3ccc(F)cc32)c1	ZINC000058496845	507427804	/nfs/dbraw/zinc/42/78/04/507427804.db2.gz	QWVCEGMDBZWOQY-UHFFFAOYSA-N	-1	0	355.774	2.929	50	0		FFAARM
Cc1cc(NC(=O)Cn2nc(C)c(-c3cccc(C(=O)[O-])c3)c2C)n(C)n1	ZINC000048121783	507457691	/nfs/dbraw/zinc/45/76/91/507457691.db2.gz	RDKDYDJDQVZOSB-UHFFFAOYSA-N	-1	0	367.409	2.546	50	0		FFAARM
COc1cc(C)c(S(=O)(=O)Nc2ccc(C(=O)[O-])cc2)cc1OC	ZINC000026527733	507593594	/nfs/dbraw/zinc/59/35/94/507593594.db2.gz	KFGWTCXZPFFQJF-UHFFFAOYSA-N	-1	0	351.380	2.511	50	0		FFAARM
O=C([O-])[C@@H]1CCCN(c2nc(=O)c3scc(-c4ccccc4)c3[nH]2)C1	ZINC000049421365	507620467	/nfs/dbraw/zinc/62/04/67/507620467.db2.gz	YGPYZQSMCXBYRR-GFCCVEGCSA-N	-1	0	355.419	2.953	50	0		FFAARM
CNC(=O)c1ccc(C)c(NC(=O)C[C@@](C)(C(=O)[O-])c2ccccc2)c1	ZINC000027056656	507628520	/nfs/dbraw/zinc/62/85/20/507628520.db2.gz	CGZNVYGCROAGHC-HXUWFJFHSA-N	-1	0	354.406	2.726	50	0		FFAARM
COc1ccc(NC(=O)c2ccco2)cc1NC(=O)[C@H]1[C@H](C(=O)[O-])C1(C)C	ZINC000071280253	507699336	/nfs/dbraw/zinc/69/93/36/507699336.db2.gz	GAPPSYFMDMHCDV-HUUCEWRRSA-N	-1	0	372.377	2.836	50	0		FFAARM
CN(Cc1nc(=O)c2sccc2[n-]1)C(=O)CCC(=O)c1ccccc1	ZINC000028969990	507752280	/nfs/dbraw/zinc/75/22/80/507752280.db2.gz	KSBGHGGNWGGIIX-UHFFFAOYSA-N	-1	0	355.419	2.606	50	0		FFAARM
CCOc1ccc(-c2ccnc(N3CC[C@H](COC)C3)n2)cc1C(=O)[O-]	ZINC000072409226	507785080	/nfs/dbraw/zinc/78/50/80/507785080.db2.gz	SAQXTTPXKYPWRY-ZDUSSCGKSA-N	-1	0	357.410	2.713	50	0		FFAARM
Cc1csc2c1ncnc2N1CCCn2nc(CCC(=O)[O-])cc2C1	ZINC000072411207	507785448	/nfs/dbraw/zinc/78/54/48/507785448.db2.gz	DTLPEJJVFMLFOY-UHFFFAOYSA-N	-1	0	357.439	2.624	50	0		FFAARM
Cc1cc(N2CCn3nc(CCC(=O)[O-])cc3C2)nc(-c2ccccc2)n1	ZINC000072469303	507794437	/nfs/dbraw/zinc/79/44/37/507794437.db2.gz	LAPPMUUTMYEMBJ-UHFFFAOYSA-N	-1	0	363.421	2.686	50	0		FFAARM
CCC[C@]1(C(=O)[O-])CCCN(C(=O)c2cc(=O)[nH]c3cc(F)ccc32)C1	ZINC000091350803	507982448	/nfs/dbraw/zinc/98/24/48/507982448.db2.gz	NCFJKGWKIYLQIS-IBGZPJMESA-N	-1	0	360.385	2.774	50	0		FFAARM
Cc1nc2cc(C(=O)N3C[C@@H](c4ccc(F)cc4)[C@H](C(=O)[O-])C3)ccc2[nH]1	ZINC000091461578	507988235	/nfs/dbraw/zinc/98/82/35/507988235.db2.gz	YPGTUGKGGRYBQS-JKSUJKDBSA-N	-1	0	367.380	2.951	50	0		FFAARM
Cc1ccc(NC(=O)N2CCC3(CCC(=O)N([C@H](C)C(=O)[O-])C3)CC2)cc1	ZINC000091656635	508000185	/nfs/dbraw/zinc/00/01/85/508000185.db2.gz	HDDPSSAUVSKVNM-OAHLLOKOSA-N	-1	0	373.453	2.705	50	0		FFAARM
COc1cccc([C@@H]2CN(C(=O)c3cc(C)n(C)c3C)C[C@H]2C(=O)[O-])c1	ZINC000091997854	508031010	/nfs/dbraw/zinc/03/10/10/508031010.db2.gz	UJNUYXPFMLWHQO-ZWKOTPCHSA-N	-1	0	356.422	2.591	50	0		FFAARM
CC(C)=CC[C@@]1(C(=O)[O-])CCCN(C(=O)c2cc3c([nH]c2=O)CCCC3)C1	ZINC000092062167	508038273	/nfs/dbraw/zinc/03/82/73/508038273.db2.gz	OCSMLIINLOUSJM-NRFANRHFSA-N	-1	0	372.465	2.917	50	0		FFAARM
COC(=O)c1ccc(Cl)c(S(=O)(=O)[N-]c2cc(F)ccc2O)c1	ZINC000075106923	508083521	/nfs/dbraw/zinc/08/35/21/508083521.db2.gz	PCUYLRXLMRCBEL-UHFFFAOYSA-N	-1	0	359.762	2.772	50	0		FFAARM
COC(=O)c1cccc([N-]S(=O)(=O)c2cc(-c3cc[nH]n3)oc2C)c1	ZINC000075519006	508113177	/nfs/dbraw/zinc/11/31/77/508113177.db2.gz	YVHDXHJABMUKEX-UHFFFAOYSA-N	-1	0	361.379	2.566	50	0		FFAARM
CC(C)c1csc(C(=O)N2C[C@@H]3c4ccccc4OC[C@]3(C(=O)[O-])C2)n1	ZINC000095374259	508178980	/nfs/dbraw/zinc/17/89/80/508178980.db2.gz	UFDTWSSIRIIMLV-BFUOFWGJSA-N	-1	0	372.446	2.970	50	0		FFAARM
CC(C)c1ccc(NC(=O)N2CCC3(CC2)[C@H](C(=O)[O-])CC(=O)N3C)cc1	ZINC000095376523	508180042	/nfs/dbraw/zinc/18/00/42/508180042.db2.gz	NVOOBPOUPFSIOU-INIZCTEOSA-N	-1	0	373.453	2.739	50	0		FFAARM
CSc1cccc([C@@H](C(=O)[O-])N2CCN(Cc3cccnc3)CC2)c1	ZINC000095386395	508182609	/nfs/dbraw/zinc/18/26/09/508182609.db2.gz	ALLIEZXCALBQQT-SFHVURJKSA-N	-1	0	357.479	2.747	50	0		FFAARM
CCc1cc(C(=O)N2CCC[C@@H](c3cccc(C(=O)[O-])c3)C2)cc(=O)[nH]1	ZINC000095392697	508184522	/nfs/dbraw/zinc/18/45/22/508184522.db2.gz	BVVVZZWSCNTHKD-OAHLLOKOSA-N	-1	0	354.406	2.655	50	0		FFAARM
COc1cc([N-]S(=O)(=O)c2ccc(OC)c(Cl)c2Cl)ncn1	ZINC000095444307	508185681	/nfs/dbraw/zinc/18/56/81/508185681.db2.gz	DZPWXCMQAOJTKM-UHFFFAOYSA-N	-1	0	364.210	2.601	50	0		FFAARM
CSc1nc(C)c(CCC(=O)NC2(C(=O)[O-])CCCCC2)c(C)n1	ZINC000095948851	508198343	/nfs/dbraw/zinc/19/83/43/508198343.db2.gz	DCBDLGGLNHJYGA-UHFFFAOYSA-N	-1	0	351.472	2.652	50	0		FFAARM
CC[C@H]1CN(Cc2cc(-c3cccnc3)ccc2OCC(=O)[O-])CCO1	ZINC000097655518	508227419	/nfs/dbraw/zinc/22/74/19/508227419.db2.gz	NCNUHLXTMHEUKW-SFHVURJKSA-N	-1	0	356.422	2.823	50	0		FFAARM
CC(C)[C@@H](NC(=O)Cn1ccc2cc(Br)ccc21)C(=O)[O-]	ZINC000098038002	508232409	/nfs/dbraw/zinc/23/24/09/508232409.db2.gz	LTNMIUMXDDLLJW-CQSZACIVSA-N	-1	0	353.216	2.629	50	0		FFAARM
CCCc1nnc(NC(=O)c2c([O-])c3cccc4c3n(c2=O)CCC4)s1	ZINC000100613821	508239505	/nfs/dbraw/zinc/23/95/05/508239505.db2.gz	OAOQDBGVKMWFIX-UHFFFAOYSA-N	-1	0	370.434	2.710	50	0		FFAARM
COc1cccc([C@H](C2=C([O-])COC2=O)c2cc3c(cc2O)OCO3)c1	ZINC000100695826	508239861	/nfs/dbraw/zinc/23/98/61/508239861.db2.gz	PVYFFSQPIZEDHW-KRWDZBQOSA-N	-1	0	356.330	2.630	50	0		FFAARM
CCn1c(=O)c(C(=O)Nc2ccsc2C(=O)OC)c([O-])c2ccccc21	ZINC000100730298	508239975	/nfs/dbraw/zinc/23/99/75/508239975.db2.gz	AHXUSNGOCGBQSJ-UHFFFAOYSA-N	-1	0	372.402	2.827	50	0		FFAARM
CC(C)C(=O)c1c2ccccc2n(C(=O)NC(=O)c2ccccc2)c1[O-]	ZINC000101173047	508240761	/nfs/dbraw/zinc/24/07/61/508240761.db2.gz	DLODQFZMFNLOGX-MRXNPFEDSA-N	-1	0	350.374	2.892	50	0		FFAARM
Cc1ccc(CN(C)C(=O)c2ccc3c(c2)[n-]c(=S)n(C)c3=O)cc1	ZINC000102176600	508268619	/nfs/dbraw/zinc/26/86/19/508268619.db2.gz	OHDBEDAEGUHKPJ-UHFFFAOYSA-N	-1	0	353.447	2.803	50	0		FFAARM
Cc1cc(C(=O)N[C@@H]2CCOC[C@H]2Oc2ccc(C(=O)[O-])cc2)c(C)o1	ZINC000223741297	509347468	/nfs/dbraw/zinc/34/74/68/509347468.db2.gz	WGPWBEKPFKUMDI-IAGOWNOFSA-N	-1	0	359.378	2.561	50	0		FFAARM
O=C([O-])C1CCN(S(=O)(=O)Cc2ccc(Cl)cc2Cl)CC1	ZINC000226087276	509394769	/nfs/dbraw/zinc/39/47/69/509394769.db2.gz	SPPJKQWFHDUAMW-UHFFFAOYSA-N	-1	0	352.239	2.620	50	0		FFAARM
O=C([O-])[C@@H]1CCCN(S(=O)(=O)Cc2ccc(Cl)cc2Cl)C1	ZINC000226087325	509394925	/nfs/dbraw/zinc/39/49/25/509394925.db2.gz	QKILOOYOCAGNHF-SECBINFHSA-N	-1	0	352.239	2.620	50	0		FFAARM
Cc1c(C(=O)N(C[C@@H](C)C(=O)[O-])C2CC2)nnn1-c1ccccc1Cl	ZINC000170067870	509666474	/nfs/dbraw/zinc/66/64/74/509666474.db2.gz	OBVFIEOKUPNTDT-SNVBAGLBSA-N	-1	0	362.817	2.554	50	0		FFAARM
Cc1cc(C(=O)[O-])cc(S(=O)(=O)N(C)c2ccc(O)cc2)c1Cl	ZINC000170610507	509678934	/nfs/dbraw/zinc/67/89/34/509678934.db2.gz	BTIRFNQWLBHAEX-UHFFFAOYSA-N	-1	0	355.799	2.877	50	0		FFAARM
CC(C)(C)CCS(=O)(=O)[N-]C(=O)c1ncccc1OCC(F)(F)F	ZINC000170656586	509702078	/nfs/dbraw/zinc/70/20/78/509702078.db2.gz	AUSYJXDNQJXQAI-UHFFFAOYSA-N	-1	0	368.377	2.519	50	0		FFAARM
Cc1nc(-c2ccc(Cl)s2)sc1C(=O)N1CCO[C@H](C(=O)[O-])C1	ZINC000237682744	509710084	/nfs/dbraw/zinc/71/00/84/509710084.db2.gz	IXBBBSVCQJTZPJ-QMMMGPOBSA-N	-1	0	372.855	2.759	50	0		FFAARM
COC(=O)C[C@H](c1ccc(C(=O)[O-])cc1)c1oc2ccccc2c(=O)c1O	ZINC000253413256	509878941	/nfs/dbraw/zinc/87/89/41/509878941.db2.gz	UHAUKBFVWCFPQP-CQSZACIVSA-N	-1	0	368.341	2.892	50	0	biogenic	FFAARM
Cc1[nH]nc(-c2ccsc2)c1CC(=O)N[C@@H](Cc1ccccc1)C(=O)[O-]	ZINC000253409691	509879233	/nfs/dbraw/zinc/87/92/33/509879233.db2.gz	MGEBJOWOQWWZFL-INIZCTEOSA-N	-1	0	369.446	2.801	50	0		FFAARM
Cc1nn(C)c(C)c1[C@@H](NC(=O)c1cccc(C(=O)[O-])c1)C(F)(F)F	ZINC000262838531	510434483	/nfs/dbraw/zinc/43/44/83/510434483.db2.gz	QZGKFURSWNCWSK-CYBMUJFWSA-N	-1	0	355.316	2.769	50	0		FFAARM
CC(C)Cc1cc(C(=O)N2C[C@@H](c3ccccc3)[C@H](C(=O)[O-])C2)cc(=O)[nH]1	ZINC000262901480	510466255	/nfs/dbraw/zinc/46/62/55/510466255.db2.gz	MIDBQYHKLRKSCP-ZWKOTPCHSA-N	-1	0	368.433	2.926	50	0		FFAARM
Cc1nc(COc2ccc(F)cc2)sc1C(=O)N1CCC[C@H]1C(=O)[O-]	ZINC000178276348	510523354	/nfs/dbraw/zinc/52/33/54/510523354.db2.gz	XAROIBRYTIVSRP-ZDUSSCGKSA-N	-1	0	364.398	2.859	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)[C@@H]2CC=CC[C@H]2c2nc3ccccc3s2)CCO1	ZINC000263046927	510534304	/nfs/dbraw/zinc/53/43/04/510534304.db2.gz	WKCUTVWKQUVJGC-NFAWXSAZSA-N	-1	0	372.446	2.658	50	0		FFAARM
CC(C)n1cnnc1-c1ccccc1[N-]S(=O)(=O)C[C@@H]1CCCCO1	ZINC000175777568	510785823	/nfs/dbraw/zinc/78/58/23/510785823.db2.gz	HIGHVGPCBBVJSL-AWEZNQCLSA-N	-1	0	364.471	2.837	50	0		FFAARM
O=C([O-])Cn1ccc([C@@H]2CCCN(C(=O)c3ccc(Cl)c(F)c3)C2)n1	ZINC000426387828	513925047	/nfs/dbraw/zinc/92/50/47/513925047.db2.gz	SSNRBYWJBOJKQI-GFCCVEGCSA-N	-1	0	365.792	2.780	50	0		FFAARM
Cc1cc(C(=O)N[C@@H](C)c2n[nH]c(CC(=O)[O-])n2)sc1-c1ccccc1	ZINC000426622897	513997388	/nfs/dbraw/zinc/99/73/88/513997388.db2.gz	GCWPSMMPYTUHBJ-NSHDSACASA-N	-1	0	370.434	2.960	50	0		FFAARM
COc1cccc([C@@H](C)N2CCN(C(=O)c3ccc(C(=O)[O-])cc3)CC2)c1	ZINC000575045895	519471000	/nfs/dbraw/zinc/47/10/00/519471000.db2.gz	XCLSIULJDMSZJQ-OAHLLOKOSA-N	-1	0	368.433	2.912	50	0		FFAARM
CCC[C@H](C)c1cc([N-]S(=O)(=O)c2ccc(O)c(C(=O)OC)c2)n[nH]1	ZINC000079106632	521071359	/nfs/dbraw/zinc/07/13/59/521071359.db2.gz	YYCXEQAFGXLOSI-JTQLQIEISA-N	-1	0	367.427	2.606	50	0		FFAARM
C[C@@H](NC(=O)Nc1ccccc1C[S@](C)=O)[C@@H]1C[C@H](C(=O)[O-])C1(C)C	ZINC000593963187	521318939	/nfs/dbraw/zinc/31/89/39/521318939.db2.gz	ZBZOVJHDYMQMPT-NBFLZKEXSA-N	-1	0	366.483	2.822	50	0		FFAARM
C[C@@H]1CCc2c(sc(NC(=O)[C@H]3CC=CC[C@H]3C(=O)[O-])c2C(N)=O)C1	ZINC000239159647	524723026	/nfs/dbraw/zinc/72/30/26/524723026.db2.gz	MOAACRFRNIIRHU-OUAUKWLOSA-N	-1	0	362.451	2.577	50	0		FFAARM
C[C@@H]1C[C@H]1C(=O)N[C@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)[O-]	ZINC000299747993	525478748	/nfs/dbraw/zinc/47/87/48/525478748.db2.gz	FSLHKMSHTJQJMU-XPLICSAQSA-N	-1	0	365.227	2.698	50	0		FFAARM
Cc1nn(CCC(=O)N2C[C@@H](c3cccc(F)c3)[C@H](C(=O)[O-])C2)c(C)c1C	ZINC000091626266	526276789	/nfs/dbraw/zinc/27/67/89/526276789.db2.gz	JJWFAGIWAJLUNH-ZWKOTPCHSA-N	-1	0	373.428	2.664	50	0		FFAARM
O=C([O-])[C@@H]1CCN(C(=O)CCc2nc3ccccc3n2-c2ccccc2)C1	ZINC000269131129	526278556	/nfs/dbraw/zinc/27/85/56/526278556.db2.gz	BKVYZGQQLNKNHC-OAHLLOKOSA-N	-1	0	363.417	2.891	50	0		FFAARM
O=C([O-])[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)C[C@H]1Sc2ccccc2NC1=O	ZINC000299750601	526291749	/nfs/dbraw/zinc/29/17/49/526291749.db2.gz	OASVCKBLNVIKIT-AOLWHUPESA-N	-1	0	374.462	2.734	50	0		FFAARM
Cc1oc(CN(C)C(=O)c2ccc3c(c2)NC(=O)[C@H](C)S3)cc1C(=O)[O-]	ZINC000268936536	526770189	/nfs/dbraw/zinc/77/01/89/526770189.db2.gz	OAUAKNOLNHEKPJ-JTQLQIEISA-N	-1	0	374.418	2.991	50	0		FFAARM
Cc1nc(-c2ncccn2)sc1C(=O)N[C@@H]1CCCCC[C@H]1C(=O)[O-]	ZINC000120177680	570565043	/nfs/dbraw/zinc/56/50/43/570565043.db2.gz	WSDKWZWWRFFBHV-VXGBXAGGSA-N	-1	0	360.439	2.672	50	0		FFAARM
Cc1cc2ncc(C(=O)N[C@H](c3ccccc3)[C@H](C)C(=O)[O-])c(C)n2n1	ZINC000262544429	601169448	/nfs/dbraw/zinc/16/94/48/601169448.db2.gz	VPRSZWIAUXAALY-SJCJKPOMSA-N	-1	0	352.394	2.538	50	0		FFAARM
Cc1c(S(=O)(=O)[N-]c2c(C)cccc2C(=O)OC(C)(C)C)cnn1C	ZINC000864096599	730821880	/nfs/dbraw/zinc/82/18/80/730821880.db2.gz	KTGVVPCWNMIRSL-UHFFFAOYSA-N	-1	0	365.455	2.793	50	0		FFAARM
C[C@@H](C(=O)[O-])c1cccc(NC(=O)[C@H]2CCCN(C(=O)N3CCCC3)C2)c1	ZINC000263178037	980535667	/nfs/dbraw/zinc/53/56/67/980535667.db2.gz	GYHNTFUXXOKUTB-ZBFHGGJFSA-N	-1	0	373.453	2.741	50	0		FFAARM
O=C([O-])c1cc2c(nc1N1CCC[C@@]3(CCC(=O)N(C4CC4)C3)C1)CCC2	ZINC000077375349	1020667478	/nfs/dbraw/zinc/66/74/78/1020667478.db2.gz	OKMQZSBQIXIMNX-OAQYLSRUSA-N	-1	0	369.465	2.640	50	0		FFAARM
COCc1cc(NC(=O)N2CCC(c3ccccc3C(=O)[O-])CC2)ncn1	ZINC000669501406	1027960413	/nfs/dbraw/zinc/96/04/13/1027960413.db2.gz	AHEAZLZWNZWTRE-UHFFFAOYSA-N	-1	0	370.409	2.733	50	0		FFAARM
Cn1c(N[C@@H]2CCCN(C(=O)c3ccco3)C2)nc2cc(C(=O)[O-])ccc21	ZINC001506412794	1059501089	/nfs/dbraw/zinc/50/10/89/1059501089.db2.gz	FGLJWOMNFCFYNN-CYBMUJFWSA-N	-1	0	368.393	2.581	50	0		FFAARM
Cc1nc([C@@H](C)N(C)S(=O)(=O)c2ccsc2C(=O)[O-])c(C)s1	ZINC001506423849	1059511052	/nfs/dbraw/zinc/51/10/52/1059511052.db2.gz	XZVHCPIUOOWROS-SSDOTTSWSA-N	-1	0	360.482	2.901	50	0		FFAARM
CCC[C@]1(C(=O)[O-])CN(C(=O)Cc2cccc3ccccc32)CC[C@@H]1O	ZINC001529172379	1062201370	/nfs/dbraw/zinc/20/13/70/1062201370.db2.gz	FXCLKQWZMLUPET-RXVVDRJESA-N	-1	0	355.434	2.847	50	0		FFAARM
COc1ccc(C(=O)NC(=S)Nc2cc(C(=O)[O-])ccc2C)cc1OC	ZINC000001158057	219383089	/nfs/dbraw/zinc/38/30/89/219383089.db2.gz	GQEJUWMDRQCYTA-UHFFFAOYSA-N	-1	0	374.418	2.837	50	0		FFAARM
Cc1noc(C)c1[C@H]1CCCN1C(=O)c1cc(=O)n(-c2ccccc2)[n-]1	ZINC000219031499	209675777	/nfs/dbraw/zinc/67/57/77/209675777.db2.gz	JSXKFVFEOIVPOE-MRXNPFEDSA-N	-1	0	352.394	2.748	50	0		FFAARM
CCc1ccc(S(=O)(=O)[N-]c2ccc3c(c2)C(=O)N(C)CCO3)s1	ZINC000008961553	209477583	/nfs/dbraw/zinc/47/75/83/209477583.db2.gz	QMIRHXXDTXLEDS-UHFFFAOYSA-N	-1	0	366.464	2.576	50	0		FFAARM
O=S(=O)([O-])C1=C(c2ccccc2)OC(c2ccccc2)=CS1(=O)=O	ZINC000002184569	209395918	/nfs/dbraw/zinc/39/59/18/209395918.db2.gz	XMTCDMUXVGBRKV-UHFFFAOYSA-N	-1	0	364.400	2.644	50	0		FFAARM
O=C([O-])CC[C@H](CNS(=O)(=O)c1ccc(Cl)s1)C(F)(F)F	ZINC000001802363	209392004	/nfs/dbraw/zinc/39/20/04/209392004.db2.gz	MMJIZRQLHKWCBH-ZCFIWIBFSA-N	-1	0	365.782	2.723	50	0		FFAARM
O=C([O-])CC[C@@H](NC(=O)[C@H]1CC(=O)Nc2cc(F)ccc21)c1ccccc1	ZINC000139244750	209378204	/nfs/dbraw/zinc/37/82/04/209378204.db2.gz	FTAHKNJFWRCLTG-JKSUJKDBSA-N	-1	0	370.380	2.974	50	0		FFAARM
C[C@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)N1CCCC[C@H]1C(=O)[O-]	ZINC000136520323	209374743	/nfs/dbraw/zinc/37/47/43/209374743.db2.gz	MHSZUFBELCOXRZ-CABZTGNLSA-N	-1	0	373.236	2.577	50	0		FFAARM
NC(=O)c1c2c(sc1NC(=O)[C@H]1CCCC[C@H]1C(=O)[O-])CCCC2	ZINC000000355781	209372452	/nfs/dbraw/zinc/37/24/52/209372452.db2.gz	OFSGNJCEUBTMGV-VHSXEESVSA-N	-1	0	350.440	2.555	50	0		FFAARM
O=C([O-])CN(C(=O)[C@H]1C[C@@H]1c1cccc(C(F)(F)F)c1)C1CCOCC1	ZINC000238104970	209360138	/nfs/dbraw/zinc/36/01/38/209360138.db2.gz	LWCHWTCZLNNJBI-CABCVRRESA-N	-1	0	371.355	2.901	50	0		FFAARM
O=C([O-])CN(Cc1ccccc1)C(=O)c1cccc(N2CCCC2=O)c1	ZINC000238152906	209359283	/nfs/dbraw/zinc/35/92/83/209359283.db2.gz	MKSVTTPSKGVAOM-UHFFFAOYSA-N	-1	0	352.390	2.540	50	0		FFAARM
O=C([O-])c1ccc(C(=O)N2CC[C@H](OCCCc3ccccc3)C2)cn1	ZINC000238001557	209358569	/nfs/dbraw/zinc/35/85/69/209358569.db2.gz	CYZCOJHCHJBMBO-KRWDZBQOSA-N	-1	0	354.406	2.644	50	0		FFAARM
O=C([O-])[C@H]1CCCN1C(=O)c1ccc(-n2ccc(C(F)(F)F)n2)cc1	ZINC000238083934	209358601	/nfs/dbraw/zinc/35/86/01/209358601.db2.gz	UQWHPWJNBARZFN-GFCCVEGCSA-N	-1	0	353.300	2.580	50	0		FFAARM
O=C([O-])[C@H]1Cc2ccccc2CN1C(=O)C[C@H]1CCOc2ccccc21	ZINC000238030085	209357785	/nfs/dbraw/zinc/35/77/85/209357785.db2.gz	MAAPOKSEWXCILR-CRAIPNDOSA-N	-1	0	351.402	2.981	50	0		FFAARM
O=C([O-])CC[C@H]1CCCN(C(=O)Cc2ccn(-c3ccc(F)cc3)n2)C1	ZINC000238010095	209357392	/nfs/dbraw/zinc/35/73/92/209357392.db2.gz	XQDFXQOHZYEZFP-CQSZACIVSA-N	-1	0	359.401	2.657	50	0		FFAARM
C[C@@H](Oc1ccc(F)cc1Br)C(=O)N1CCC[C@@H](C(=O)[O-])C1	ZINC000237485545	209349579	/nfs/dbraw/zinc/34/95/79/209349579.db2.gz	BHYUUTHVFAXUDA-NXEZZACHSA-N	-1	0	374.206	2.679	50	0		FFAARM
CC[C@H](C(=O)N1CCO[C@@H](CC(=O)[O-])C1)c1cccc(C(F)(F)F)c1	ZINC000237073973	209333112	/nfs/dbraw/zinc/33/31/12/209333112.db2.gz	ARHMVXVMXOGXJD-KBPBESRZSA-N	-1	0	359.344	2.901	50	0		FFAARM
CCc1ccc(-c2nc(C)c(C(=O)N3CCO[C@@H](CC(=O)[O-])C3)s2)cc1	ZINC000236992852	209285123	/nfs/dbraw/zinc/28/51/23/209285123.db2.gz	TYECPOWZCIAJJH-HNNXBMFYSA-N	-1	0	374.462	2.997	50	0		FFAARM
CCO[C@H](C)c1nc(CC(=O)N2Cc3ccccc3C[C@@H]2C(=O)[O-])cs1	ZINC000236925503	209262632	/nfs/dbraw/zinc/26/26/32/209262632.db2.gz	KOMLTUODQSJEAM-MLGOLLRUSA-N	-1	0	374.462	2.821	50	0		FFAARM
COc1cccc(-n2[nH][n-]c3c(=O)n(-c4ccc(C)c(C)c4)c(=O)c2=3)c1	ZINC000102820647	209242355	/nfs/dbraw/zinc/24/23/55/209242355.db2.gz	GLQNSHWKFXFICN-IRXDYDNUSA-N	-1	0	350.378	2.810	50	0		FFAARM
Cc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccccc4F)c=3c2=O)cc1C	ZINC000101418488	209224888	/nfs/dbraw/zinc/22/48/88/209224888.db2.gz	NHOKGYZPFLDVRX-SJORKVTESA-N	-1	0	352.369	2.936	50	0		FFAARM
CC(C)c1nnc(NC(=O)c2c([O-])c3cccc4c3n(c2=O)CCC4)s1	ZINC000100613825	209215166	/nfs/dbraw/zinc/21/51/66/209215166.db2.gz	MCJJBFQBSMMAOE-UHFFFAOYSA-N	-1	0	370.434	2.881	50	0		FFAARM
CC(C)CCn1c(CN2Cc3nc[nH]c3C[C@@H]2C(=O)[O-])nc2ccccc21	ZINC000097463494	209181871	/nfs/dbraw/zinc/18/18/71/209181871.db2.gz	YCILBZKRCUOZTQ-GOSISDBHSA-N	-1	0	367.453	2.817	50	0		FFAARM
Cc1ccccc1NC(=O)C1CCN(c2nc3[n-]cnc(=O)c3s2)CC1	ZINC000096331560	209152422	/nfs/dbraw/zinc/15/24/22/209152422.db2.gz	JCGRRYDBHVLXKB-UHFFFAOYSA-N	-1	0	369.450	2.955	50	0		FFAARM
COC(=O)[C@@H]1Oc2c(c(=O)oc3ccccc23)[C@H]1c1ccc(C(=O)[O-])cc1	ZINC000096335819	209151990	/nfs/dbraw/zinc/15/19/90/209151990.db2.gz	DLNHLZWTNXWJPT-RHSMWYFYSA-N	-1	0	366.325	2.557	50	0		FFAARM
COCc1c(C(=O)[O-])cnn1-c1ncc2c(n1)-c1ccccc1CCC2	ZINC000299780698	206646311	/nfs/dbraw/zinc/64/63/11/206646311.db2.gz	LCMYNKDOKALBEY-UHFFFAOYSA-N	-1	0	350.378	2.663	50	0		FFAARM
O=C([O-])[C@H]1COCCN1C(=O)OCC1c2ccccc2-c2ccccc21	ZINC000001420803	206881041	/nfs/dbraw/zinc/88/10/41/206881041.db2.gz	CJVIYWXADATNKP-GOSISDBHSA-N	-1	0	353.374	2.721	50	0		FFAARM
Cc1oc2cc3oc(=O)c(CCC(=O)N(C)CC(=O)[O-])c(C)c3cc2c1C	ZINC000002098509	206901037	/nfs/dbraw/zinc/90/10/37/206901037.db2.gz	WFDKFZWBQGLSEQ-UHFFFAOYSA-N	-1	0	371.389	2.940	50	0	biogenic	FFAARM
Cc1ccc(C(=O)Nc2ccc3c(c2)C(=O)N(CCC(=O)[O-])C3=O)cc1C	ZINC000002881183	206943215	/nfs/dbraw/zinc/94/32/15/206943215.db2.gz	AMAWCTKLVUZVHT-UHFFFAOYSA-N	-1	0	366.373	2.626	50	0		FFAARM
O=C([O-])[C@H]1[C@@H]2C=C[C@@]3(CN(c4ccc(C(F)(F)F)cc4Cl)C(=O)[C@@H]13)O2	ZINC000004237633	207008544	/nfs/dbraw/zinc/00/85/44/207008544.db2.gz	QLXZJAHCWHTALL-OHTBPHCPSA-N	-1	0	373.714	2.730	50	0		FFAARM
C[C@@H]1CCc2c(sc(NC(=O)[C@@H]3CC=CC[C@@H]3C(=O)[O-])c2C(N)=O)C1	ZINC000004173447	207004834	/nfs/dbraw/zinc/00/48/34/207004834.db2.gz	MOAACRFRNIIRHU-MXWKQRLJSA-N	-1	0	362.451	2.577	50	0		FFAARM
COc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccccc4Cl)c=3c2=O)cc1	ZINC000004483523	207021092	/nfs/dbraw/zinc/02/10/92/207021092.db2.gz	NZQBOKANXRQAPA-JKSUJKDBSA-N	-1	0	370.796	2.842	50	0		FFAARM
COc1cc(C)c(S(=O)(=O)Nc2ccc(OCC(=O)[O-])cc2)cc1C	ZINC000004569068	207028996	/nfs/dbraw/zinc/02/89/96/207028996.db2.gz	FWWDSSGMJXZJFW-UHFFFAOYSA-N	-1	0	365.407	2.576	50	0		FFAARM
Cc1cc(=O)n2nc(N[N-]C(=S)SCc3ccccc3)sc2n1	ZINC000004576158	207029034	/nfs/dbraw/zinc/02/90/34/207029034.db2.gz	KZQRMTHFPSLZAP-UHFFFAOYSA-N	-1	0	363.493	2.594	50	0		FFAARM
CCOc1ccc(-n2c(SCC(=O)[O-])nnc2-c2cccnc2)cc1	ZINC000005045938	207075117	/nfs/dbraw/zinc/07/51/17/207075117.db2.gz	DOJXGBJCTPGNPQ-UHFFFAOYSA-N	-1	0	356.407	2.905	50	0		FFAARM
O=C(CSc1nc(C(F)(F)F)cc(=O)[n-]1)Nc1ccc(F)cc1F	ZINC000005155156	207084643	/nfs/dbraw/zinc/08/46/43/207084643.db2.gz	VOIMTWMJABTDLA-UHFFFAOYSA-N	-1	0	365.283	2.798	50	0		FFAARM
CC1=C(C)C[C@H](C(=O)N2CCN(Cc3ccc(F)cc3)CC2)[C@@H](C(=O)[O-])C1	ZINC000006699449	207154709	/nfs/dbraw/zinc/15/47/09/207154709.db2.gz	BIWKGQZHLMGLGB-OALUTQOASA-N	-1	0	374.456	2.917	50	0		FFAARM
O=c1[nH]c2ccc(S(=O)(=O)[N-]c3ccccc3OC(F)(F)F)cc2[nH]1	ZINC000009338447	207266863	/nfs/dbraw/zinc/26/68/63/207266863.db2.gz	ZRHQGJGTVWKODY-UHFFFAOYSA-N	-1	0	373.312	2.556	50	0		FFAARM
Cc1cc(C)cc(N2C(=O)C[C@@H](Sc3ncccc3C(=O)[O-])C2=O)c1	ZINC000009870428	207288542	/nfs/dbraw/zinc/28/85/42/207288542.db2.gz	WUQLIUGUODUZDO-CQSZACIVSA-N	-1	0	356.403	2.821	50	0		FFAARM
CCOc1cc2c(cc1[N-]S(=O)(=O)c1c(C)noc1C)O[C@@H](C)C2	ZINC000012508256	207384194	/nfs/dbraw/zinc/38/41/94/207384194.db2.gz	OHSUKSZIASNGFV-VIFPVBQESA-N	-1	0	352.412	2.814	50	0		FFAARM
CCc1nc(-c2csc(S(=O)(=O)[N-]c3ccc(Cl)cn3)c2)no1	ZINC000021701992	207777584	/nfs/dbraw/zinc/77/75/84/207777584.db2.gz	LSBPYQFXNKTLJZ-UHFFFAOYSA-N	-1	0	370.843	2.632	50	0		FFAARM
CNC(=O)c1cccc(NC(=O)C[C@](C)(C(=O)[O-])c2ccccc2)c1C	ZINC000030522271	208002770	/nfs/dbraw/zinc/00/27/70/208002770.db2.gz	OGMOVJBDMFBDDC-FQEVSTJZSA-N	-1	0	354.406	2.726	50	0		FFAARM
COc1cccc(-n2c(=O)c3[n-][nH]n(-c4cccc(Cl)c4)c=3c2=O)c1	ZINC000033114703	208073155	/nfs/dbraw/zinc/07/31/55/208073155.db2.gz	WSKUWHKKNDAKHO-HUUCEWRRSA-N	-1	0	356.769	2.846	50	0		FFAARM
CC[C@H](C)NC(=O)CCc1nnc(-c2cccc(OC(C)C)c2)[n-]c1=O	ZINC000034764341	208110132	/nfs/dbraw/zinc/11/01/32/208110132.db2.gz	VWQFRDWUGJXHMR-ZDUSSCGKSA-N	-1	0	358.442	2.879	50	0		FFAARM
O=C([O-])CCCNC(=O)CCn1ccc2ccc(Br)cc21	ZINC000036359392	208156883	/nfs/dbraw/zinc/15/68/83/208156883.db2.gz	SBYHILKDCFDGLB-UHFFFAOYSA-N	-1	0	353.216	2.775	50	0		FFAARM
O=C([O-])Cn1cc([C@@H](C(=O)[O-])[NH+]2CCSCC2)c2ccc(Cl)cc21	ZINC000036354084	208157215	/nfs/dbraw/zinc/15/72/15/208157215.db2.gz	AREIVBGFULUNGU-HNNXBMFYSA-N	-1	0	368.842	2.554	50	0		FFAARM
O=C([O-])C1CCN(C(=O)[C@H]2C[C@@H]2c2ccc(Br)cc2)CC1	ZINC000238029332	209358395	/nfs/dbraw/zinc/35/83/95/209358395.db2.gz	UZDHDNHZFSSDIO-KGLIPLIRSA-N	-1	0	352.228	2.876	50	0		FFAARM
Cn1ccnc1C(=O)c1ccc(NC(=O)Cc2ccccc2C(=O)[O-])cc1	ZINC000040158780	208239687	/nfs/dbraw/zinc/23/96/87/208239687.db2.gz	ZHECLIOWDSNOIJ-UHFFFAOYSA-N	-1	0	363.373	2.531	50	0		FFAARM
COc1cc2c(cc1OC)[C@@H](CC(=O)[O-])N(C(=O)c1ccc(C)n1C)CC2	ZINC000299395760	208291336	/nfs/dbraw/zinc/29/13/36/208291336.db2.gz	LKBYBNZWOSULEE-MRXNPFEDSA-N	-1	0	372.421	2.565	50	0		FFAARM
COc1ccc(-c2ccc(C(=O)N3CCO[C@H](CC(=O)[O-])C3)c(F)c2)cc1	ZINC000299748008	208342269	/nfs/dbraw/zinc/34/22/69/208342269.db2.gz	FUHGGCRCPNVTGR-MRXNPFEDSA-N	-1	0	373.380	2.817	50	0		FFAARM
O=C([O-])[C@@H]1c2ccccc2C(=O)N(C2CC2)[C@H]1c1ccc2c(c1)OCO2	ZINC000045923013	208342906	/nfs/dbraw/zinc/34/29/06/208342906.db2.gz	JHRFIVIKSLXTHD-MSOLQXFVSA-N	-1	0	351.358	2.943	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)CCc1ccc2c(c1)OCCO2)c1ccc(F)cc1	ZINC000299745997	208343106	/nfs/dbraw/zinc/34/31/06/208343106.db2.gz	UQCAVBSSPFPXIG-INIZCTEOSA-N	-1	0	373.380	2.862	50	0		FFAARM
O=C([N-]OCc1ccccc1)C1=NN(Cc2ccc(F)cc2)C(=O)CC1	ZINC000045061982	208324238	/nfs/dbraw/zinc/32/42/38/208324238.db2.gz	JAZOAQMDEIYLJK-UHFFFAOYSA-N	-1	0	355.369	2.552	50	0		FFAARM
O=C([O-])CCN(Cc1cccc(F)c1F)C(=O)c1cc(C2CC2)on1	ZINC000299753319	208363807	/nfs/dbraw/zinc/36/38/07/208363807.db2.gz	XTYNZKQJDKFVKH-UHFFFAOYSA-N	-1	0	350.321	2.947	50	0		FFAARM
Cc1cc(Br)c([O-])c(C(=O)NCc2cccnc2N(C)C)c1	ZINC000047832917	208384645	/nfs/dbraw/zinc/38/46/45/208384645.db2.gz	ABEBSLHBJZQGBJ-UHFFFAOYSA-N	-1	0	364.243	2.854	50	0		FFAARM
COc1cc(/C=C2\C(=O)[N-]N(c3ccc(F)cc3)C2=O)cc(Cl)c1O	ZINC000000997390	209386238	/nfs/dbraw/zinc/38/62/38/209386238.db2.gz	UPIRBAVLOCIMFU-WUXMJOGZSA-N	-1	0	362.744	2.655	50	0		FFAARM
CC(C)Oc1ccccc1CNC(=O)c1ccc2c(c1)[n-]c(=S)[nH]c2=O	ZINC000065474921	208682612	/nfs/dbraw/zinc/68/26/12/208682612.db2.gz	MKNZNCVQLTUYEZ-UHFFFAOYSA-N	-1	0	369.446	2.929	50	0		FFAARM
Cc1c(C(=O)[O-])sc2ncnc(NCc3ccccc3-n3cncn3)c12	ZINC000067447002	208706261	/nfs/dbraw/zinc/70/62/61/208706261.db2.gz	YXQYQTIHCDYWAD-UHFFFAOYSA-N	-1	0	366.406	2.891	50	0		FFAARM
COc1ccc(NC(=O)Cc2ccccc2C(=O)[O-])cc1-c1nnc(C)o1	ZINC000071286919	208760814	/nfs/dbraw/zinc/76/08/14/208760814.db2.gz	DFZSCFJZZWJPMB-UHFFFAOYSA-N	-1	0	367.361	2.933	50	0		FFAARM
Cc1ccc(C(=O)N2CCC(C(=O)[O-])(n3ccc(C(C)(C)C)n3)CC2)cn1	ZINC000072410082	208850418	/nfs/dbraw/zinc/85/04/18/208850418.db2.gz	CZQOHCLAZLNFBM-UHFFFAOYSA-N	-1	0	370.453	2.600	50	0		FFAARM
Cc1ccc(F)c(OC2(C(=O)[O-])CCN(C(=O)N3CCCC3)CC2)c1	ZINC000072423643	208854693	/nfs/dbraw/zinc/85/46/93/208854693.db2.gz	HCRXQCFRTGKBFG-UHFFFAOYSA-N	-1	0	350.390	2.648	50	0		FFAARM
Cc1cccc(OC2(C(=O)[O-])CCN(C(=O)CCn3cccc3)CC2)c1	ZINC000072431716	208859259	/nfs/dbraw/zinc/85/92/59/208859259.db2.gz	ZHECDUYOGKSYRN-UHFFFAOYSA-N	-1	0	356.422	2.711	50	0		FFAARM
Cc1ccc(C)c(C(=O)N2CCC3(CCC(=O)N([C@H](C)C(=O)[O-])C3)CC2)c1	ZINC000091872310	209002651	/nfs/dbraw/zinc/00/26/51/209002651.db2.gz	JCCNBDBYSBXFMD-MRXNPFEDSA-N	-1	0	372.465	2.621	50	0		FFAARM
C[C@@H]1CCN(S(=O)(=O)[N-]c2cc(Cl)ccc2C(=O)N2CCCC2)C1	ZINC000095993782	209094096	/nfs/dbraw/zinc/09/40/96/209094096.db2.gz	YJPXLVKUBLGNER-GFCCVEGCSA-N	-1	0	371.890	2.575	50	0		FFAARM
COc1ccccc1COc1cccc([C@@H](C(=O)[O-])N2CCOCC2)c1	ZINC000095362585	209028625	/nfs/dbraw/zinc/02/86/25/209028625.db2.gz	LNQRFWIGMZLANE-IBGZPJMESA-N	-1	0	357.406	2.732	50	0		FFAARM
O=C([O-])c1cccc([C@H]2CCCN(CC(=O)NCc3cccs3)C2)c1	ZINC000095389234	209046232	/nfs/dbraw/zinc/04/62/32/209046232.db2.gz	MCHBCVDJJUFIQS-INIZCTEOSA-N	-1	0	358.463	2.942	50	0		FFAARM
O=C([O-])[C@@]12CN(C(=O)c3cc(F)ccc3F)C[C@@H]1c1ccccc1OC2	ZINC000095366592	209030792	/nfs/dbraw/zinc/03/07/92/209030792.db2.gz	BMAPRQDOVFFPMK-AUUYWEPGSA-N	-1	0	359.328	2.668	50	0		FFAARM
COC(=O)c1cscc1[N-]S(=O)(=O)c1cc(OC)c(OC)cc1C	ZINC000095455624	209052130	/nfs/dbraw/zinc/05/21/30/209052130.db2.gz	YLWGVDYKNCUERK-UHFFFAOYSA-N	-1	0	371.436	2.661	50	0		FFAARM
Cc1nn(C)c(C)c1C[C@@H](C)C(=O)N[C@H](C(=O)[O-])c1ccccc1Cl	ZINC000095464028	209055483	/nfs/dbraw/zinc/05/54/83/209055483.db2.gz	LMNPMQZBKUOUCZ-HWPZZCPQSA-N	-1	0	363.845	2.811	50	0		FFAARM
O=S(=O)([N-]c1noc(C2CC2)n1)c1c(F)cccc1Br	ZINC000095466360	209055651	/nfs/dbraw/zinc/05/56/51/209055651.db2.gz	DXCFKXAIWAWTET-UHFFFAOYSA-N	-1	0	362.180	2.649	50	0		FFAARM
O=C([O-])[C@@]1(CCc2ccccc2)CCCN(c2ncnc3nc[nH]c32)C1	ZINC000071758859	136140502	/nfs/dbraw/zinc/14/05/02/136140502.db2.gz	QCEXUVBOIUSQHI-LJQANCHMSA-N	-1	0	351.410	2.657	50	0		FFAARM
CN1C(C(=O)N2CCCc3ccccc32)=C([O-])c2ccccc2S1(=O)=O	ZINC000071769134	136140969	/nfs/dbraw/zinc/14/09/69/136140969.db2.gz	RFDMZMWBWLWFDB-UHFFFAOYSA-N	-1	0	370.430	2.527	50	0		FFAARM
O=C([O-])C1(Oc2ccc3c(c2)CCC3)CCN(c2ncc(F)cn2)CC1	ZINC000072407208	136145203	/nfs/dbraw/zinc/14/52/03/136145203.db2.gz	PYPMOTQARZUKLK-UHFFFAOYSA-N	-1	0	357.385	2.607	50	0		FFAARM
O=C([O-])[C@H]1CC2(CN1C(=O)C1CC1)CCN(c1nccc3occc31)CC2	ZINC000072439641	136147765	/nfs/dbraw/zinc/14/77/65/136147765.db2.gz	FSVSPZWPZGVHLI-OAHLLOKOSA-N	-1	0	369.421	2.510	50	0		FFAARM
Cc1cccc(OC2(C(=O)[O-])CCN(c3ncnc4[nH]ccc43)CC2)c1	ZINC000072473983	136149061	/nfs/dbraw/zinc/14/90/61/136149061.db2.gz	RMOZQKHOPQAUNC-UHFFFAOYSA-N	-1	0	352.394	2.769	50	0		FFAARM
O=C(Nc1cccnc1)c1cncc([N-]S(=O)(=O)c2ccccc2)c1	ZINC000020846764	263382378	/nfs/dbraw/zinc/38/23/78/263382378.db2.gz	LSTHJVXNJRHMKK-UHFFFAOYSA-N	-1	0	354.391	2.530	50	0		FFAARM
CCCC[C@H](CC(=O)[O-])NC(=O)N1CCN(Cc2cccc(F)c2)CC1	ZINC000426583956	263639800	/nfs/dbraw/zinc/63/98/00/263639800.db2.gz	GZAWSJNWDLDUKK-QGZVFWFLSA-N	-1	0	365.449	2.686	50	0		FFAARM
O=C([O-])C1CCN(C(=O)C2(c3ccc(Br)cc3)CC2)CC1	ZINC000037433335	506426433	/nfs/dbraw/zinc/42/64/33/506426433.db2.gz	NQCDXIZOGVNVAZ-UHFFFAOYSA-N	-1	0	352.228	2.804	50	0		FFAARM
Cc1ccc(OCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)[O-])cc1	ZINC000000626132	506224578	/nfs/dbraw/zinc/22/45/78/506224578.db2.gz	XYEFUSIUQLPQHR-SFHVURJKSA-N	-1	0	352.390	2.667	50	0	biogenic	FFAARM
CCN(CC)S(=O)(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1	ZINC000000687770	506227670	/nfs/dbraw/zinc/22/76/70/506227670.db2.gz	NBWDEJVYMHJBGH-UHFFFAOYSA-N	-1	0	374.509	2.579	50	0		FFAARM
O=C([O-])[C@H]1Cn2c(nc3c(c2=O)C2(CCCC2)Cc2ccccc2-3)S1	ZINC000000912149	506238460	/nfs/dbraw/zinc/23/84/60/506238460.db2.gz	YZNOCZYSARSFSL-CYBMUJFWSA-N	-1	0	354.431	2.837	50	0	biogenic	FFAARM
O=C([O-])[C@H](Cc1ccccc1)NS(=O)(=O)c1ccccc1C(F)(F)F	ZINC000000953446	506240055	/nfs/dbraw/zinc/24/00/55/506240055.db2.gz	OBPSPXVWEQDGSQ-ZDUSSCGKSA-N	-1	0	373.352	2.680	50	0		FFAARM
CC[C@@]1(c2ccccc2)C(=O)[N-]C(=O)N(C(=O)c2cccc(Cl)c2)C1=O	ZINC000001216351	506256969	/nfs/dbraw/zinc/25/69/69/506256969.db2.gz	CVIJAXUUHVXWDD-LJQANCHMSA-N	-1	0	370.792	2.907	50	0		FFAARM
O=c1ccc(-c2csc(S(=O)(=O)[N-]c3ccc(Cl)cc3)c2)n[nH]1	ZINC000065119278	506261812	/nfs/dbraw/zinc/26/18/12/506261812.db2.gz	RGTFFFLONZVMOH-UHFFFAOYSA-N	-1	0	367.839	2.953	50	0		FFAARM
CCc1nc2sc(C)nn2c1S(=O)(=O)[N-]c1ccc(F)c(C)c1	ZINC000065183911	506267892	/nfs/dbraw/zinc/26/78/92/506267892.db2.gz	KXVPJBACNQQECP-UHFFFAOYSA-N	-1	0	354.432	2.910	50	0		FFAARM
CCc1nn2c(nc(C)c2S(=O)(=O)[N-]c2ccc(C)c(F)c2)s1	ZINC000065183772	506267987	/nfs/dbraw/zinc/26/79/87/506267987.db2.gz	UZRSEDHLPMVMKB-UHFFFAOYSA-N	-1	0	354.432	2.910	50	0		FFAARM
CCc1nn2c(nc(C)c2S(=O)(=O)[N-]c2ccc(F)cc2F)s1	ZINC000065183733	506268095	/nfs/dbraw/zinc/26/80/95/506268095.db2.gz	MGONKMDDDLQXBI-UHFFFAOYSA-N	-1	0	358.395	2.741	50	0		FFAARM
COc1ccc([N-]S(=O)(=O)c2c(C)nc3sc(C)nn32)cc1Cl	ZINC000065183635	506268436	/nfs/dbraw/zinc/26/84/36/506268436.db2.gz	VJFRXLGARVOABP-UHFFFAOYSA-N	-1	0	372.859	2.870	50	0		FFAARM
Cc1oc2cc3oc(=O)c(CC(=O)NCCC(=O)[O-])c(C)c3cc2c1C	ZINC000002096374	506272736	/nfs/dbraw/zinc/27/27/36/506272736.db2.gz	YPRMIKSZAPUUFV-UHFFFAOYSA-N	-1	0	357.362	2.598	50	0	biogenic	FFAARM
COc1ccc(-c2c(C(=O)[O-])nnn2-c2ccc(OC)c(OC)c2)cc1	ZINC000065288232	506283043	/nfs/dbraw/zinc/28/30/43/506283043.db2.gz	AKTODWOTQIQSRB-UHFFFAOYSA-N	-1	0	355.350	2.658	50	0		FFAARM
COc1ccc2[nH]c(SCC(=O)Nc3ccc(O)c(C(=O)[O-])c3)nc2c1	ZINC000002753285	506289354	/nfs/dbraw/zinc/28/93/54/506289354.db2.gz	KPGNACCOMWZKTJ-UHFFFAOYSA-N	-1	0	373.390	2.706	50	0		FFAARM
CCc1nn(C)c(Cl)c1[C@@H]1CC(=O)Nc2cc(OCC(=O)[O-])ccc21	ZINC000065371323	506290452	/nfs/dbraw/zinc/29/04/52/506290452.db2.gz	HTVSNWLVQCJVRW-LLVKDONJSA-N	-1	0	363.801	2.573	50	0		FFAARM
CCCn1nc(C)c(CNc2nc(N)nc3ccc(C(=O)[O-])cc32)c1C	ZINC000065462840	506303286	/nfs/dbraw/zinc/30/32/86/506303286.db2.gz	ACUCUQCYQMWSNV-UHFFFAOYSA-N	-1	0	354.414	2.746	50	0		FFAARM
Cc1ccc(-c2nc(N[C@@H](C)c3nnn[n-]3)ncc2-c2ccc(N)nc2)cc1	ZINC000065469493	506305340	/nfs/dbraw/zinc/30/53/40/506305340.db2.gz	JPVSLTDNGLHBHQ-LBPRGKRZSA-N	-1	0	373.424	2.782	50	0		FFAARM
COc1ccc(N(CCC(=O)[O-])S(=O)(=O)c2ccc(C)cc2C)cc1	ZINC000003886264	506351859	/nfs/dbraw/zinc/35/18/59/506351859.db2.gz	MXODPTITDMYECG-UHFFFAOYSA-N	-1	0	363.435	2.982	50	0		FFAARM
CC/C(NN1CCCCCC1)=C1/C(=O)[N-]C(=O)N(c2ccccc2C)C1=O	ZINC000009316589	506689023	/nfs/dbraw/zinc/68/90/23/506689023.db2.gz	WDDBBHLNYJUTIV-BMRADRMJSA-N	-1	0	370.453	2.623	50	0		FFAARM
COC(=O)Nc1cccc([N-]S(=O)(=O)c2cc(OC)ccc2OC)c1	ZINC000055637619	506809552	/nfs/dbraw/zinc/80/95/52/506809552.db2.gz	BSOYZAASOUEJCP-UHFFFAOYSA-N	-1	0	366.395	2.683	50	0		FFAARM
Cc1n[nH]c(C)c1[C@H](NC(=O)c1csc(-c2cccs2)n1)C(=O)[O-]	ZINC000067490246	506899231	/nfs/dbraw/zinc/89/92/31/506899231.db2.gz	YNZOJERMBWRBMA-LBPRGKRZSA-N	-1	0	362.436	2.767	50	0		FFAARM
COc1ccccc1[C@H](C)NC(=O)COc1ccc(C(=O)[O-])cc1OC	ZINC000013420244	506940765	/nfs/dbraw/zinc/94/07/65/506940765.db2.gz	GJTQMQOPHMXKRJ-LBPRGKRZSA-N	-1	0	359.378	2.658	50	0		FFAARM
O=C([O-])[C@@H]1CC=CC[C@H]1C(=O)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000013737112	506956454	/nfs/dbraw/zinc/95/64/54/506956454.db2.gz	MKUFWNNCCCXWQI-IAGOWNOFSA-N	-1	0	362.857	2.651	50	0		FFAARM
CCn1nc(C(=O)[O-])c2c1CCN(C(=O)CCCCc1ccccc1)C2	ZINC000067818484	507017595	/nfs/dbraw/zinc/01/75/95/507017595.db2.gz	QQYLSLHSBWQOTQ-UHFFFAOYSA-N	-1	0	355.438	2.899	50	0		FFAARM
CCN(CC)S(=O)(=O)c1ccc(NC(=O)CC(C)(C)CC(=O)[O-])cc1	ZINC000016479201	507093033	/nfs/dbraw/zinc/09/30/33/507093033.db2.gz	WNJHFPHTCSZRDU-UHFFFAOYSA-N	-1	0	370.471	2.547	50	0		FFAARM
Cc1sc(NC(=O)[C@H]2CC(C)=C(C)C[C@H]2C(=O)[O-])c(C(N)=O)c1C	ZINC000017072721	507112667	/nfs/dbraw/zinc/11/26/67/507112667.db2.gz	CXJGDABQUUDLPG-NWDGAFQWSA-N	-1	0	350.440	2.850	50	0		FFAARM
O=C([O-])CCCC(=O)Nc1sc2c(c1C(=O)NC1CC1)CCCC2	ZINC000017072713	507113772	/nfs/dbraw/zinc/11/37/72/507113772.db2.gz	LNDZRAJHKFXNDP-UHFFFAOYSA-N	-1	0	350.440	2.713	50	0		FFAARM
C[C@@H](c1ccccc1)N1C(=O)C[C@@H](Sc2ncccc2C(=O)[O-])C1=O	ZINC000019880972	507205602	/nfs/dbraw/zinc/20/56/02/507205602.db2.gz	OZFMZIOAGPZXNE-SMDDNHRTSA-N	-1	0	356.403	2.761	50	0		FFAARM
CC[C@@H](C)n1c2nc(-c3cccnc3)cc(C(=O)[O-])c2c(=O)[nH]c1=S	ZINC000020615427	507230456	/nfs/dbraw/zinc/23/04/56/507230456.db2.gz	GLAQJHYFJVBALO-SECBINFHSA-N	-1	0	356.407	2.811	50	0		FFAARM
O=C(CCn1c(=O)c2ccccc2[n-]c1=S)Nc1nnc(C2CC2)s1	ZINC000021292886	507250194	/nfs/dbraw/zinc/25/01/94/507250194.db2.gz	VZMNBPPWJHNVHM-UHFFFAOYSA-N	-1	0	373.463	2.817	50	0		FFAARM
C[C@@H]1CN([C@@H](c2sc3ncnn3c2[O-])c2cccc(F)c2)C[C@H](C)O1	ZINC000022609566	507300604	/nfs/dbraw/zinc/30/06/04/507300604.db2.gz	VCWKKHRFLOLDAF-UHIISALHSA-N	-1	0	362.430	2.834	50	0		FFAARM
COc1ccc(S(=O)(=O)N2CCCc3cc(C)ccc32)cc1C(=O)[O-]	ZINC000047949115	507422646	/nfs/dbraw/zinc/42/26/46/507422646.db2.gz	LSSNLTBQQRPAII-UHFFFAOYSA-N	-1	0	361.419	2.843	50	0		FFAARM
COc1ccc(C(=O)[O-])cc1S(=O)(=O)N1CCc2ccc(Cl)cc21	ZINC000058496073	507427621	/nfs/dbraw/zinc/42/76/21/507427621.db2.gz	VBXJHUVQVPKTNU-UHFFFAOYSA-N	-1	0	367.810	2.798	50	0		FFAARM
O=C([O-])c1ccc2c(c1)S[C@@H](CC(=O)Nc1ccc(F)cc1)C(=O)N2	ZINC000061719395	507633631	/nfs/dbraw/zinc/63/36/31/507633631.db2.gz	OGRQVHBNSRHVGL-AWEZNQCLSA-N	-1	0	360.366	2.966	50	0		FFAARM
CCCCC[C@H](O)/C=C/[C@H]1O[C@H](O)C[C@@H](O)[C@@H]1C/C=C\CCCC(=O)[O-]	ZINC000027642764	507673773	/nfs/dbraw/zinc/67/37/73/507673773.db2.gz	XNRNNGPBEPRNAR-VXNSILGVSA-N	-1	0	370.486	2.769	50	0		FFAARM
COc1ccc(C(=O)NC2CCCC2)cc1NC(=O)[C@@H]1[C@@H](C(=O)[O-])C1(C)C	ZINC000071287537	507700012	/nfs/dbraw/zinc/70/00/12/507700012.db2.gz	AWUJXOXSTGRUNI-HOTGVXAUSA-N	-1	0	374.437	2.663	50	0		FFAARM
O=C([O-])c1ccccc1CC(=O)NCc1noc(-c2ccc(Cl)cc2)n1	ZINC000071285683	507700863	/nfs/dbraw/zinc/70/08/63/507700863.db2.gz	KOZWFSWMSLHZCL-UHFFFAOYSA-N	-1	0	371.780	2.947	50	0		FFAARM
CC1(C)[C@H](C(=O)[O-])[C@H]1C(=O)Nc1nc(-c2nc3ccccc3[nH]2)cs1	ZINC000071282988	507701158	/nfs/dbraw/zinc/70/11/58/507701158.db2.gz	HKTAXUCDVCQXCX-RYUDHWBXSA-N	-1	0	356.407	2.982	50	0		FFAARM
CC(=O)c1cn(CC(=O)N[C@H](C(=O)[O-])c2ccccc2)c2ccccc12	ZINC000071375806	507702711	/nfs/dbraw/zinc/70/27/11/507702711.db2.gz	VQFQARALCWYIER-IBGZPJMESA-N	-1	0	350.374	2.786	50	0		FFAARM
Cc1cc2nc(CN3CCC[C@@H]3c3nc4cc(F)ccc4[nH]3)cc(=O)n2[n-]1	ZINC000072163869	507767147	/nfs/dbraw/zinc/76/71/47/507767147.db2.gz	VFWMRNDULVJKKJ-MRXNPFEDSA-N	-1	0	366.400	2.684	50	0		FFAARM
O=C([O-])[C@@H]1c2nc[nH]c2CCN1C(=O)CCc1ccc(-c2cccs2)o1	ZINC000072424862	507788607	/nfs/dbraw/zinc/78/86/07/507788607.db2.gz	WUYVVYCYXFZFNT-KRWDZBQOSA-N	-1	0	371.418	2.874	50	0		FFAARM
CC(C)(C)c1ccn(C2(C(=O)[O-])CCN(C(=O)[C@@H]3CC34CCC4)CC2)n1	ZINC000072458065	507793588	/nfs/dbraw/zinc/79/35/88/507793588.db2.gz	GNMZMCYYYXRUKH-AWEZNQCLSA-N	-1	0	359.470	2.773	50	0		FFAARM
Cc1ccc(OC2(C(=O)[O-])CCN(Cc3coc(C(C)C)n3)CC2)cn1	ZINC000072463361	507794465	/nfs/dbraw/zinc/79/44/65/507794465.db2.gz	SFOZJPHXYKQGQX-UHFFFAOYSA-N	-1	0	359.426	3.000	50	0		FFAARM
O=C([O-])c1ccnc(-c2ccnc(NCc3ccc4c(c3)OCO4)n2)c1	ZINC000072463673	507794884	/nfs/dbraw/zinc/79/48/84/507794884.db2.gz	DDEJYVNXFIELAF-UHFFFAOYSA-N	-1	0	350.334	2.578	50	0		FFAARM
CC(C)(C)c1ccn(C2(C(=O)[O-])CCN(C(=O)[C@H]3CC=CCC3)CC2)n1	ZINC000072475749	507796314	/nfs/dbraw/zinc/79/63/14/507796314.db2.gz	BLWATTCNVJCPNR-HNNXBMFYSA-N	-1	0	359.470	2.939	50	0		FFAARM
COc1cccc([C@@H]2CN(C(=O)c3cccnc3SC)C[C@H]2C(=O)[O-])c1	ZINC000091746789	508007373	/nfs/dbraw/zinc/00/73/73/508007373.db2.gz	VFXBWLZJFPSPBP-JKSUJKDBSA-N	-1	0	372.446	2.753	50	0		FFAARM
CN(C)S(=O)(=O)c1cccc(C(=O)/C=C\c2ccc(C(=O)[O-])cc2)c1	ZINC000096297958	508213186	/nfs/dbraw/zinc/21/31/86/508213186.db2.gz	UDHMGJXQGXDFJI-FLIBITNWSA-N	-1	0	359.403	2.531	50	0		FFAARM
CC(C)C(=O)N1CCc2c(nc3cc(-c4ccccc4Cl)[n-]n3c2=O)C1	ZINC000097151903	508220098	/nfs/dbraw/zinc/22/00/98/508220098.db2.gz	KXJVHFNCIQZBHZ-UHFFFAOYSA-N	-1	0	370.840	2.884	50	0		FFAARM
COc1cc2nc(-c3ccc(CCC(=O)[O-])cc3)nc(N)c2cc1OC	ZINC000214992438	509241387	/nfs/dbraw/zinc/24/13/87/509241387.db2.gz	YWJGMOUZSLNFQS-UHFFFAOYSA-N	-1	0	353.378	2.913	50	0		FFAARM
COc1ccc(-c2nc(C(=O)[N-]S(=O)(=O)CC3CCC3)c(C)o2)cc1	ZINC000164953721	509546799	/nfs/dbraw/zinc/54/67/99/509546799.db2.gz	YJQBKWVKWQVUPM-UHFFFAOYSA-N	-1	0	364.423	2.518	50	0		FFAARM
Cc1oc(C)c(S(=O)(=O)N[C@H]2CCC[C@H](C(F)(F)F)C2)c1C(=O)[O-]	ZINC000237647236	509700989	/nfs/dbraw/zinc/70/09/89/509700989.db2.gz	LSGMSBXMNLNBCV-UWVGGRQHSA-N	-1	0	369.361	2.994	50	0		FFAARM
O=C([O-])Cc1ccc(S(=O)(=O)N[C@H]2CCC[C@@H](C(F)(F)F)C2)s1	ZINC000238107195	509821303	/nfs/dbraw/zinc/82/13/03/509821303.db2.gz	OOAUEXNPNNEZFV-BDAKNGLRSA-N	-1	0	371.402	2.775	50	0		FFAARM
O=S(=O)([N-][C@@H](Cc1ccccc1)[C@H]1C[C@H](O)C1)c1c(F)cccc1F	ZINC000244898799	509876061	/nfs/dbraw/zinc/87/60/61/509876061.db2.gz	ZBUOVPSCLAJZKS-ZQIUZPCESA-N	-1	0	367.417	2.625	50	0		FFAARM
Cc1ccc(C(=O)N(C)C)cc1NC(=O)CCc1ccccc1C(=O)[O-]	ZINC000262753732	510398299	/nfs/dbraw/zinc/39/82/99/510398299.db2.gz	OOGZRPMHAZRSHC-UHFFFAOYSA-N	-1	0	354.406	2.966	50	0		FFAARM
O=C([O-])[C@@]12CN(C(=O)c3ncccc3O)C[C@@H]1C[C@@H](c1ccccc1)CC2	ZINC000426408958	513931991	/nfs/dbraw/zinc/93/19/91/513931991.db2.gz	OVMCEAJPNXLIFQ-QYWGDWMGSA-N	-1	0	366.417	2.898	50	0		FFAARM
O=C([O-])Cn1ccc([C@@H]2CCCN(C(=O)Cc3ccccc3Cl)C2)n1	ZINC000426563450	513981438	/nfs/dbraw/zinc/98/14/38/513981438.db2.gz	NLMYIJYHZXBKRU-CQSZACIVSA-N	-1	0	361.829	2.570	50	0		FFAARM
CC(C)S(=O)(=O)c1ccccc1NC(=O)NC1CCC(C(=O)[O-])CC1	ZINC000517719587	516423802	/nfs/dbraw/zinc/42/38/02/516423802.db2.gz	BZJVBZPKSQXKSK-UHFFFAOYSA-N	-1	0	368.455	2.634	50	0		FFAARM
NC(=O)C[C@H]1CCCCN1C(=O)c1cccc(-c2ccccc2C(=O)[O-])c1	ZINC000584894742	518527868	/nfs/dbraw/zinc/52/78/68/518527868.db2.gz	GXADHFMHSNMWPZ-MRXNPFEDSA-N	-1	0	366.417	2.922	50	0		FFAARM
CCC[C@@H](C(=O)NCCc1ccc(OCC(=O)[O-])cc1)c1ccccn1	ZINC000585139538	518545896	/nfs/dbraw/zinc/54/58/96/518545896.db2.gz	VNXWSOLNBPYTHX-QGZVFWFLSA-N	-1	0	356.422	2.788	50	0		FFAARM
O=C([O-])c1cnc(C(=O)N2CCC[C@@H]2Cc2c(F)cccc2Cl)cn1	ZINC000568389810	519016022	/nfs/dbraw/zinc/01/60/22/519016022.db2.gz	ARGKCCLUYSCQAU-SNVBAGLBSA-N	-1	0	363.776	2.815	50	0		FFAARM
COc1ccc(S(=O)(=O)[N-]c2nc(C)c(C)s2)cc1NC(C)=O	ZINC000028248885	519229501	/nfs/dbraw/zinc/22/95/01/519229501.db2.gz	FOEXYLQPTCOMRY-UHFFFAOYSA-N	-1	0	355.441	2.528	50	0		FFAARM
COC(=O)c1cc(S(=O)(=O)[N-]c2cccnc2Nc2ccccc2)c[nH]1	ZINC000089404296	521916129	/nfs/dbraw/zinc/91/61/29/521916129.db2.gz	UNMUCUJLQYMLRI-UHFFFAOYSA-N	-1	0	372.406	2.741	50	0		FFAARM
C[C@@H]1C[C@H](C(=O)N[C@H](c2ccccc2)c2cccc(F)c2)O[C@H]1C(=O)[O-]	ZINC000630152326	522658275	/nfs/dbraw/zinc/65/82/75/522658275.db2.gz	IZGLHBPFUFUVPA-BDQAWRDZSA-N	-1	0	357.381	2.910	50	0		FFAARM
C[C@@H](Cc1ccccc1C(F)(F)F)N(C)C(=O)c1cnc(C(=O)[O-])cn1	ZINC000630300093	522777115	/nfs/dbraw/zinc/77/71/15/522777115.db2.gz	PDSSFOTZNBZSON-JTQLQIEISA-N	-1	0	367.327	2.897	50	0		FFAARM
COC[C@@H](C)N(C(=O)c1cccc(C(=O)[O-])n1)[C@@H]1CCc2ccccc21	ZINC000630305936	522780139	/nfs/dbraw/zinc/78/01/39/522780139.db2.gz	UJSOJPDBCRAUCR-FZKQIMNGSA-N	-1	0	354.406	2.944	50	0		FFAARM
O=C([O-])[C@@H]1CCCN1CC(=O)NCc1ccc(-c2ccc(Cl)cc2)o1	ZINC000262686819	526275170	/nfs/dbraw/zinc/27/51/70/526275170.db2.gz	YERGFAPAZOSQRQ-HNNXBMFYSA-N	-1	0	362.813	2.765	50	0		FFAARM
O=C([O-])[C@@H]1CCN(C(=O)c2ccn(-c3ccc(Cl)c(Cl)c3)n2)C1	ZINC000269195896	526278964	/nfs/dbraw/zinc/27/89/64/526278964.db2.gz	PTVQGFBAGLHLDZ-SECBINFHSA-N	-1	0	354.193	2.726	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)CCc2cccs2)C[C@H]1c1ccc2c(c1)OCO2	ZINC000091445229	526284748	/nfs/dbraw/zinc/28/47/48/526284748.db2.gz	QITKHRJEGNBRCL-LSDHHAIUSA-N	-1	0	373.430	2.736	50	0		FFAARM
O=C([O-])C[C@@H]1CN(C(=O)[C@H]2C[C@H]2c2cccc(Cl)c2Cl)CCO1	ZINC000268942534	527630746	/nfs/dbraw/zinc/63/07/46/527630746.db2.gz	FTHODCZSPUCXTO-USWWRNFRSA-N	-1	0	358.221	2.799	50	0		FFAARM
O=C([O-])[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCOc2ccccc21	ZINC000299742879	527648299	/nfs/dbraw/zinc/64/82/99/527648299.db2.gz	JBHXTLUKQBVRSR-FUHWJXTLSA-N	-1	0	364.401	2.846	50	0		FFAARM
CC(C)Oc1ccccc1[C@@H](C(=O)[O-])N1CCN(c2ccccn2)CC1	ZINC000095379987	535063309	/nfs/dbraw/zinc/06/33/09/535063309.db2.gz	DHQWWAJXVIJZTR-IBGZPJMESA-N	-1	0	355.438	2.817	50	0		FFAARM
COC(=O)C[C@@H](c1ccccc1Cl)c1c(=O)nc2ccccn2c1[O-]	ZINC000205975795	570555124	/nfs/dbraw/zinc/55/51/24/570555124.db2.gz	ZEFDTADPADDORD-LBPRGKRZSA-N	-1	0	358.781	2.749	50	0		FFAARM
Cc1cc(=O)n2[n-]cc(C(=O)Nc3ccc(Br)cc3C)c2n1	ZINC000102905480	570841386	/nfs/dbraw/zinc/84/13/86/570841386.db2.gz	JTOVQLUGRVHWMK-UHFFFAOYSA-N	-1	0	361.199	2.654	50	0		FFAARM
O=C(Cc1c[nH]c2ccccc12)Nc1cccc(Cn2[n-]c(=O)ccc2=O)c1	ZINC000048203994	570936666	/nfs/dbraw/zinc/93/66/66/570936666.db2.gz	TVCNUYWNMJOACX-UHFFFAOYSA-N	-1	0	374.400	2.660	50	0		FFAARM
CS(=O)(=O)[C@H]1CCC[C@@H](NC(=O)c2ccc3[n-]c(=S)oc3c2)C1	ZINC000073930098	571138990	/nfs/dbraw/zinc/13/89/90/571138990.db2.gz	SFBPURUEVAYNSH-MNOVXSKESA-N	-1	0	354.453	2.576	50	0		FFAARM
O=C([O-])c1ccc(CC(=O)N2CCCN(C(=O)CC3CCCC3)CC2)cc1	ZINC000262948136	962033358	/nfs/dbraw/zinc/03/33/58/962033358.db2.gz	CAPOCFVUPIEZTQ-UHFFFAOYSA-N	-1	0	372.465	2.569	50	0		FFAARM
COc1ccc(/C=C(/C#N)C(=O)Nc2ccc(C(=O)[O-])cc2)cc1OC	ZINC000096663323	977026048	/nfs/dbraw/zinc/02/60/48/977026048.db2.gz	MQIDHPNQKBKUSI-ZROIWOOFSA-N	-1	0	352.346	2.948	50	0		FFAARM
COc1ccccc1OCc1nc(-c2cc(C(C)(C)C)[nH]c(=O)n2)n[nH]1	ZINC000824827493	999266354	/nfs/dbraw/zinc/26/63/54/999266354.db2.gz	CBUPQIKTZQNJGV-UHFFFAOYSA-N	-1	0	355.398	2.852	50	0		FFAARM
Cc1ccc(C(=O)Nc2ccc(S(=O)(=O)[N-]c3cc(C)on3)cc2)o1	ZINC000001111970	219371230	/nfs/dbraw/zinc/37/12/30/219371230.db2.gz	OEJDFWCZMPVXGK-UHFFFAOYSA-N	-1	0	361.379	2.938	50	0		FFAARM
O=C([O-])c1cc(S(=O)(=O)N2CCCCCC2)ccc1Br	ZINC000000753277	209482085	/nfs/dbraw/zinc/48/20/85/209482085.db2.gz	AABQOKSTOUWPHF-UHFFFAOYSA-N	-1	0	362.245	2.712	50	0		FFAARM
Cc1ccccc1CSc1nc(N)c(NC(=O)c2ccco2)c(=O)[n-]1	ZINC000006309507	209451169	/nfs/dbraw/zinc/45/11/69/209451169.db2.gz	IMASFJPSXFWJFH-UHFFFAOYSA-N	-1	0	356.407	2.798	50	0		FFAARM
O=C([O-])[C@@H](NS(=O)(=O)c1ccccc1)c1ccc(Br)cc1	ZINC000000971928	209384315	/nfs/dbraw/zinc/38/43/15/209384315.db2.gz	YIGVMRNPMFZMSX-ZDUSSCGKSA-N	-1	0	370.224	2.553	50	0		FFAARM
C[C@H](Oc1ccc2ccc(=O)oc2c1)C(=O)NC[C@H]1CC[C@H](C(=O)[O-])CC1	ZINC000245240731	209366464	/nfs/dbraw/zinc/36/64/64/209366464.db2.gz	SCMRAVQXCAHESR-YDHLFZDLSA-N	-1	0	373.405	2.568	50	0	biogenic	FFAARM
O=C([O-])c1ccc(CNC(=O)CC[C@@H]2Cc3ccccc3NC2=O)cc1	ZINC000238108055	209360828	/nfs/dbraw/zinc/36/08/28/209360828.db2.gz	BKYCXODIDXQSEZ-MRXNPFEDSA-N	-1	0	352.390	2.592	50	0		FFAARM
O=C([O-])C[C@H]1CN(C(=O)CCCCc2nc3ccccc3s2)CCO1	ZINC000238051427	209358927	/nfs/dbraw/zinc/35/89/27/209358927.db2.gz	WLYXLJOEUNYPJU-ZDUSSCGKSA-N	-1	0	362.451	2.711	50	0		FFAARM
O=C([O-])CC[C@H]1CCCN(C(=O)[C@@H]2COc3ccc(Cl)cc3C2)C1	ZINC000238014164	209358856	/nfs/dbraw/zinc/35/88/56/209358856.db2.gz	UYWQRDVXUKKWFN-OCCSQVGLSA-N	-1	0	351.830	2.995	50	0		FFAARM
O=C([O-])[C@H]1CCCN1C(=O)/C=C/c1ccc(OCc2ccccn2)cc1	ZINC000238077042	209358472	/nfs/dbraw/zinc/35/84/72/209358472.db2.gz	ULNRSNYCKIZETJ-VEGGFIAOSA-N	-1	0	352.390	2.749	50	0		FFAARM
O=C([O-])CC[C@H]1CCCCN1C(=O)CC[C@H]1Cc2ccccc2NC1=O	ZINC000237982170	209355375	/nfs/dbraw/zinc/35/53/75/209355375.db2.gz	FZGRPNQENUMDAS-JKSUJKDBSA-N	-1	0	358.438	2.824	50	0		FFAARM
Cc1ccc([C@H](NC(=O)CN2CCC[C@@H]2C(=O)[O-])c2cccs2)cc1	ZINC000237638127	209353282	/nfs/dbraw/zinc/35/32/82/209353282.db2.gz	LGFHXZKWTBIYGD-QAPCUYQASA-N	-1	0	358.463	2.811	50	0		FFAARM
C[C@]1(C(=O)[O-])CCN(C(=O)c2cc3cc(Br)ccc3[nH]2)C1	ZINC000237656160	209353054	/nfs/dbraw/zinc/35/30/54/209353054.db2.gz	PSWOAYYGGZDWFU-HNNXBMFYSA-N	-1	0	351.200	2.867	50	0		FFAARM
O=C([O-])C1(C(=O)N2CCC(C(=O)Nc3ccc(F)c(Cl)c3)CC2)CC1	ZINC000118974785	209350735	/nfs/dbraw/zinc/35/07/35/209350735.db2.gz	XAYHCLYOQQJIQS-UHFFFAOYSA-N	-1	0	368.792	2.521	50	0		FFAARM
COc1ccc(-c2noc(CN3[C@H](C(=O)[O-])C[C@@H]4CCCC[C@@H]43)n2)cc1	ZINC000237444142	209348538	/nfs/dbraw/zinc/34/85/38/209348538.db2.gz	WBMRMVTXYPCSOD-BPUTZDHNSA-N	-1	0	357.410	2.963	50	0		FFAARM
COc1ccc(-c2cc(C(=O)N3CCCC[C@H]3CCC(=O)[O-])[nH]n2)cc1	ZINC000237403681	209347087	/nfs/dbraw/zinc/34/70/87/209347087.db2.gz	UYVPWLOUDZGMKG-AWEZNQCLSA-N	-1	0	357.410	2.945	50	0		FFAARM
COc1ccc(Br)c(C(=O)N(C[C@H](C)C(=O)[O-])C2CC2)c1	ZINC000237316275	209345739	/nfs/dbraw/zinc/34/57/39/209345739.db2.gz	BRCXSIAUWOPUFA-VIFPVBQESA-N	-1	0	356.216	2.783	50	0		FFAARM
COc1cc(S(=O)(=O)Nc2ccccc2Cl)cc(C(=O)[O-])c1OC	ZINC000045945941	209329134	/nfs/dbraw/zinc/32/91/34/209329134.db2.gz	RBACBHVJJMVXQM-UHFFFAOYSA-N	-1	0	371.798	2.856	50	0		FFAARM
Cc1cccnc1[N-]S(=O)(=O)c1ccc(I)cc1	ZINC000107115560	209276246	/nfs/dbraw/zinc/27/62/46/209276246.db2.gz	OHAJZNBLNBPKEL-UHFFFAOYSA-N	-1	0	374.203	2.795	50	0		FFAARM
Cc1ccc(-n2[nH][n-]c3c(=O)n(-c4ccc(F)c(F)c4)c(=O)c2=3)cc1F	ZINC000102819274	209242098	/nfs/dbraw/zinc/24/20/98/209242098.db2.gz	QYTDNLBQOBEJTR-HUUCEWRRSA-N	-1	0	360.295	2.910	50	0		FFAARM
C[C@H]1CCCC[C@@H]1NC(=O)CSc1nc(=O)cc([O-])n1C1CCCC1	ZINC000102137526	209233855	/nfs/dbraw/zinc/23/38/55/209233855.db2.gz	VIRVFJULUIPRBD-JSGCOSHPSA-N	-1	0	365.499	2.851	50	0		FFAARM
CCCCn1c([O-])c(C2=NN[C@H](c3ccc(C(C)C)cc3)C2)c(=O)[nH]c1=O	ZINC000101761932	209228757	/nfs/dbraw/zinc/22/87/57/209228757.db2.gz	FIKQTXSEBQUZOP-HNNXBMFYSA-N	-1	0	370.453	2.604	50	0		FFAARM
Cc1ccc(-n2c(=O)c3[n-][nH]n(Cc4cccc(F)c4)c=3c2=O)cc1C	ZINC000101418498	209225008	/nfs/dbraw/zinc/22/50/08/209225008.db2.gz	NMASCJJRCPNVDC-IRXDYDNUSA-N	-1	0	352.369	2.936	50	0		FFAARM
CCOc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccccc4F)c=3c2=O)cc1	ZINC000101417798	209225045	/nfs/dbraw/zinc/22/50/45/209225045.db2.gz	XQXWODUDKCZOQL-SJORKVTESA-N	-1	0	368.368	2.718	50	0		FFAARM
Cc1ccc(C)c(Cn2[nH][n-]c3c(=O)n(-c4ccc(F)cc4)c(=O)c2=3)c1	ZINC000101167231	209221992	/nfs/dbraw/zinc/22/19/92/209221992.db2.gz	XUJUBVXBJAEIIF-DLBZAZTESA-N	-1	0	352.369	2.936	50	0		FFAARM
CC(=O)c1[n-]n(-c2ccc(C)cc2)c2c(O)n(-c3ccc(C)cc3)c(=O)c1-2	ZINC000100563732	209214706	/nfs/dbraw/zinc/21/47/06/209214706.db2.gz	DFPRLVSTULKADY-HKUYNNGSSA-N	-1	0	361.401	2.627	50	0		FFAARM
O=C([O-])c1ccc(Br)c(N2C(=O)[C@H]3CC=CC[C@@H]3C2=O)c1	ZINC000100093181	209209250	/nfs/dbraw/zinc/20/92/50/209209250.db2.gz	JZIPZDADEZRTHY-UWVGGRQHSA-N	-1	0	350.168	2.603	50	0		FFAARM
Cc1ncn(Cc2nc(CC3CC3)nn2-c2ccccc2C(=O)[O-])c1C	ZINC000096131407	209115474	/nfs/dbraw/zinc/11/54/74/209115474.db2.gz	RXZLQNYSRGQYHB-UHFFFAOYSA-N	-1	0	351.410	2.780	50	0		FFAARM
Cc1ccccc1OCC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)[O-]	ZINC000000790591	206830926	/nfs/dbraw/zinc/83/09/26/206830926.db2.gz	XBIUBLLFSQQXGR-QGZVFWFLSA-N	-1	0	352.390	2.667	50	0	biogenic,in-vitro	FFAARM
O=C([O-])[C@H]1CC=CC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCCCC2)c1	ZINC000000794642	206832151	/nfs/dbraw/zinc/83/21/51/206832151.db2.gz	XMSLPTJAWDQIRU-IRXDYDNUSA-N	-1	0	356.422	2.918	50	0		FFAARM
O=C(N[C@H]1CCSC1)c1ccccc1[N-]S(=O)(=O)c1ccccc1	ZINC000001024077	206854620	/nfs/dbraw/zinc/85/46/20/206854620.db2.gz	NZELCDBYPPBNGH-ZDUSSCGKSA-N	-1	0	362.476	2.723	50	0		FFAARM
CC(=O)[N-]S(=O)(=O)c1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1	ZINC000001217254	206869790	/nfs/dbraw/zinc/86/97/90/206869790.db2.gz	RWPIAFAGHGNMKZ-UHFFFAOYSA-N	-1	0	367.814	2.809	50	0		FFAARM
O=C([O-])c1ccc(Cl)c(S(=O)(=O)N2CCc3ccccc3C2)c1	ZINC000003243456	206962541	/nfs/dbraw/zinc/96/25/41/206962541.db2.gz	AXYVOQBUPXDNMM-UHFFFAOYSA-N	-1	0	351.811	2.785	50	0		FFAARM
O=C([O-])/C=C/C(=O)NCCNc1ncnc2scc(-c3ccccc3)c21	ZINC000004299572	207010291	/nfs/dbraw/zinc/01/02/91/207010291.db2.gz	ZLMWHZCEYXFTGF-VOTSOKGWSA-N	-1	0	368.418	2.527	50	0		FFAARM
COc1ccc(-c2cc(=O)oc3cc(OCc4nnn[n-]4)ccc32)cc1	ZINC000004282705	207011080	/nfs/dbraw/zinc/01/10/80/207011080.db2.gz	GCORMIQKFYLLCF-UHFFFAOYSA-N	-1	0	350.334	2.561	50	0	biogenic	FFAARM
COc1ccc([C@H](CC(=O)Nc2cc(C)on2)[N-]C(=O)C(F)(F)F)cc1	ZINC000004474829	207021174	/nfs/dbraw/zinc/02/11/74/207021174.db2.gz	ZMEBXPWSGRFBFW-LBPRGKRZSA-N	-1	0	371.315	2.740	50	0		FFAARM
COc1cc2c(cc1OC)[C@@H](C(=O)[O-])[C@H](c1ccccc1OC)N(C)C2=O	ZINC000004563442	207028162	/nfs/dbraw/zinc/02/81/62/207028162.db2.gz	RTULEOKBRLRJCC-MSOLQXFVSA-N	-1	0	371.389	2.708	50	0		FFAARM
CC1=C(C)C[C@@H](C(=O)Nc2sc3c(c2C(N)=O)CCC3)[C@H](C(=O)[O-])C1	ZINC000004902951	207060391	/nfs/dbraw/zinc/06/03/91/207060391.db2.gz	ZSIOQPWHGGVIDW-VXGBXAGGSA-N	-1	0	362.451	2.721	50	0		FFAARM
COc1ccc(Nc2nnc(Cc3ccc(C)cc3)c(=O)[n-]2)cc1OC	ZINC000005154456	207085262	/nfs/dbraw/zinc/08/52/62/207085262.db2.gz	IWOMDOQKPBJXNP-UHFFFAOYSA-N	-1	0	352.394	2.825	50	0		FFAARM
COc1ccc(C[C@@H](C(=O)Nc2cc(C)cc(C)c2)c2nnn[n-]2)cc1	ZINC000005488753	207102212	/nfs/dbraw/zinc/10/22/12/207102212.db2.gz	OSCLOUIYZRSDAF-QGZVFWFLSA-N	-1	0	351.410	2.790	50	0		FFAARM
COc1cccc(C[C@@H](C(=O)Nc2ccc(C)c(C)c2)c2nnn[n-]2)c1	ZINC000005518441	207104362	/nfs/dbraw/zinc/10/43/62/207104362.db2.gz	YWMAUZOEIPAJCR-QGZVFWFLSA-N	-1	0	351.410	2.790	50	0		FFAARM
CS(=O)(=O)[N-]c1ccccc1C(=O)NCCSc1ccccc1	ZINC000006268658	207135598	/nfs/dbraw/zinc/13/55/98/207135598.db2.gz	XUNUACIUUWHPAX-UHFFFAOYSA-N	-1	0	350.465	2.580	50	0		FFAARM
CC[C@@]1(C)NC(=O)N([N-]C(=O)c2ccccc2Oc2ccccc2)C1=O	ZINC000006589017	207148086	/nfs/dbraw/zinc/14/80/86/207148086.db2.gz	ZSOHCMPJGHSAPM-LJQANCHMSA-N	-1	0	353.378	2.844	50	0		FFAARM
CCc1ccc(-n2c(=O)c3[n-][nH]n(Cc4cccc(F)c4)c=3c2=O)cc1	ZINC000006770759	207163181	/nfs/dbraw/zinc/16/31/81/207163181.db2.gz	MUUSZAKUFURIBS-DLBZAZTESA-N	-1	0	352.369	2.882	50	0		FFAARM
O=C(Nc1nnc(S(=O)(=O)[N-]c2ccccc2)s1)C1CCCCC1	ZINC000006778352	207163766	/nfs/dbraw/zinc/16/37/66/207163766.db2.gz	AWGDUZQERMJAKK-UHFFFAOYSA-N	-1	0	366.468	2.858	50	0		FFAARM
COc1cc(Cl)c(C)cc1[N-]S(=O)(=O)c1ccc2c(c1)CC(=O)N2	ZINC000006788812	207165308	/nfs/dbraw/zinc/16/53/08/207165308.db2.gz	SIVBCAKIOPXXGE-UHFFFAOYSA-N	-1	0	366.826	2.952	50	0		FFAARM
CCc1cccc([N-]S(=O)(=O)c2c(C)nc3scc(C)n3c2=O)c1	ZINC000006784740	207165469	/nfs/dbraw/zinc/16/54/69/207165469.db2.gz	UORAOVYNBGYZKL-UHFFFAOYSA-N	-1	0	363.464	2.736	50	0		FFAARM
Cc1csc2nc(C)c(S(=O)(=O)[N-]c3cccc(Cl)c3)c(=O)n12	ZINC000006823682	207170362	/nfs/dbraw/zinc/17/03/62/207170362.db2.gz	ILDHNOLLBSVIKG-UHFFFAOYSA-N	-1	0	369.855	2.827	50	0		FFAARM
COc1ccc(C(N)=O)cc1[N-]S(=O)(=O)c1ccc2ccccc2c1	ZINC000035685952	207251384	/nfs/dbraw/zinc/25/13/84/207251384.db2.gz	OEAJRBNWXZAINN-UHFFFAOYSA-N	-1	0	356.403	2.748	50	0		FFAARM
CCCn1c(=O)cc([O-])nc1SCC(=O)Nc1ccccc1Cl	ZINC000009493998	207273554	/nfs/dbraw/zinc/27/35/54/207273554.db2.gz	UZPKBMBOWDLBEC-UHFFFAOYSA-N	-1	0	353.831	2.743	50	0		FFAARM
O=C([N-]n1cnc2ccc(Cl)cc2c1=O)c1ccc(Br)o1	ZINC000009689997	207281499	/nfs/dbraw/zinc/28/14/99/207281499.db2.gz	WIZFEJWRIFISCT-UHFFFAOYSA-N	-1	0	368.574	2.789	50	0		FFAARM
O=C([O-])c1cccc(N2C(=O)C[C@@H](Nc3ccc4c(c3)CCC4)C2=O)c1	ZINC000012542955	207389143	/nfs/dbraw/zinc/38/91/43/207389143.db2.gz	BMLITWBJMJIBFP-QGZVFWFLSA-N	-1	0	350.374	2.618	50	0		FFAARM
NC(=O)c1ccc(CSc2ncc(C(=O)[O-])n2-c2ccccc2)cc1	ZINC000012573525	207395152	/nfs/dbraw/zinc/39/51/52/207395152.db2.gz	PORJKNWNFVESQR-UHFFFAOYSA-N	-1	0	353.403	2.962	50	0		FFAARM
CS(=O)(=O)c1ccccc1NC(=O)CSc1ccccc1C(=O)[O-]	ZINC000012895792	207434252	/nfs/dbraw/zinc/43/42/52/207434252.db2.gz	GMQXFEKUKUGFJO-UHFFFAOYSA-N	-1	0	365.432	2.519	50	0		FFAARM
O=C([N-]N1C(=O)NC2(CCCCC2)C1=O)c1cc(Cl)sc1Cl	ZINC000017114673	207611836	/nfs/dbraw/zinc/61/18/36/207611836.db2.gz	OIOUWCIABRLGAT-UHFFFAOYSA-N	-1	0	362.238	2.954	50	0		FFAARM
[NH3+][C@@H](Cc1cc(C[P@@](=O)([O-])O)cc(-c2ccccc2Cl)c1)C(=O)[O-]	ZINC000031415656	208012656	/nfs/dbraw/zinc/01/26/56/208012656.db2.gz	VBRJFXSFCYEZMQ-HNNXBMFYSA-N	-1	0	369.741	2.639	50	0	in-vitro	FFAARM
CCOC(=O)c1ccccc1NC(=O)Cc1c(C(=O)[O-])c(C)cn1CC	ZINC000035511181	208127631	/nfs/dbraw/zinc/12/76/31/208127631.db2.gz	UZBRNKFRWXHTKO-UHFFFAOYSA-N	-1	0	358.394	2.873	50	0		FFAARM
Cc1ccc(-c2nnc(CCC(=O)NCCc3cccs3)c(=O)[n-]2)cc1	ZINC000034768812	208109034	/nfs/dbraw/zinc/10/90/34/208109034.db2.gz	DFOGVHMEXSVLBM-UHFFFAOYSA-N	-1	0	368.462	2.906	50	0		FFAARM
Cc1ccc(-c2nnc(CCC(=O)NCc3ccc(F)cc3)c(=O)[n-]2)cc1	ZINC000034768798	208109972	/nfs/dbraw/zinc/10/99/72/208109972.db2.gz	BTYSGYBVVFGNNF-UHFFFAOYSA-N	-1	0	366.396	2.941	50	0		FFAARM
CCn1c2nc(-c3ccc4c(c3)OCO4)cc(C(=O)[O-])c2c(=O)[nH]c1=S	ZINC000036617276	208166527	/nfs/dbraw/zinc/16/65/27/208166527.db2.gz	PRQCDYKQHWTGQU-UHFFFAOYSA-N	-1	0	371.374	2.568	50	0		FFAARM
O=C([O-])Cn1cc([C@H](C(=O)[O-])[NH+]2CCSCC2)c2ccc(Cl)cc21	ZINC000036354086	208157177	/nfs/dbraw/zinc/15/71/77/208157177.db2.gz	AREIVBGFULUNGU-OAHLLOKOSA-N	-1	0	368.842	2.554	50	0		FFAARM
C[C@H]1Oc2ccc(S(=O)(=O)[N-]c3cccc4cccnc43)cc2NC1=O	ZINC000071538666	208184996	/nfs/dbraw/zinc/18/49/96/208184996.db2.gz	WXRDSSODIJILKK-LLVKDONJSA-N	-1	0	369.402	2.755	50	0		FFAARM
O=C([O-])CNC(=O)CCn1ccc2ccc(OCc3ccccc3)cc21	ZINC000040309647	208246841	/nfs/dbraw/zinc/24/68/41/208246841.db2.gz	DTEZACCBVULMNL-UHFFFAOYSA-N	-1	0	352.390	2.811	50	0	biogenic	FFAARM
C[C@@H](CC(=O)N1CCO[C@H](CC(=O)[O-])C1)c1ccccc1Br	ZINC000299742341	208338321	/nfs/dbraw/zinc/33/83/21/208338321.db2.gz	BFRRLAPYLVLXCX-NWDGAFQWSA-N	-1	0	370.243	2.645	50	0		FFAARM
Cc1noc2nc(-c3ccccc3)cc(C(=O)N3CC[C@@H](C(=O)[O-])C3)c12	ZINC000299742219	208338696	/nfs/dbraw/zinc/33/86/96/208338696.db2.gz	IXYSBAIUICLZOS-CYBMUJFWSA-N	-1	0	351.362	2.745	50	0		FFAARM
CCOC(=O)CN(C)c1ccc(NC(=O)c2cccs2)cc1C(=O)[O-]	ZINC000046053505	208356170	/nfs/dbraw/zinc/35/61/70/208356170.db2.gz	JBWPBOXDBQJKPE-UHFFFAOYSA-N	-1	0	362.407	2.698	50	0		FFAARM
CC1(C)[C@H](C(=O)[O-])[C@H]1C(=O)Nc1ccc(F)c(C(=O)Nc2cccnc2)c1	ZINC000071289106	208760886	/nfs/dbraw/zinc/76/08/86/208760886.db2.gz	VHNLFDDIVPXBAZ-GJZGRUSLSA-N	-1	0	371.368	2.768	50	0		FFAARM
COc1cccc(F)c1-c1cc(C(=O)[O-])cc(S(=O)(=O)NC2CC2)c1	ZINC000071746443	208771322	/nfs/dbraw/zinc/77/13/22/208771322.db2.gz	WAPCTYBXIVLAOQ-UHFFFAOYSA-N	-1	0	365.382	2.640	50	0		FFAARM
CC(C)Oc1ccc(C(=O)N2CCCn3nc(CCC(=O)[O-])cc3C2)cc1	ZINC000072435917	208863184	/nfs/dbraw/zinc/86/31/84/208863184.db2.gz	AQSXHJNYUACOBT-UHFFFAOYSA-N	-1	0	371.437	2.734	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)c2ccccc2N2CCCC2)C[C@H]1c1ccncc1	ZINC000091859018	209000522	/nfs/dbraw/zinc/00/05/22/209000522.db2.gz	QGOBDWVIVQXLGD-ZWKOTPCHSA-N	-1	0	365.433	2.622	50	0		FFAARM
COc1nc2c(cc1C(=O)N1C[C@@H](c3ccccc3)[C@H](C(=O)[O-])C1)CCC2	ZINC000091782299	208996649	/nfs/dbraw/zinc/99/66/49/208996649.db2.gz	QWDMKFIOWSEDAE-DLBZAZTESA-N	-1	0	366.417	2.519	50	0		FFAARM
COC[C@@](C)(CC(=O)[O-])NC(=O)CSCc1nc2ccccc2s1	ZINC000095989852	209094039	/nfs/dbraw/zinc/09/40/39/209094039.db2.gz	XJXPGSOKOZILKQ-MRXNPFEDSA-N	-1	0	368.480	2.526	50	0		FFAARM
O=C([O-])CCCNC(=O)Cc1csc(COc2ccc(Cl)cc2)n1	ZINC000095969613	209091910	/nfs/dbraw/zinc/09/19/10/209091910.db2.gz	JRMDBKNKYIFPEO-UHFFFAOYSA-N	-1	0	368.842	2.899	50	0		FFAARM
CCn1cc(C(=O)[N-]S(=O)(=O)c2cc(C)sc2C)c(C(C)C)n1	ZINC000095961014	209091176	/nfs/dbraw/zinc/09/11/76/209091176.db2.gz	PEIJZFDVYWFTIY-UHFFFAOYSA-N	-1	0	355.485	2.823	50	0		FFAARM
O=C([O-])C1(NC(=O)[C@H]2CC(=O)N(c3ccccc3Cl)C2)CCCCC1	ZINC000095348428	209022597	/nfs/dbraw/zinc/02/25/97/209022597.db2.gz	IKYWDAWBOTVEHB-LBPRGKRZSA-N	-1	0	364.829	2.597	50	0		FFAARM
Cc1ccc(-c2nnc(CCC(=O)NC3(C(=O)[O-])CCCCC3)o2)cc1	ZINC000095349573	209023013	/nfs/dbraw/zinc/02/30/13/209023013.db2.gz	UZBOOGKUPZPVDF-UHFFFAOYSA-N	-1	0	357.410	2.881	50	0		FFAARM
CSc1ccc([C@@H](C(=O)[O-])N2CCN(C(=O)c3ccco3)CC2)cc1	ZINC000095357302	209026145	/nfs/dbraw/zinc/02/61/45/209026145.db2.gz	PFXSSHFYKIARIB-INIZCTEOSA-N	-1	0	360.435	2.585	50	0		FFAARM
COc1ccc2[nH]c3c(c2c1)CN([C@H](C(=O)[O-])c1c(C)noc1C)CC3	ZINC000095356285	209026685	/nfs/dbraw/zinc/02/66/85/209026685.db2.gz	DOBBIVXAKDJMRT-SFHVURJKSA-N	-1	0	355.394	2.965	50	0		FFAARM
CCCCOc1cc(F)ccc1[C@H](C(=O)[O-])N1CCCN(C(C)=O)CC1	ZINC000095366687	209031411	/nfs/dbraw/zinc/03/14/11/209031411.db2.gz	GHAUNGCAEOPBIK-GOSISDBHSA-N	-1	0	366.433	2.685	50	0		FFAARM
COc1c(C)cc([C@@H](C(=O)[O-])N2CCN(Cc3ccccn3)CC2)cc1C	ZINC000095367959	209032931	/nfs/dbraw/zinc/03/29/31/209032931.db2.gz	PENWARMDMVZSEO-IBGZPJMESA-N	-1	0	369.465	2.651	50	0		FFAARM
O=C([O-])[C@@H](c1ccc(O)cc1)N1CCN(C/C=C/c2ccccc2)CC1	ZINC000095375696	209037513	/nfs/dbraw/zinc/03/75/13/209037513.db2.gz	XETZIESNYHJWNN-WWPOYFSUSA-N	-1	0	352.434	2.849	50	0		FFAARM
Cc1cc(CN(C)[C@H](C(=O)[O-])c2ccc(NC(=O)N3CCCC3)cc2)on1	ZINC000095384270	209042809	/nfs/dbraw/zinc/04/28/09/209042809.db2.gz	ZJARFEGWNVPPCX-KRWDZBQOSA-N	-1	0	372.425	2.868	50	0		FFAARM
COc1ccc(CNC(=O)[C@@H](C)c2ccc3c(c2)OCCO3)cc1C(=O)[O-]	ZINC000095424122	209048509	/nfs/dbraw/zinc/04/85/09/209048509.db2.gz	LLHXVZJAHOUIGQ-LBPRGKRZSA-N	-1	0	371.389	2.585	50	0		FFAARM
COc1ccc(CCC(=O)NC[C@H](Cc2ccccc2)C(=O)[O-])cc1F	ZINC000095425296	209049136	/nfs/dbraw/zinc/04/91/36/209049136.db2.gz	DWPQSESGSASIDD-INIZCTEOSA-N	-1	0	359.397	2.827	50	0		FFAARM
COc1cc(C(=O)N[C@@H](CC(=O)[O-])c2cccs2)ccc1[N+](=O)[O-]	ZINC000095424196	209049230	/nfs/dbraw/zinc/04/92/30/209049230.db2.gz	MSVYTNVIHXLZGW-JTQLQIEISA-N	-1	0	350.352	2.611	50	0		FFAARM
COC(=O)c1cccc2[nH]c([N-]S(=O)(=O)c3ccc(C)s3)nc21	ZINC000095455173	209052626	/nfs/dbraw/zinc/05/26/26/209052626.db2.gz	KIPGDNKUGXUBMN-UHFFFAOYSA-N	-1	0	351.409	2.520	50	0		FFAARM
CC(=O)N1c2ccc(S(=O)(=O)Nc3cccc4c3CCO4)cc2C[C@@H]1C	ZINC000330075175	258154475	/nfs/dbraw/zinc/15/44/75/258154475.db2.gz	DBOHWRIGWXIONV-LBPRGKRZSA-N	-1	0	372.446	2.720	50	0		FFAARM
Cc1nccnc1N1CCC(Oc2ccc3ncccc3c2)(C(=O)[O-])CC1	ZINC000077342126	132181329	/nfs/dbraw/zinc/18/13/29/132181329.db2.gz	STAUEXNMJYYHNJ-UHFFFAOYSA-N	-1	0	364.405	2.836	50	0		FFAARM
O=C([O-])C1(Oc2ccc3ncccc3c2)CCN(c2ncccn2)CC1	ZINC000077356175	132181663	/nfs/dbraw/zinc/18/16/63/132181663.db2.gz	MDAUZMJBXZLWRC-UHFFFAOYSA-N	-1	0	350.378	2.527	50	0		FFAARM
CCCc1cncnc1N1CCC(Oc2ccccc2OC)(C(=O)[O-])CC1	ZINC000082092061	132194354	/nfs/dbraw/zinc/19/43/54/132194354.db2.gz	UIHQEWVYNXSREG-UHFFFAOYSA-N	-1	0	371.437	2.940	50	0		FFAARM
Cc1cccc2[nH]c([C@@H]3CCCN(c4ncncc4CC(=O)[O-])C3)nc21	ZINC000095363778	132208159	/nfs/dbraw/zinc/20/81/59/132208159.db2.gz	RRXAKMJIUZIQAN-CYBMUJFWSA-N	-1	0	351.410	2.672	50	0		FFAARM
Cc1ccc2c(C)cc(N3CCC4(CC3)NC(=O)C[C@@H]4C(=O)[O-])nc2c1C	ZINC000095381100	132209464	/nfs/dbraw/zinc/20/94/64/132209464.db2.gz	MLTDZQOOWOZGDE-MRXNPFEDSA-N	-1	0	367.449	2.720	50	0		FFAARM
Cc1cc(CN2CCN(c3cc(C)nc(-c4ccccc4[O-])n3)CC2)[nH]n1	ZINC000101913086	132234566	/nfs/dbraw/zinc/23/45/66/132234566.db2.gz	KSVHLXGONURULJ-UHFFFAOYSA-N	-1	0	364.453	2.511	50	0		FFAARM
O=C([O-])CC[C@H]1CCCN(C(=O)c2ccc(N3CCCCC3=O)cc2)C1	ZINC000238019400	132248958	/nfs/dbraw/zinc/24/89/58/132248958.db2.gz	IWAXYEZJPDFKDD-OAHLLOKOSA-N	-1	0	358.438	2.921	50	0		FFAARM
CN1C(=O)C[C@H](C(=O)N[C@@H](CC(=O)[O-])c2ccc(F)cc2)c2ccccc21	ZINC000299750014	136122001	/nfs/dbraw/zinc/12/20/01/136122001.db2.gz	MKHBBMVXKZFPLJ-HOTGVXAUSA-N	-1	0	370.380	2.608	50	0		FFAARM
CC[C@H](C)C(=O)Nc1ccc(S(=O)(=O)[N-]c2nc(C)cc(C)n2)cc1	ZINC000000683176	506228382	/nfs/dbraw/zinc/22/83/82/506228382.db2.gz	DYNVIZZDKCBNBC-NSHDSACASA-N	-1	0	362.455	2.879	50	0		FFAARM
COc1ccc(C2=NN(C(=O)CCC(=O)[O-])[C@@H](c3ccco3)C2)cc1OC	ZINC000000801907	506233479	/nfs/dbraw/zinc/23/34/79/506233479.db2.gz	GYPCFJFAUSVPMV-CQSZACIVSA-N	-1	0	372.377	2.839	50	0		FFAARM
COc1cc(NC(C)=O)c(OC)cc1[N-]S(=O)(=O)c1ccc(F)cc1	ZINC000001205034	506254518	/nfs/dbraw/zinc/25/45/18/506254518.db2.gz	VRISSQZIYAXRDW-UHFFFAOYSA-N	-1	0	368.386	2.602	50	0		FFAARM
O=c1ccc(-c2csc(S(=O)(=O)[N-]c3cccc(Cl)c3)c2)n[nH]1	ZINC000065119276	506261940	/nfs/dbraw/zinc/26/19/40/506261940.db2.gz	UEQJFKIELOKXMF-UHFFFAOYSA-N	-1	0	367.839	2.953	50	0		FFAARM
O=c1ccc(-c2csc(S(=O)(=O)[N-]c3ccc(F)c(F)c3)c2)n[nH]1	ZINC000065119387	506262529	/nfs/dbraw/zinc/26/25/29/506262529.db2.gz	APJZHODAKMMBJD-UHFFFAOYSA-N	-1	0	369.374	2.577	50	0		FFAARM
O=C([O-])[C@H](CCC(=O)OCc1ccccc1)NC(=O)OCc1ccccc1	ZINC000001678300	506266630	/nfs/dbraw/zinc/26/66/30/506266630.db2.gz	TWIVXHQQTRSWGO-KRWDZBQOSA-N	-1	0	371.389	2.890	50	0		FFAARM
CCc1nc2sc(C)nn2c1S(=O)(=O)[N-]c1ccc(F)cc1C	ZINC000065183896	506268389	/nfs/dbraw/zinc/26/83/89/506268389.db2.gz	RNNLNOBJJZIYAT-UHFFFAOYSA-N	-1	0	354.432	2.910	50	0		FFAARM
CCC[C@@H](NC(=O)[C@@H](C)Oc1ccc2c(C)c(C)c(=O)oc2c1)C(=O)[O-]	ZINC000002148868	506272750	/nfs/dbraw/zinc/27/27/50/506272750.db2.gz	VLNIJXQNIVYZFO-IUODEOHRSA-N	-1	0	361.394	2.547	50	0	biogenic	FFAARM
Cc1coc2c1cc1c(C)c(CC(=O)NCCC(=O)[O-])c(=O)oc1c2C	ZINC000002156489	506274168	/nfs/dbraw/zinc/27/41/68/506274168.db2.gz	VFLFJMWKFCJVGJ-UHFFFAOYSA-N	-1	0	357.362	2.598	50	0	biogenic	FFAARM
CCCCn1c2ccccc2c([O-])c(C(=O)NCc2ccncc2)c1=O	ZINC000002275524	506275446	/nfs/dbraw/zinc/27/54/46/506275446.db2.gz	MYZFVPBMHNPXQM-UHFFFAOYSA-N	-1	0	351.406	2.832	50	0		FFAARM
CC(C)N1CCCn2cc(S(=O)(=O)[N-]c3ccc(F)cc3)cc2C1=O	ZINC000065258820	506277578	/nfs/dbraw/zinc/27/75/78/506277578.db2.gz	YOEZMCMLPHYYPK-UHFFFAOYSA-N	-1	0	365.430	2.682	50	0		FFAARM
O=S(=O)([N-]c1cccn2nc(C3CC3)nc12)c1ccc2c(c1)CCC2	ZINC000065284015	506281185	/nfs/dbraw/zinc/28/11/85/506281185.db2.gz	QHFWYOIEHIPIHH-UHFFFAOYSA-N	-1	0	354.435	2.896	50	0		FFAARM
Cc1n[nH]c(C)c1S(=O)(=O)[N-]c1ccn(Cc2ccc(Cl)cc2)n1	ZINC000002804876	506294648	/nfs/dbraw/zinc/29/46/48/506294648.db2.gz	ZAMOCVFZFJZMMD-UHFFFAOYSA-N	-1	0	365.846	2.726	50	0		FFAARM
Cc1noc([N-]S(=O)(=O)c2ccc(NC(=O)c3cccnc3)cc2)c1C	ZINC000002821405	506297292	/nfs/dbraw/zinc/29/72/92/506297292.db2.gz	VIVDFHVVXBBKIX-UHFFFAOYSA-N	-1	0	372.406	2.740	50	0		FFAARM
Cc1ccc(Cn2c(=O)c3cc(N4CCOCC4)ccc3[n-]c2=S)cc1	ZINC000002976011	506305449	/nfs/dbraw/zinc/30/54/49/506305449.db2.gz	AKAMBNJPOIHNIR-UHFFFAOYSA-N	-1	0	367.474	2.879	50	0		FFAARM
O=C([O-])CCNC(=O)c1ccc(NC(=O)Cc2ccc(Cl)cc2)cc1	ZINC000003656661	506350226	/nfs/dbraw/zinc/35/02/26/506350226.db2.gz	FVVRDVKVRPNLSF-UHFFFAOYSA-N	-1	0	360.797	2.726	50	0		FFAARM
COc1ccc(NS(=O)(=O)c2ccc(OC)c(C(=O)[O-])c2)c(Cl)c1	ZINC000065833494	506376138	/nfs/dbraw/zinc/37/61/38/506376138.db2.gz	ODHFSSPBBJOIFS-UHFFFAOYSA-N	-1	0	371.798	2.856	50	0		FFAARM
CCCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](C(=O)[O-])C(C)C	ZINC000004760615	506393705	/nfs/dbraw/zinc/39/37/05/506393705.db2.gz	SPAQWPZGFYWELB-HZPDHXFCSA-N	-1	0	364.442	2.697	50	0		FFAARM
O=S(=O)([N-]CC1(c2ccccc2)CCOCC1)c1c(F)cccc1F	ZINC000038592087	506439975	/nfs/dbraw/zinc/43/99/75/506439975.db2.gz	UMLJNTTUCKKVEG-UHFFFAOYSA-N	-1	0	367.417	2.992	50	0		FFAARM
COC(=O)c1ccccc1S(=O)(=O)[N-]c1ccccc1OC(F)F	ZINC000006316816	506475440	/nfs/dbraw/zinc/47/54/40/506475440.db2.gz	VMLWFUSKACVURY-UHFFFAOYSA-N	-1	0	357.334	2.875	50	0		FFAARM
NC(=O)c1cc(S(=O)(=O)[N-]c2cccc(C(F)(F)F)c2)cs1	ZINC000006681493	506497648	/nfs/dbraw/zinc/49/76/48/506497648.db2.gz	FNFJXKASWFJROZ-UHFFFAOYSA-N	-1	0	350.343	2.667	50	0		FFAARM
Cc1nn(C)c(C)c1[N-]S(=O)(=O)c1ccc(Br)c(C)c1	ZINC000009155747	506684088	/nfs/dbraw/zinc/68/40/88/506684088.db2.gz	LCSQPTBRRXPOOJ-UHFFFAOYSA-N	-1	0	358.261	2.909	50	0		FFAARM
Cc1noc(C)c1S(=O)(=O)[N-]c1ccccc1C(=O)NC1CCCC1	ZINC000009468028	506697608	/nfs/dbraw/zinc/69/76/08/506697608.db2.gz	KEUWKRMHAIIIHS-UHFFFAOYSA-N	-1	0	363.439	2.765	50	0		FFAARM
O=C([O-])c1cnc2c(c1)n(CCCCCF)c(=O)n2CCc1ccccn1	ZINC000055254500	506709685	/nfs/dbraw/zinc/70/96/85/506709685.db2.gz	TWJOGCKSGGEWBP-UHFFFAOYSA-N	-1	0	372.400	2.674	50	0		FFAARM
Cc1nc(SC(F)F)[n-]c(=O)c1CCC(=O)NCc1ccccc1F	ZINC000012938214	506918014	/nfs/dbraw/zinc/91/80/14/506918014.db2.gz	INTDNBQFYZRNFH-UHFFFAOYSA-N	-1	0	371.384	2.781	50	0		FFAARM
O=C([O-])c1ccc(N2N=C(c3ccc4c(c3)OCCO4)CCC2=O)cc1	ZINC000013060459	506926500	/nfs/dbraw/zinc/92/65/00/506926500.db2.gz	SFKYSXWHONCJRA-UHFFFAOYSA-N	-1	0	352.346	2.687	50	0		FFAARM
COc1ccc(NC(C)=O)c([N-]S(=O)(=O)c2ccc(F)c(F)c2)c1	ZINC000057121961	507177869	/nfs/dbraw/zinc/17/78/69/507177869.db2.gz	SXOBZYPJDIIPOB-UHFFFAOYSA-N	-1	0	356.350	2.733	50	0		FFAARM
CCN1CCN([C@H](c2sc3nc(C)nn3c2[O-])c2ccc(C)cc2)CC1	ZINC000022458793	507294106	/nfs/dbraw/zinc/29/41/06/507294106.db2.gz	JNTVYBKXFADFAV-INIZCTEOSA-N	-1	0	371.510	2.840	50	0		FFAARM
O=C(NCc1cc2ccccc2[nH]1)c1ccc2c(c1)[n-]c(=S)[nH]c2=O	ZINC000060471200	507548610	/nfs/dbraw/zinc/54/86/10/507548610.db2.gz	KYGSDNSJAUCKEM-UHFFFAOYSA-N	-1	0	350.403	2.623	50	0		FFAARM
COc1ccc2c(c1)S[C@@H](CC(=O)Nc1cccc(C(=O)[O-])c1)C(=O)N2	ZINC000061720551	507632353	/nfs/dbraw/zinc/63/23/53/507632353.db2.gz	IUGHIQOKGQAOQX-HNNXBMFYSA-N	-1	0	372.402	2.835	50	0		FFAARM
COc1ccc(NC(=O)C2CCC2)c(NC(=O)[C@@H]2[C@@H](C(=O)[O-])C2(C)C)c1	ZINC000071284127	507701074	/nfs/dbraw/zinc/70/10/74/507701074.db2.gz	MOJLNDNFKCVSHA-GJZGRUSLSA-N	-1	0	360.410	2.729	50	0		FFAARM
Cc1cc([N-]S(=O)(=O)c2cccc(C(=O)NC3CCCCC3)c2)no1	ZINC000029674053	507786758	/nfs/dbraw/zinc/78/67/58/507786758.db2.gz	BXLDCOQNZYCNNB-UHFFFAOYSA-N	-1	0	363.439	2.846	50	0		FFAARM
COc1cc(C)c(CN2CCCn3nc(CCC(=O)[O-])cc3C2)cc1C	ZINC000072436675	507791465	/nfs/dbraw/zinc/79/14/65/507791465.db2.gz	NUMTYGTUTCDYDX-UHFFFAOYSA-N	-1	0	357.454	2.932	50	0		FFAARM
CCn1nc(C)c(C(=O)N2C[C@@H](c3ccc(F)cc3)[C@H](C(=O)[O-])C2)c1C	ZINC000091445068	507986209	/nfs/dbraw/zinc/98/62/09/507986209.db2.gz	DIVPWGXSCKLOKB-JKSUJKDBSA-N	-1	0	359.401	2.599	50	0		FFAARM
Cc1[nH]nc(C2CC2)c1C(=O)N1C[C@@H](c2ccccc2C)[C@H](C(=O)[O-])C1	ZINC000091486312	507989706	/nfs/dbraw/zinc/98/97/06/507989706.db2.gz	IDIWLMVNVHLQAC-JKSUJKDBSA-N	-1	0	353.422	2.844	50	0		FFAARM
COc1cc(F)c(S(=O)(=O)[N-]c2cnc3ccccc3n2)cc1OC	ZINC000075106768	508083461	/nfs/dbraw/zinc/08/34/61/508083461.db2.gz	MNVBXDJCJRGMCD-UHFFFAOYSA-N	-1	0	363.370	2.587	50	0		FFAARM
COc1cc([C@H]2SC(C)(C)[C@H](C(=O)[O-])N2C(C)=O)cc(OC)c1OC	ZINC000075251816	508091933	/nfs/dbraw/zinc/09/19/33/508091933.db2.gz	NPCUMDXXMDXQSI-LSDHHAIUSA-N	-1	0	369.439	2.538	50	0		FFAARM
O=C(Nc1ccc(F)cc1)c1c[nH]nc1S(=O)(=O)[N-]c1ccccc1	ZINC000075476408	508110002	/nfs/dbraw/zinc/11/00/02/508110002.db2.gz	DQRMEPIPHCBSNC-UHFFFAOYSA-N	-1	0	360.370	2.602	50	0		FFAARM
CC(C)Cn1c2ccccc2c([O-])c(C(=O)NCc2ccncc2)c1=O	ZINC000100449261	508239362	/nfs/dbraw/zinc/23/93/62/508239362.db2.gz	VZDQQJPPARZIOS-UHFFFAOYSA-N	-1	0	351.406	2.688	50	0		FFAARM
CCCc1cc(=O)n2nc(NC(=O)c3ccc(C(C)(C)C)cc3)[n-]c2n1	ZINC000100650763	508239948	/nfs/dbraw/zinc/23/99/48/508239948.db2.gz	KGTXWQWYRQIPMK-UHFFFAOYSA-N	-1	0	353.426	2.920	50	0		FFAARM
CC(C)Cn1c2ccccc2c([O-])c(C(=O)NCc2cccnc2)c1=O	ZINC000102211045	508269773	/nfs/dbraw/zinc/26/97/73/508269773.db2.gz	OEDLPPSDGRXCGN-UHFFFAOYSA-N	-1	0	351.406	2.688	50	0		FFAARM
C[C@@H](Cc1cccc(F)c1)C(=O)N1CCC[C@H](n2cc(C(=O)[O-])cn2)C1	ZINC000153230446	508561359	/nfs/dbraw/zinc/56/13/59/508561359.db2.gz	ACNZSOQUDRAGFD-GUYCJALGSA-N	-1	0	359.401	2.763	50	0		FFAARM
CCCc1c(C(=O)N2CCC[C@H](C(=O)[O-])C2)cnn1Cc1ccccc1	ZINC000136116124	508671920	/nfs/dbraw/zinc/67/19/20/508671920.db2.gz	PJVVDJXNMPMXRO-INIZCTEOSA-N	-1	0	355.438	2.821	50	0		FFAARM
O=C([O-])CCCOc1ccc(CNC(=O)c2cccc3c[nH]nc32)cc1	ZINC000225483641	509374027	/nfs/dbraw/zinc/37/40/27/509374027.db2.gz	FYVVLVFKROYOMK-UHFFFAOYSA-N	-1	0	353.378	2.737	50	0		FFAARM
O=C([O-])C1CCN(S(=O)(=O)Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000226087292	509394827	/nfs/dbraw/zinc/39/48/27/509394827.db2.gz	CGQKYPMRVCKAJM-UHFFFAOYSA-N	-1	0	352.239	2.620	50	0		FFAARM
CC(=O)N1CCc2ccccc2[C@H]1CC(=O)NCc1cccc(C(=O)[O-])c1	ZINC000236588038	509460833	/nfs/dbraw/zinc/46/08/33/509460833.db2.gz	ZUDNFGWYRLOZAT-LJQANCHMSA-N	-1	0	366.417	2.537	50	0		FFAARM
COc1ccc(C(=O)[N-]S(=O)(=O)CC2CCC2)cc1-c1ccccn1	ZINC000164888814	509542240	/nfs/dbraw/zinc/54/22/40/509542240.db2.gz	FHYICIBIMCEZBX-UHFFFAOYSA-N	-1	0	360.435	2.617	50	0		FFAARM
CCCCC[C@@H](NC(=O)[C@@H]1CCCN(C(=O)c2ccccc2)C1)C(=O)[O-]	ZINC000170592111	509673854	/nfs/dbraw/zinc/67/38/54/509673854.db2.gz	QOZOFHGPWOJWST-IAGOWNOFSA-N	-1	0	360.454	2.689	50	0		FFAARM
Cc1cc(F)ccc1-c1ccc(C(=O)N2CCO[C@H](C(=O)[O-])C2)cc1F	ZINC000237650051	509701728	/nfs/dbraw/zinc/70/17/28/509701728.db2.gz	YIEOPOVTUNAWCT-KRWDZBQOSA-N	-1	0	361.344	2.866	50	0		FFAARM
CCO[C@@H]1C[C@@](NC(=O)c2cnc(-c3ccco3)s2)(C(=O)[O-])C1(C)C	ZINC000193040993	509751018	/nfs/dbraw/zinc/75/10/18/509751018.db2.gz	DMZSXDUIBIBRBJ-SJKOYZFVSA-N	-1	0	364.423	2.791	50	0		FFAARM
O=C([O-])CCN(C(=O)CCCc1c[nH]c2ccccc12)C1CCOCC1	ZINC000238062581	509813462	/nfs/dbraw/zinc/81/34/62/509813462.db2.gz	RISDOSWWBGAFPX-UHFFFAOYSA-N	-1	0	358.438	2.973	50	0		FFAARM
O=C([O-])CCN(C[C@@H]1CCCO1)C(=O)[C@@H]1C[C@@H]1c1cccc(F)c1F	ZINC000238089466	509818007	/nfs/dbraw/zinc/81/80/07/509818007.db2.gz	FGULFEMWQFQOKV-IACUBPJLSA-N	-1	0	353.365	2.551	50	0		FFAARM
Cc1ccc(C)c(CS(=O)(=O)[N-]C(=O)Cc2c[nH]c3ccccc23)c1	ZINC000241707077	509843706	/nfs/dbraw/zinc/84/37/06/509843706.db2.gz	QMLRNKRJYDFPFV-UHFFFAOYSA-N	-1	0	356.447	2.973	50	0		FFAARM
COc1ccc(S(=O)(=O)[N-]c2cccc(NC(=O)C3CC3)c2)c(F)c1	ZINC000252497110	509844486	/nfs/dbraw/zinc/84/44/86/509844486.db2.gz	PZKXLKLIANHGOM-UHFFFAOYSA-N	-1	0	364.398	2.984	50	0		FFAARM
Cc1ncsc1CCN(C)CC(=O)Nc1ccc(Cl)c(C(=O)[O-])c1	ZINC000244788081	509872055	/nfs/dbraw/zinc/87/20/55/509872055.db2.gz	QJAUBAFJBJTXFY-UHFFFAOYSA-N	-1	0	367.858	2.916	50	0		FFAARM
C=CCN1C(=O)C(=NN=Cc2ccc(OCC(=O)[O-])cc2)c2ccccc21	ZINC000254902574	509912308	/nfs/dbraw/zinc/91/23/08/509912308.db2.gz	BMHQKNXDMPBDBQ-UHFFFAOYSA-N	-1	0	363.373	2.506	50	0		FFAARM
Cc1cc(C(=O)N(Cc2ccccc2)C[C@H](C)C(=O)[O-])c2cnn(C)c2n1	ZINC000190667920	510273627	/nfs/dbraw/zinc/27/36/27/510273627.db2.gz	HQCRGYFSAHIXJF-ZDUSSCGKSA-N	-1	0	366.421	2.640	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)c2cc(F)cc3nc[nH]c32)C[C@H]1c1ccccc1	ZINC000366289184	511941023	/nfs/dbraw/zinc/94/10/23/511941023.db2.gz	RHNQTQPLHLHJER-LSDHHAIUSA-N	-1	0	353.353	2.642	50	0		FFAARM
O=C([O-])c1ccc([C@@H]2CCCN2S(=O)(=O)N2CCCCCC2)s1	ZINC000372494179	512902426	/nfs/dbraw/zinc/90/24/26/512902426.db2.gz	BDYHTKPRYLVWRQ-LBPRGKRZSA-N	-1	0	358.485	2.704	50	0		FFAARM
O=C([O-])Cn1nccc1[C@H]1CCCN(c2nnc(-c3ccccc3)s2)C1	ZINC000426691302	514016906	/nfs/dbraw/zinc/01/69/06/514016906.db2.gz	OHGJMNFVCBUGIO-AWEZNQCLSA-N	-1	0	369.450	2.870	50	0		FFAARM
C[C@]1(C(=O)[O-])C[C@@H](O)CN1C(=O)OCC1c2ccccc2-c2ccccc21	ZINC000521398882	517713850	/nfs/dbraw/zinc/71/38/50/517713850.db2.gz	WSKXCJGRXYRWBH-LRTDBIEQSA-N	-1	0	367.401	2.845	50	0		FFAARM
CC(C)(C(=O)[O-])C(=O)NCc1ccc(-n2ccc(C(F)(F)F)n2)cc1	ZINC000582244383	518657913	/nfs/dbraw/zinc/65/79/13/518657913.db2.gz	YGUZEUNZACSNIF-UHFFFAOYSA-N	-1	0	355.316	2.618	50	0		FFAARM
Cn1nccc1C1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H](C(=O)[O-])c1ccccc1	ZINC000634921657	521814523	/nfs/dbraw/zinc/81/45/23/521814523.db2.gz	LFZMJAMLSHMJLD-FBVQUNGASA-N	-1	0	367.449	2.916	50	0		FFAARM
O=C([O-])[C@@H]1CCCN(C(=O)Cc2csc(CCC(F)(F)F)n2)C1	ZINC000630096599	522616778	/nfs/dbraw/zinc/61/67/78/522616778.db2.gz	CRHJVHQFQCLJHO-SECBINFHSA-N	-1	0	350.362	2.504	50	0		FFAARM
C[C@@H]1C[C@H](C(=O)N[C@@H](c2ccccc2)c2cccc(F)c2)O[C@H]1C(=O)[O-]	ZINC000630152327	522658388	/nfs/dbraw/zinc/65/83/88/522658388.db2.gz	IZGLHBPFUFUVPA-GQAVTEOGSA-N	-1	0	357.381	2.910	50	0		FFAARM
C[C@@H]1C[C@H](C(=O)NC2(c3cccc(OC(F)(F)F)c3)CC2)O[C@H]1C(=O)[O-]	ZINC000630204588	522696537	/nfs/dbraw/zinc/69/65/37/522696537.db2.gz	OJNHDPSKXMAXMD-OASPWFOLSA-N	-1	0	373.327	2.569	50	0		FFAARM
Cc1nn(CCC(=O)[O-])c(C)c1NC(=O)c1csc(C(C)(C)C)n1	ZINC000630333476	522798649	/nfs/dbraw/zinc/79/86/49/522798649.db2.gz	ZLVZPDBZOQWLCT-UHFFFAOYSA-N	-1	0	350.444	2.981	50	0		FFAARM
O=C([O-])[C@@H]1CCN(C(=O)/C=C/c2ccc(OCc3ccccn3)cc2)C1	ZINC000178260541	526278206	/nfs/dbraw/zinc/27/82/06/526278206.db2.gz	TZHHWZDVUYKEAQ-YXMGTMDOSA-N	-1	0	352.390	2.607	50	0		FFAARM
O=C([O-])c1ccc(CNC(=O)[C@@H]2C[C@H]2c2ccc3c(c2)OCCO3)cc1	ZINC000268943905	526367655	/nfs/dbraw/zinc/36/76/55/526367655.db2.gz	NOZSCKXCFJBBJB-JKSUJKDBSA-N	-1	0	353.374	2.576	50	0		FFAARM
O=C([O-])COc1cccc(CNC(=O)[C@H]2C[C@@H]2c2c(F)cccc2F)c1	ZINC000238020407	527618237	/nfs/dbraw/zinc/61/82/37/527618237.db2.gz	XEMVCXOZFZHOPJ-KBPBESRZSA-N	-1	0	361.344	2.848	50	0		FFAARM
COc1ccc(Cc2c([O-])[nH]c(=O)n(-c3cccc(Cl)c3)c2=O)cc1	ZINC000001071832	536531545	/nfs/dbraw/zinc/53/15/45/536531545.db2.gz	MVMNGIFKXNRBFK-HNNXBMFYSA-N	-1	0	358.781	2.790	50	0		FFAARM
O=C([O-])C1(O)CCN(C(=O)OCC2c3ccccc3-c3ccccc32)CC1	ZINC000307477490	571115195	/nfs/dbraw/zinc/11/51/95/571115195.db2.gz	VPSWETIYGIVCKV-UHFFFAOYSA-N	-1	0	367.401	2.847	50	0		FFAARM
C[C@@H](C(=O)[O-])[C@@H](NC(=O)CN1C(=O)CCc2ccccc21)c1ccccc1	ZINC000262539599	601171699	/nfs/dbraw/zinc/17/16/99/601171699.db2.gz	RAEMYMUTEXOFLF-JLTOFOAXSA-N	-1	0	366.417	2.544	50	0		FFAARM
CCn1c(SCC(=O)[O-])nc2sc3c(c2c1=O)CC(C)(C)OC3	ZINC000005019446	727779459	/nfs/dbraw/zinc/77/94/59/727779459.db2.gz	KPAVNFKEKBKHJQ-UHFFFAOYSA-N	-1	0	354.453	2.506	50	0		FFAARM
O=C([O-])CC[C@@H]1CCCCN1C(=O)[C@H]1C[C@@H]1c1ccc2c(c1)OCCO2	ZINC000262205379	967814293	/nfs/dbraw/zinc/81/42/93/967814293.db2.gz	VXMHLZPVHRKDTC-XHSDSOJGSA-N	-1	0	359.422	2.807	50	0		FFAARM
O=C([O-])[C@H]1CCN(C(=O)/C=C/c2ccc(OCc3cccnc3)cc2)C1	ZINC000178266138	969842870	/nfs/dbraw/zinc/84/28/70/969842870.db2.gz	VKWYOBJJOGBOIO-JZLODUJNSA-N	-1	0	352.390	2.607	50	0		FFAARM
Cc1ccc(-n2[n-]c(C(=O)N[C@H]3CCC[C@H](OC(F)F)C3)cc2=O)cc1	ZINC000888092750	976545367	/nfs/dbraw/zinc/54/53/67/976545367.db2.gz	ZIKCQLJSMSFYDV-JSGCOSHPSA-N	-1	0	365.380	2.754	50	0		FFAARM
CC(C)[C@H](NC(=O)c1nn(-c2cccc(F)c2)c2c1CCCC2)C(=O)[O-]	ZINC000263209482	980563642	/nfs/dbraw/zinc/56/36/42/980563642.db2.gz	NIDVQTNNCMCQHF-INIZCTEOSA-N	-1	0	359.401	2.729	50	0		FFAARM
O=C([O-])COC1CN(C(=O)OCC2c3ccccc3-c3ccccc32)C1	ZINC000585090042	1008334694	/nfs/dbraw/zinc/33/46/94/1008334694.db2.gz	ATOZHVHGFTUNQV-UHFFFAOYSA-N	-1	0	353.374	2.721	50	0		FFAARM
O=C([O-])c1ccccc1[C@H]1CCN(C(=O)c2ccccc2-c2nc[nH]n2)C1	ZINC000072171586	1019838908	/nfs/dbraw/zinc/83/89/08/1019838908.db2.gz	MISPIGBDLXCRRO-ZDUSSCGKSA-N	-1	0	362.389	2.800	50	0		FFAARM
O=C([O-])[C@H]1CC2(CN1C(=O)C1CC1)CCN(c1nc3ccccc3o1)CC2	ZINC000072438735	1019896414	/nfs/dbraw/zinc/89/64/14/1019896414.db2.gz	USRPMRFUCPVMPF-OAHLLOKOSA-N	-1	0	369.421	2.510	50	0		FFAARM
C[C@@H]1OCCC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCCC[C@H]2C(=O)[O-])c1	ZINC000668274521	1027581136	/nfs/dbraw/zinc/58/11/36/1027581136.db2.gz	FQQAYIWKXPVUTG-JQFCIGGWSA-N	-1	0	374.437	2.520	50	0		FFAARM
COC(=O)c1ccccc1NC(=O)c1ccc(NC(=O)CCC(=O)[O-])cc1	ZINC000001010681	219353196	/nfs/dbraw/zinc/35/31/96/219353196.db2.gz	XDJMYNQXHKMQRI-UHFFFAOYSA-N	-1	0	370.361	2.529	50	0		FFAARM
COc1cccc2c1N(S(=O)(=O)c1ccc(C)c(C(=O)[O-])c1)CCC2	ZINC000031533998	209846616	/nfs/dbraw/zinc/84/66/16/209846616.db2.gz	NDRUTPCPTSQXON-UHFFFAOYSA-N	-1	0	361.419	2.843	50	0		FFAARM
Cc1ccn2c(c1)nnc2[N-]S(=O)(=O)c1cc(C)c(F)cc1Cl	ZINC000225473692	209813125	/nfs/dbraw/zinc/81/31/25/209813125.db2.gz	JSRBQPSNKOYWDP-UHFFFAOYSA-N	-1	0	354.794	2.939	50	0		FFAARM
Cc1coc2c1c(C)cc1oc(=O)c(CC(=O)NCCCC(=O)[O-])c(C)c21	ZINC000006624276	209454448	/nfs/dbraw/zinc/45/44/48/209454448.db2.gz	OOSVCNDSOQJVGW-UHFFFAOYSA-N	-1	0	371.389	2.988	50	0	biogenic	FFAARM
COc1ccccc1CNC(=O)c1c([O-])c2cccc3c2n(c1=O)CCC3	ZINC000001295702	209387602	/nfs/dbraw/zinc/38/76/02/209387602.db2.gz	BHPWWAVITGAKQQ-UHFFFAOYSA-N	-1	0	364.401	2.592	50	0		FFAARM
O=C1[N-]N(c2ccc(F)c(Cl)c2)C(=O)/C1=C/c1ccc2c(c1)OCO2	ZINC000001218909	209386015	/nfs/dbraw/zinc/38/60/15/209386015.db2.gz	DANYWFZKJMPHKM-VZUCSPMQSA-N	-1	0	360.728	2.669	50	0		FFAARM
O=C([O-])CCN(C[C@H]1CCCO1)C(=O)c1sccc1Br	ZINC000238108308	209361039	/nfs/dbraw/zinc/36/10/39/209361039.db2.gz	DFZUPGMYXXIHAQ-SECBINFHSA-N	-1	0	362.245	2.607	50	0		FFAARM
O=C([O-])Cn1ccc(NC(=O)[C@H]2C[C@H]2c2ccccc2C(F)(F)F)n1	ZINC000122743245	209359589	/nfs/dbraw/zinc/35/95/89/209359589.db2.gz	DBUPVBCRYQFTNT-QWRGUYRKSA-N	-1	0	353.300	2.729	50	0		FFAARM
O=C([O-])[C@H]1CCN(C(=O)C2(c3ccc(Br)cc3)CCC2)C1	ZINC000238082343	209358385	/nfs/dbraw/zinc/35/83/85/209358385.db2.gz	GBCVPWHARVOQKA-NSHDSACASA-N	-1	0	352.228	2.804	50	0		FFAARM
COc1ccc(C)cc1NC(=O)Cn1[n-]c(-c2ccc(F)cc2)cc1=O	ZINC000049006606	209333015	/nfs/dbraw/zinc/33/30/15/209333015.db2.gz	RHGLIOLWLRPRFH-UHFFFAOYSA-N	-1	0	355.369	2.938	50	0		FFAARM
CCc1ccc(-c2nc(C)c(C(=O)N3CCO[C@H](C(=O)[O-])C3)s2)cc1	ZINC000236992891	209283984	/nfs/dbraw/zinc/28/39/84/209283984.db2.gz	TXAYKJULHHYHLM-AWEZNQCLSA-N	-1	0	360.435	2.607	50	0		FFAARM
CN(C)c1c(Cl)cccc1NS(=O)(=O)c1ccc(C(=O)[O-])cc1	ZINC000042791753	209266034	/nfs/dbraw/zinc/26/60/34/209266034.db2.gz	NVWOQIMIJRNJPF-UHFFFAOYSA-N	-1	0	354.815	2.905	50	0		FFAARM
CCOc1ccc(Br)cc1S(=O)(=O)[N-]C(=O)c1ccoc1	ZINC000042252333	209253664	/nfs/dbraw/zinc/25/36/64/209253664.db2.gz	BIFKACFQPUAKDU-UHFFFAOYSA-N	-1	0	374.212	2.560	50	0		FFAARM
CCOc1ccc(-n2[nH][n-]c3c(=O)n(-c4ccc(C)cc4)c(=O)c2=3)cc1	ZINC000102820447	209242330	/nfs/dbraw/zinc/24/23/30/209242330.db2.gz	RNPJXVASVLJZKQ-SJORKVTESA-N	-1	0	350.378	2.892	50	0		FFAARM
C[C@@H]1CCCC[C@H]1NC(=O)CSc1nc(=O)cc([O-])n1C1CCCC1	ZINC000102137529	209233288	/nfs/dbraw/zinc/23/32/88/209233288.db2.gz	VIRVFJULUIPRBD-TZMCWYRMSA-N	-1	0	365.499	2.851	50	0		FFAARM
Cc1cc(=O)n2nc(CN(C(=O)c3ccccc3C)c3ccccc3)[n-]c2n1	ZINC000101801982	209230682	/nfs/dbraw/zinc/23/06/82/209230682.db2.gz	CTZISWPYGXGWMW-UHFFFAOYSA-N	-1	0	373.416	2.881	50	0		FFAARM
Cc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccc(F)cc4)c=3c2=O)cc1C	ZINC000101168224	209221696	/nfs/dbraw/zinc/22/16/96/209221696.db2.gz	YCENAKLSGQJLSJ-DLBZAZTESA-N	-1	0	352.369	2.936	50	0		FFAARM
CC(C)c1ccc(-c2noc(CCC(=O)N3CC[C@@H](C(=O)[O-])C3)n2)cc1	ZINC000236853844	209215993	/nfs/dbraw/zinc/21/59/93/209215993.db2.gz	HFGQECYBWNGCSZ-OAHLLOKOSA-N	-1	0	357.410	2.726	50	0		FFAARM
Cc1ccc(NC(=O)C2=C([O-])c3sccc3N(C)S2(=O)=O)cc1	ZINC000100326316	209211254	/nfs/dbraw/zinc/21/12/54/209211254.db2.gz	XSZSBMBHDGQDRH-UHFFFAOYSA-N	-1	0	350.421	2.701	50	0		FFAARM
CC(C)(C(=O)N1CCO[C@H](CC(=O)[O-])C1)c1cccc(C(F)(F)F)c1	ZINC000236692922	209199300	/nfs/dbraw/zinc/19/93/00/209199300.db2.gz	AXLZYHYFKQVQKQ-CYBMUJFWSA-N	-1	0	359.344	2.685	50	0		FFAARM
CC(C)[C@@H]1c2[nH]c3ccccc3c2CCN1C(=O)c1[nH]cnc1C(=O)[O-]	ZINC000097759333	209196623	/nfs/dbraw/zinc/19/66/23/209196623.db2.gz	RIPPRVBPSSYPIC-QGZVFWFLSA-N	-1	0	352.394	2.985	50	0		FFAARM
CC(C)(C)c1noc(CCCC(=O)N2CCC[C@@H](CCC(=O)[O-])C2)n1	ZINC000236662096	209195746	/nfs/dbraw/zinc/19/57/46/209195746.db2.gz	ULVCZHMHCXNHRQ-ZDUSSCGKSA-N	-1	0	351.447	2.793	50	0		FFAARM
O=C([O-])[C@H](C(=O)NCc1cnn(-c2cccc(F)c2)c1)C1CCCCC1	ZINC000299786660	206649904	/nfs/dbraw/zinc/64/99/04/206649904.db2.gz	NSBWFFNQPFSQAM-KRWDZBQOSA-N	-1	0	359.401	2.909	50	0		FFAARM
O=C(NCCc1ccc(Cl)cc1)c1c([O-])c2cccc3c2n(c1=O)CC3	ZINC000001294535	206872113	/nfs/dbraw/zinc/87/21/13/206872113.db2.gz	LRUDWIITHXKTMX-UHFFFAOYSA-N	-1	0	368.820	2.889	50	0		FFAARM
COc1ccc(CCNC(=O)C[C@@H](Cc2ccccc2)C(=O)[O-])cc1OC	ZINC000002291124	206908813	/nfs/dbraw/zinc/90/88/13/206908813.db2.gz	LNSYHTUJWZZIST-QGZVFWFLSA-N	-1	0	371.433	2.696	50	0	biogenic	FFAARM
O=C([O-])c1ccccc1NC(=O)c1ccc(NC(=O)[C@@H]2CCCO2)cc1	ZINC000002879892	206942172	/nfs/dbraw/zinc/94/21/72/206942172.db2.gz	YRIJNBMCZCJELM-INIZCTEOSA-N	-1	0	354.362	2.755	50	0		FFAARM
COc1ccc(C)cc1[N-]S(=O)(=O)c1cc2c3c(c1)CCCN3C(=O)C2	ZINC000004270328	207009659	/nfs/dbraw/zinc/00/96/59/207009659.db2.gz	FZAPKBOQCLWSDO-UHFFFAOYSA-N	-1	0	372.446	2.640	50	0		FFAARM
CCOc1ccc(-n2c(=O)c3[n-][nH]n(Cc4cccc(C)c4)c=3c2=O)cc1	ZINC000004483693	207021420	/nfs/dbraw/zinc/02/14/20/207021420.db2.gz	APEKABPSHXGTFT-QZTJIDSGSA-N	-1	0	364.405	2.887	50	0		FFAARM
O=c1c2[n-][nH]n(Cc3ccccc3Cl)c=2c(=O)n1-c1ccc(F)cc1	ZINC000004483683	207021464	/nfs/dbraw/zinc/02/14/64/207021464.db2.gz	RAELTFMPEFUALW-HUUCEWRRSA-N	-1	0	358.760	2.973	50	0		FFAARM
CCc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccccc4F)c=3c2=O)cc1	ZINC000004483654	207021508	/nfs/dbraw/zinc/02/15/08/207021508.db2.gz	GGYYGYHGSJFWJT-IAGOWNOFSA-N	-1	0	352.369	2.882	50	0		FFAARM
COc1cc([C@@H]2N[C@@H](C(=O)[O-])CS2)ccc1OC(=O)c1ccccc1	ZINC000004553711	207028517	/nfs/dbraw/zinc/02/85/17/207028517.db2.gz	NRPIROMOVISGKT-CZUORRHYSA-N	-1	0	359.403	2.703	50	0		FFAARM
Cc1cccc(CN(CC(=O)[O-])S(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000004679442	207037852	/nfs/dbraw/zinc/03/78/52/207037852.db2.gz	MESDOYQTWXRVKW-UHFFFAOYSA-N	-1	0	353.827	2.924	50	0		FFAARM
CC(C)COC(=O)CN1C(=O)S/C(=C\c2ccc(C(=O)[O-])cc2)C1=O	ZINC000004746571	207044499	/nfs/dbraw/zinc/04/44/99/207044499.db2.gz	OQGQQYZJXRDYBQ-QPEQYQDCSA-N	-1	0	363.391	2.620	50	0		FFAARM
COc1ccc(N(CC(=O)[O-])S(=O)(=O)c2ccccc2)cc1Cl	ZINC000004852867	207055626	/nfs/dbraw/zinc/05/56/26/207055626.db2.gz	YLZSHXZOUXAYQC-UHFFFAOYSA-N	-1	0	355.799	2.629	50	0		FFAARM
CCC(NCc1ccc(F)cc1)=C1C(=O)[N-]C(=O)N(C2CCCCC2)C1=O	ZINC000006186932	207133100	/nfs/dbraw/zinc/13/31/00/207133100.db2.gz	QEJSZXDSVRLGDJ-MSUUIHNZSA-N	-1	0	373.428	2.991	50	0		FFAARM
COc1cccc(NC(=O)[N-]S(=O)(=O)c2ccc(C)cc2)c1OC	ZINC000006668645	207152810	/nfs/dbraw/zinc/15/28/10/207152810.db2.gz	IYZJWAYBWHOUSE-UHFFFAOYSA-N	-1	0	350.396	2.523	50	0		FFAARM
CC1=C(C)C[C@H](C(=O)N2CCN(Cc3cccc(F)c3)CC2)[C@H](C(=O)[O-])C1	ZINC000006741886	207160027	/nfs/dbraw/zinc/16/00/27/207160027.db2.gz	RHAWVMBDVZUSKT-RBUKOAKNSA-N	-1	0	374.456	2.917	50	0		FFAARM
COc1ccc(/C=C2\CCn3c2nc2cc(C(=O)[O-])ccc2c3=O)cc1O	ZINC000006761845	207162476	/nfs/dbraw/zinc/16/24/76/207162476.db2.gz	OFMUHKLHZNFNIL-XYOKQWHBSA-N	-1	0	364.357	2.753	50	0		FFAARM
O=C([O-])c1ccc(NC(=O)c2ccccc2NC(=O)[C@@H]2CCCO2)cc1	ZINC000008189543	207222278	/nfs/dbraw/zinc/22/22/78/207222278.db2.gz	NXFWMCJHVBVBAW-INIZCTEOSA-N	-1	0	354.362	2.755	50	0		FFAARM
O=C([O-])c1ccccc1NC(=O)c1cccc(NC(=O)[C@H]2CCCO2)c1	ZINC000008189565	207222562	/nfs/dbraw/zinc/22/25/62/207222562.db2.gz	SUEXDFTXTPGVEC-MRXNPFEDSA-N	-1	0	354.362	2.755	50	0		FFAARM
COc1cc(-c2nc([N-]c3nc(C)cc(C)n3)n[nH]2)cc(OC)c1OC	ZINC000008914640	207250488	/nfs/dbraw/zinc/25/04/88/207250488.db2.gz	AXSGQIGZSXHXPI-UHFFFAOYSA-N	-1	0	356.386	2.648	50	0		FFAARM
CCC(=O)N[C@]([N-]c1nc2ccccc2s1)(C(=O)OC)C(F)(F)F	ZINC000008974222	207253942	/nfs/dbraw/zinc/25/39/42/207253942.db2.gz	RQEZNZNSCMKVAD-ZDUSSCGKSA-N	-1	0	361.345	2.666	50	0		FFAARM
COC(=O)C[C@H]([N-]S(=O)(=O)c1c(C)noc1C)c1ccccc1Cl	ZINC000009578375	207278700	/nfs/dbraw/zinc/27/87/00/207278700.db2.gz	JEWBFHDEUCJVFS-ZDUSSCGKSA-N	-1	0	372.830	2.528	50	0		FFAARM
CCn1c2ccccc2c([O-])c(C(=O)Nc2ccc3c(c2)OCO3)c1=O	ZINC000012414633	207372702	/nfs/dbraw/zinc/37/27/02/207372702.db2.gz	HMJFIFNRQGWSHC-UHFFFAOYSA-N	-1	0	352.346	2.708	50	0		FFAARM
CS(=O)(=O)[N-]c1ccccc1C(=O)NCCCOC1CCCCC1	ZINC000012526072	207384188	/nfs/dbraw/zinc/38/41/88/207384188.db2.gz	SECSMOHAJGKVNI-UHFFFAOYSA-N	-1	0	354.472	2.527	50	0		FFAARM
O=C([O-])C[C@@H]1Sc2nnc(-c3ccco3)n2N=C1c1ccc(F)cc1	ZINC000013182384	207454999	/nfs/dbraw/zinc/45/49/99/207454999.db2.gz	NBSKPXVTIAGNDC-LBPRGKRZSA-N	-1	0	358.354	2.879	50	0		FFAARM
COc1ccc(CCNC(=O)[C@@]2(C)CC[C@H](C(=O)[O-])C2(C)C)cc1OC	ZINC000018191970	207629567	/nfs/dbraw/zinc/62/95/67/207629567.db2.gz	SFNLISZDERIUTH-JLTOFOAXSA-N	-1	0	363.454	2.890	50	0		FFAARM
Cc1ccc(-n2[nH][n-]c3c(=O)n(-c4ccc(F)c(F)c4)c(=O)c2=3)cc1F	ZINC000033114698	208073567	/nfs/dbraw/zinc/07/35/67/208073567.db2.gz	QYTDNLBQOBEJTR-CABCVRRESA-N	-1	0	360.295	2.910	50	0		FFAARM
COc1ccc([C@H]2CCCN2C(=O)c2ccc(C(=O)[O-])nc2)cc1OC	ZINC000298164968	208089234	/nfs/dbraw/zinc/08/92/34/208089234.db2.gz	YEKDNADVLJYQPA-OAHLLOKOSA-N	-1	0	356.378	2.774	50	0		FFAARM
COc1ccc([C@@H]2CCCN2C(=O)c2ccc(C(=O)[O-])nc2)c(OC)c1	ZINC000298166417	208089449	/nfs/dbraw/zinc/08/94/49/208089449.db2.gz	YUIPROBNNMZQDD-INIZCTEOSA-N	-1	0	356.378	2.774	50	0		FFAARM
Cc1cc(=O)n2nc(CN(C(=O)C(C)(C)C)c3ccc(Cl)cc3)[n-]c2n1	ZINC000035476776	208126580	/nfs/dbraw/zinc/12/65/80/208126580.db2.gz	KBOIPKPXYMDBGP-UHFFFAOYSA-N	-1	0	373.844	2.959	50	0		FFAARM
COc1ccc(-c2nnc(CCC(=O)NC3CCCCC3)c(=O)[n-]2)cc1	ZINC000034762697	208109597	/nfs/dbraw/zinc/10/95/97/208109597.db2.gz	SSNIMRABUIPSAJ-UHFFFAOYSA-N	-1	0	356.426	2.634	50	0		FFAARM
C[C@@H]1C[C@H](C)C[N@H+]([C@@H](C(=O)[O-])c2cn(CC(=O)[O-])c3cc(F)ccc23)C1	ZINC000036358521	208158227	/nfs/dbraw/zinc/15/82/27/208158227.db2.gz	POUAEAIOQXDTMT-FTLABTOESA-N	-1	0	362.401	2.969	50	0		FFAARM
Cc1nc(-n2cccc2)sc1C(=O)N[C@@H](Cc1ccccc1)C(=O)[O-]	ZINC000036358478	208158398	/nfs/dbraw/zinc/15/83/98/208158398.db2.gz	POCBBEPMDVUYDC-AWEZNQCLSA-N	-1	0	355.419	2.668	50	0		FFAARM
CS(=O)(=O)Nc1cc(NC(=O)c2cc(Cl)ccc2[O-])ccc1F	ZINC000036398181	208164833	/nfs/dbraw/zinc/16/48/33/208164833.db2.gz	GRIJWEAFIVCZQW-UHFFFAOYSA-N	-1	0	358.778	2.809	50	0		FFAARM
COc1ccc(I)c(CC[N-]C(=O)C(F)(F)F)c1	ZINC000040448104	208253980	/nfs/dbraw/zinc/25/39/80/208253980.db2.gz	VEMUEECVVGWXHA-UHFFFAOYSA-N	-1	0	373.112	2.521	50	0		FFAARM
CNC(=O)c1cccc([N-]S(=O)(=O)c2cccc3cc(C)cnc32)c1	ZINC000043582792	208306352	/nfs/dbraw/zinc/30/63/52/208306352.db2.gz	JHIMFDJXTLNQTF-UHFFFAOYSA-N	-1	0	355.419	2.704	50	0		FFAARM
O=C([O-])[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1cnn(Cc2ccccc2)c1	ZINC000299327657	208284558	/nfs/dbraw/zinc/28/45/58/208284558.db2.gz	BNIDNLXXOAFNAI-NXHRZFHOSA-N	-1	0	353.422	2.789	50	0		FFAARM
COc1cc(C(=O)N2CC[C@@H](C(=O)[O-])C2)ccc1OCc1ccccc1	ZINC000299741576	208338611	/nfs/dbraw/zinc/33/86/11/208338611.db2.gz	GNVCGFSBAZOGDP-MRXNPFEDSA-N	-1	0	355.390	2.821	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)c1ccc2c(c1)NC(=O)CS2)c1cccs1	ZINC000299741655	208338847	/nfs/dbraw/zinc/33/88/47/208338847.db2.gz	ABRONSZMLVSRIH-NSHDSACASA-N	-1	0	362.432	2.738	50	0		FFAARM
O=C([O-])[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccc(Cn2cccn2)cc1	ZINC000299743552	208341133	/nfs/dbraw/zinc/34/11/33/208341133.db2.gz	LGLFETURCKJNKR-SQNIBIBYSA-N	-1	0	353.422	2.789	50	0		FFAARM
C[C@@H]1Sc2ccc(C(=O)N3[C@@H]4CCCC[C@@H]4C[C@H]3C(=O)[O-])cc2NC1=O	ZINC000299745776	208341821	/nfs/dbraw/zinc/34/18/21/208341821.db2.gz	SHLCCVGUYOEJAC-DRABBMOASA-N	-1	0	374.462	2.977	50	0		FFAARM
CN(Cc1ccc(C(=O)[O-])cc1)C(=O)[C@@H]1C[C@H]1c1ccc2c(c1)OCCO2	ZINC000299747613	208342261	/nfs/dbraw/zinc/34/22/61/208342261.db2.gz	DKFLKNCHKFSRKF-DLBZAZTESA-N	-1	0	367.401	2.918	50	0		FFAARM
Cc1cc(O[C@@H](C)C(=O)N(CC(=O)[O-])C2CCOCC2)ccc1Cl	ZINC000299748744	208353937	/nfs/dbraw/zinc/35/39/37/208353937.db2.gz	IAUXOABDXFXKJR-LBPRGKRZSA-N	-1	0	355.818	2.508	50	0		FFAARM
Cc1nc(-c2cccc(Cl)c2)sc1C(=O)N1CCOC[C@H]1C(=O)[O-]	ZINC000299750561	208358176	/nfs/dbraw/zinc/35/81/76/208358176.db2.gz	NWOAEPNMAPIYFA-LBPRGKRZSA-N	-1	0	366.826	2.698	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)C[C@@H]1CCOC1)c1ccc(OC(F)(F)F)cc1	ZINC000299752974	208362112	/nfs/dbraw/zinc/36/21/12/208362112.db2.gz	WHAYBHGUFMSGMM-GWCFXTLKSA-N	-1	0	361.316	2.644	50	0		FFAARM
O=C([O-])C[C@@H]1COCCN1C(=O)c1cccc(NCc2ccc(F)cc2)c1	ZINC000055061029	208464315	/nfs/dbraw/zinc/46/43/15/208464315.db2.gz	MZOZVIBXZBSBTM-GOSISDBHSA-N	-1	0	372.396	2.754	50	0		FFAARM
CCn1cc(-c2csc(NC(=O)Cc3ccccc3C(=O)[O-])n2)cn1	ZINC000071284629	208760285	/nfs/dbraw/zinc/76/02/85/208760285.db2.gz	OZUNOTFJEWACCF-UHFFFAOYSA-N	-1	0	356.407	2.906	50	0		FFAARM
O=C([O-])c1cc(-c2ccccc2)cc(S(=O)(=O)N2CCSCC2)c1	ZINC000072162761	208817127	/nfs/dbraw/zinc/81/71/27/208817127.db2.gz	JUGWDQSDSSJGOD-UHFFFAOYSA-N	-1	0	363.460	2.789	50	0		FFAARM
CC(C)=CC[C@@]1(C(=O)[O-])CCCN(C(=O)c2nn(C)c3c2CCCC3)C1	ZINC000091382116	208975244	/nfs/dbraw/zinc/97/52/44/208975244.db2.gz	CUSCMQLARIATRF-FQEVSTJZSA-N	-1	0	359.470	2.962	50	0		FFAARM
COCCc1ncc(-c2c(-c3ccccc3)ncn2CCC(=O)[O-])cn1	ZINC000091468346	208976436	/nfs/dbraw/zinc/97/64/36/208976436.db2.gz	SPRPZTSZQHTFFH-UHFFFAOYSA-N	-1	0	352.394	2.671	50	0		FFAARM
CC(C)=CC[C@]1(C(=O)[O-])CCCN(C(=O)CN(C)Cc2ccccn2)C1	ZINC000092028162	209012569	/nfs/dbraw/zinc/01/25/69/209012569.db2.gz	SFHXEDHLTLYBFH-HXUWFJFHSA-N	-1	0	359.470	2.563	50	0		FFAARM
COc1ccc2c(ccn2CCC(=O)N[C@H](C(=O)[O-])c2ccccc2)c1	ZINC000094992891	209019163	/nfs/dbraw/zinc/01/91/63/209019163.db2.gz	CUNBYOKUEPYUCR-IBGZPJMESA-N	-1	0	352.390	2.982	50	0		FFAARM
O=C([O-])[C@H](c1ccc(O)cc1)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000095498322	209061527	/nfs/dbraw/zinc/06/15/27/209061527.db2.gz	ZALZATDQIAXXOB-SFHVURJKSA-N	-1	0	360.841	2.989	50	0		FFAARM
C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N1CCC[C@@H](c2nnn[n-]2)C1	ZINC000095432775	209049296	/nfs/dbraw/zinc/04/92/96/209049296.db2.gz	BOFLRDAYHMWEKU-ZIAGYGMSSA-N	-1	0	357.458	2.671	50	0		FFAARM
CCCCNC(=O)[C@@H]1CCCC[C@@H]1C(=O)NCc1ccc(C(=O)[O-])s1	ZINC000095497315	209059544	/nfs/dbraw/zinc/05/95/44/209059544.db2.gz	DNDRQMOWRCRHLP-KGLIPLIRSA-N	-1	0	366.483	2.785	50	0		FFAARM
O=C([O-])C1(Oc2ccc3ncccc3c2)CCN(c2cnccn2)CC1	ZINC000077515961	132188284	/nfs/dbraw/zinc/18/82/84/132188284.db2.gz	KVHLIOVKYSMNGG-UHFFFAOYSA-N	-1	0	350.378	2.527	50	0		FFAARM
CCOc1ccccc1N1CCN([C@@H](C(=O)[O-])c2c(C)noc2C)CC1	ZINC000095386619	132210082	/nfs/dbraw/zinc/21/00/82/132210082.db2.gz	SKKXOEMLBYEXSM-GOSISDBHSA-N	-1	0	359.426	2.638	50	0		FFAARM
Cc1ccc(S(=O)(=O)N2C[C@@H](C(=O)[O-])Oc3ccc(Cl)cc32)cc1	ZINC000226087906	132288005	/nfs/dbraw/zinc/28/80/05/132288005.db2.gz	RGMOHJSNWVEDIY-HNNXBMFYSA-N	-1	0	367.810	2.689	50	0		FFAARM
Cc1ccc(S(=O)(=O)N2c3cc(C)ccc3OC[C@@H]2CC(=O)[O-])cc1	ZINC000299803784	132301006	/nfs/dbraw/zinc/30/10/06/132301006.db2.gz	CMFVXMWZZPYPMC-AWEZNQCLSA-N	-1	0	361.419	2.734	50	0		FFAARM
CN1C(=O)CCc2cc([N-]S(=O)(=O)c3cc(F)ccc3F)ccc21	ZINC000009828245	132381468	/nfs/dbraw/zinc/38/14/68/132381468.db2.gz	HHHKQFDDZDZODD-UHFFFAOYSA-N	-1	0	352.362	2.675	50	0		FFAARM
O=C([O-])c1ccnc(-c2ccnc(N3CCN(c4ccccc4)CC3)n2)c1	ZINC000071748120	136139990	/nfs/dbraw/zinc/13/99/90/136139990.db2.gz	WTAAUKSABXMSOY-UHFFFAOYSA-N	-1	0	361.405	2.563	50	0		FFAARM
O=C([O-])c1ccnc(-c2ccnc(N3CCO[C@@H](c4ccccc4)C3)n2)c1	ZINC000072406900	136145141	/nfs/dbraw/zinc/14/51/41/136145141.db2.gz	WHVMMOYVWRGAHR-GOSISDBHSA-N	-1	0	362.389	2.815	50	0		FFAARM
Cc1ccnc(N2CCC(C(=O)[O-])(n3ccc(-c4ccco4)n3)CC2)c1	ZINC000072408319	136145268	/nfs/dbraw/zinc/14/52/68/136145268.db2.gz	PBBUAUNCWGRGNU-UHFFFAOYSA-N	-1	0	352.394	2.927	50	0		FFAARM
C[C@@H](NC(=O)N1CCC(Oc2cccc(C(F)(F)F)c2)CC1)C(=O)[O-]	ZINC000426489456	263604102	/nfs/dbraw/zinc/60/41/02/263604102.db2.gz	ZQLQKYLQBUTQAZ-SNVBAGLBSA-N	-1	0	360.332	2.731	50	0		FFAARM
O=C([O-])[C@@H](Cc1ccc(Cl)cc1)NS(=O)(=O)c1ccc(Cl)cc1	ZINC000000846291	506235202	/nfs/dbraw/zinc/23/52/02/506235202.db2.gz	MBKIFDZRLANKGM-CQSZACIVSA-N	-1	0	374.245	2.968	50	0		FFAARM
O=C([N-]S(=O)(=O)c1ccc(Br)cc1)c1ccc(F)cc1	ZINC000000864910	506236558	/nfs/dbraw/zinc/23/65/58/506236558.db2.gz	VFDQRNCAZWDHLK-UHFFFAOYSA-N	-1	0	358.188	2.707	50	0		FFAARM
Cc1cccc(OCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)[O-])c1C	ZINC000000956373	506240969	/nfs/dbraw/zinc/24/09/69/506240969.db2.gz	RWUOGTGHMBJQEI-SFHVURJKSA-N	-1	0	366.417	2.976	50	0		FFAARM
COc1ccc(S(=O)(=O)Nc2ccc(F)cc2C(=O)[O-])cc1Cl	ZINC000032596921	506268417	/nfs/dbraw/zinc/26/84/17/506268417.db2.gz	JOVRVSVIWWOJRM-UHFFFAOYSA-N	-1	0	359.762	2.987	50	0		FFAARM
Cc1nnc(-c2c(C)n(C)c(C)c2S(=O)(=O)[N-]c2cccc(F)c2)o1	ZINC000065194068	506268640	/nfs/dbraw/zinc/26/86/40/506268640.db2.gz	QHIGROTWZHLYNX-UHFFFAOYSA-N	-1	0	364.402	2.940	50	0		FFAARM
O=C([O-])C[C@@H](NCc1ccco1)C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000001884653	506270810	/nfs/dbraw/zinc/27/08/10/506270810.db2.gz	QVAURIZCXYLCEN-CYBMUJFWSA-N	-1	0	356.300	2.870	50	0		FFAARM
CCc1cccc([N-]S(=O)(=O)c2cc3n(c2)CCN(C(C)C)C3=O)c1	ZINC000065254752	506276019	/nfs/dbraw/zinc/27/60/19/506276019.db2.gz	RJZQHVAYFSDTHE-UHFFFAOYSA-N	-1	0	361.467	2.716	50	0		FFAARM
C[C@@H]1CCc2cc(F)cc3c([O-])c(C(=O)NCc4ccncc4)c(=O)n1c23	ZINC000002355391	506277475	/nfs/dbraw/zinc/27/74/75/506277475.db2.gz	XBZYVYXPWKSSJF-LLVKDONJSA-N	-1	0	367.380	2.678	50	0		FFAARM
COc1ccc(Br)cc1C[C@H](NC(=O)OC(C)(C)C)C(=O)[O-]	ZINC000002379427	506277870	/nfs/dbraw/zinc/27/78/70/506277870.db2.gz	YRKQEACMEPBJKP-NSHDSACASA-N	-1	0	374.231	2.978	50	0		FFAARM
O=S(=O)([N-]c1ncn(Cc2cccc(Cl)c2)n1)c1ccc(F)cc1	ZINC000002779316	506291847	/nfs/dbraw/zinc/29/18/47/506291847.db2.gz	XVMZIEWAGLTOOY-UHFFFAOYSA-N	-1	0	366.805	2.920	50	0		FFAARM
CN(c1ccc(OCC(=O)[O-])cc1)S(=O)(=O)c1ccc(Cl)cc1	ZINC000003243186	506315645	/nfs/dbraw/zinc/31/56/45/506315645.db2.gz	REBVMMKOFAYOID-UHFFFAOYSA-N	-1	0	355.799	2.629	50	0		FFAARM
O=C([O-])Cc1ccc(NS(=O)(=O)c2ccc(Br)cc2)cc1	ZINC000003321450	506322520	/nfs/dbraw/zinc/32/25/20/506322520.db2.gz	WEKXURSNKXRWCL-UHFFFAOYSA-N	-1	0	370.224	2.877	50	0		FFAARM
COc1ccccc1C(=O)[N-]C(=O)COC(=O)c1oc2ccccc2c1C	ZINC000003518287	506340162	/nfs/dbraw/zinc/34/01/62/506340162.db2.gz	MYGRAXIPHPKNCW-UHFFFAOYSA-N	-1	0	367.357	2.863	50	0		FFAARM
CCOc1ccc([C@@H](CC(=O)[O-])NC(=O)COc2ccccc2)cc1OC	ZINC000003623032	506347571	/nfs/dbraw/zinc/34/75/71/506347571.db2.gz	WYZXESRVSVKNAW-MRXNPFEDSA-N	-1	0	373.405	2.805	50	0		FFAARM
COc1cc(NS(=O)(=O)c2ccc(C)cc2)c(C(=O)[O-])cc1OC	ZINC000004297040	506369577	/nfs/dbraw/zinc/36/95/77/506369577.db2.gz	KLDPZEDUGBZVJV-UHFFFAOYSA-N	-1	0	351.380	2.511	50	0		FFAARM
CCC(=O)N1CCc2ccc([N-]S(=O)(=O)c3cccs3)cc2C1	ZINC000008976954	506676292	/nfs/dbraw/zinc/67/62/92/506676292.db2.gz	VQQHLFAEUPUFAS-UHFFFAOYSA-N	-1	0	350.465	2.844	50	0		FFAARM
Cc1n[nH]c(C)c1S(=O)(=O)[N-]c1ccc(N2CCCC2=O)c(Cl)c1	ZINC000012970419	506920164	/nfs/dbraw/zinc/92/01/64/506920164.db2.gz	ZKJZVEBDYPURTD-UHFFFAOYSA-N	-1	0	368.846	2.608	50	0		FFAARM
O=C([O-])C1(c2ccccc2)CCN(C(=O)COc2ccc(F)cc2)CC1	ZINC000013186469	506932448	/nfs/dbraw/zinc/93/24/48/506932448.db2.gz	KDYMWGCEWXLFIR-UHFFFAOYSA-N	-1	0	357.381	2.850	50	0		FFAARM
Cc1nnc(SCC(=O)Nc2ccc(Oc3ccccc3)cc2)[n-]c1=O	ZINC000013452852	506940615	/nfs/dbraw/zinc/94/06/15/506940615.db2.gz	XZRVNFHXPBPZCU-UHFFFAOYSA-N	-1	0	368.418	2.996	50	0		FFAARM
CC(=O)N1CCc2ccc([N-]S(=O)(=O)c3cc(F)ccc3F)cc21	ZINC000013697022	506951323	/nfs/dbraw/zinc/95/13/23/506951323.db2.gz	BROMNOIOGBZUBB-UHFFFAOYSA-N	-1	0	352.362	2.675	50	0		FFAARM
O=C(C[C@@H]1SC(=O)[N-]C1=O)N1CCC[C@@H]1c1nc2ccccc2s1	ZINC000014083383	506963613	/nfs/dbraw/zinc/96/36/13/506963613.db2.gz	NSPAHKJXFDMAOC-PWSUYJOCSA-N	-1	0	361.448	2.702	50	0		FFAARM
Cc1ccc(C)c(-c2n[nH]cc2[C@@H]2CC(=O)Nc3[nH]nc(C(=O)[O-])c32)c1	ZINC000067921591	507051999	/nfs/dbraw/zinc/05/19/99/507051999.db2.gz	MIUGAABLISTNQN-NSHDSACASA-N	-1	0	351.366	2.589	50	0		FFAARM
NC(=O)c1c(NC(=O)CCCC(=O)[O-])sc2c1CCc1ccccc1-2	ZINC000017073948	507114616	/nfs/dbraw/zinc/11/46/16/507114616.db2.gz	CDOHMAPAOATVGY-UHFFFAOYSA-N	-1	0	358.419	2.806	50	0		FFAARM
O=C([O-])[C@H]1CC=CC[C@@H]1C(=O)Nc1sc2c(c1C(=O)NC1CC1)CCC2	ZINC000017076636	507114640	/nfs/dbraw/zinc/11/46/40/507114640.db2.gz	ZAQVOIXDPXEAFA-RYUDHWBXSA-N	-1	0	374.462	2.735	50	0		FFAARM
C[C@@H](CC(=O)[O-])CC(=O)Nc1sc2c(c1C(=O)NC1CC1)CCCC2	ZINC000017074927	507114906	/nfs/dbraw/zinc/11/49/06/507114906.db2.gz	UPKFUGPJNOVYEC-SNVBAGLBSA-N	-1	0	364.467	2.959	50	0		FFAARM
O=C([O-])c1cccc(NC2=C(Cl)C(=O)O[C@@H]2OC(=O)c2ccccc2)c1	ZINC000018038070	507133787	/nfs/dbraw/zinc/13/37/87/507133787.db2.gz	DQXGRTBQRWDJHU-SFHVURJKSA-N	-1	0	373.748	2.987	50	0		FFAARM
Cc1ccc([N-]S(=O)(=O)c2cc(Br)cnc2N)cc1C	ZINC000020467613	507221653	/nfs/dbraw/zinc/22/16/53/507221653.db2.gz	CAOSKGCVCUAAKY-UHFFFAOYSA-N	-1	0	356.245	2.844	50	0		FFAARM
CCN1CCN([C@H](c2sc3nc(C)nn3c2[O-])c2cccc(C)c2)CC1	ZINC000022468457	507294207	/nfs/dbraw/zinc/29/42/07/507294207.db2.gz	YYMVLPNNNOCFST-INIZCTEOSA-N	-1	0	371.510	2.840	50	0		FFAARM
CCc1nc2sc([C@@H](c3ccc(F)cc3)N3CCOCC3)c([O-])n2n1	ZINC000022854221	507316061	/nfs/dbraw/zinc/31/60/61/507316061.db2.gz	JJUTZYMAYNOINH-CQSZACIVSA-N	-1	0	362.430	2.620	50	0		FFAARM
CCS(=O)(=O)c1ccc([O-])c(NC(=O)CCC(=O)c2cccs2)c1	ZINC000024152952	507395026	/nfs/dbraw/zinc/39/50/26/507395026.db2.gz	GLGRBRZFDCYJON-UHFFFAOYSA-N	-1	0	367.448	2.849	50	0		FFAARM
Cc1cc(C(=O)[O-])c(O)c(S(=O)(=O)Nc2ccc(Cl)cc2F)c1	ZINC000058377327	507411471	/nfs/dbraw/zinc/41/14/71/507411471.db2.gz	YKHHRDHRHQMOLM-UHFFFAOYSA-N	-1	0	359.762	2.992	50	0		FFAARM
O=C([N-]O[C@H]1CCCCO1)c1nn(-c2ccccc2)c(=O)c2ccccc21	ZINC000058418938	507417004	/nfs/dbraw/zinc/41/70/04/507417004.db2.gz	ZSPAVPJNVWRCMX-KRWDZBQOSA-N	-1	0	365.389	2.574	50	0		FFAARM
CNC(=O)c1cccc(NC(=O)c2ccc3c(c2)[n-]c(=S)[nH]c3=O)c1	ZINC000058433154	507417686	/nfs/dbraw/zinc/41/76/86/507417686.db2.gz	PBBCKIIXLLAXAN-UHFFFAOYSA-N	-1	0	354.391	2.610	50	0		FFAARM
COc1ccc(C=CC(=O)Nc2ccc(-c3nc(=O)o[n-]3)cc2)cc1F	ZINC000069435719	507491008	/nfs/dbraw/zinc/49/10/08/507491008.db2.gz	JKAVYJWUYFEVLP-YCRREMRBSA-N	-1	0	355.325	2.830	50	0		FFAARM
COc1cccc2c1N(S(=O)(=O)c1cc(C)c(C(=O)[O-])s1)CCC2	ZINC000048386368	507514769	/nfs/dbraw/zinc/51/47/69/507514769.db2.gz	QMHIWJYRPZMZOV-UHFFFAOYSA-N	-1	0	367.448	2.905	50	0		FFAARM
O=C(NCC1(N2CCOCC2)CCCCC1)c1ccc([O-])c(Cl)c1	ZINC000060632786	507568439	/nfs/dbraw/zinc/56/84/39/507568439.db2.gz	BOLGLVHUEPPTQA-UHFFFAOYSA-N	-1	0	352.862	2.811	50	0		FFAARM
CC(=O)c1ccccc1-c1cc(C(=O)[O-])cc(S(=O)(=O)NC(C)C)c1	ZINC000071403972	507701845	/nfs/dbraw/zinc/70/18/45/507701845.db2.gz	FCNYOTMLUINACT-UHFFFAOYSA-N	-1	0	361.419	2.941	50	0		FFAARM
COc1ccc(CC(=O)[O-])cc1S(=O)(=O)N1C[C@H](C)c2ccccc21	ZINC000071824018	507719381	/nfs/dbraw/zinc/71/93/81/507719381.db2.gz	PXCJBRKWCNYBCU-LBPRGKRZSA-N	-1	0	361.419	2.635	50	0		FFAARM
CS(=O)(=O)c1ccc(CN2CC[C@H](c3ccccc3C(=O)[O-])C2)cc1	ZINC000072163445	507766917	/nfs/dbraw/zinc/76/69/17/507766917.db2.gz	BNBPOGXQZKRCJX-HNNXBMFYSA-N	-1	0	359.447	2.778	50	0		FFAARM
O=C([O-])[C@]1(O)[C@@H](c2ccccc2)[C@H](c2ccc(Cl)cc2)Nc2ncnn21	ZINC000072332370	507777122	/nfs/dbraw/zinc/77/71/22/507777122.db2.gz	HIQAZQFVSMOXKR-RLFYNMQTSA-N	-1	0	370.796	2.612	50	0		FFAARM
COc1cccc(OC[C@@H]2CCCN(C(=O)CCc3cc(=O)[n-]o3)C2)c1	ZINC000072435965	507791278	/nfs/dbraw/zinc/79/12/78/507791278.db2.gz	ONOSKTZYHPAXJB-CQSZACIVSA-N	-1	0	360.410	2.639	50	0		FFAARM
CCC[C@H](NC(=O)c1cc(C)c2c(=O)[n-]c(=O)nc-2[nH]1)c1ccccc1	ZINC000072847614	507861979	/nfs/dbraw/zinc/86/19/79/507861979.db2.gz	PHDGVSUJYHCMBK-ZDUSSCGKSA-N	-1	0	352.394	2.603	50	0		FFAARM
O=C([O-])Cn1cnc(-c2ccccc2)c1-c1cnc(N2CCOCC2)s1	ZINC000091626126	507997667	/nfs/dbraw/zinc/99/76/67/507997667.db2.gz	KONWFTAZRAAWFS-UHFFFAOYSA-N	-1	0	370.434	2.595	50	0		FFAARM
Cc1noc(C)c1CCC(=O)N1C[C@@H](c2ccccc2C)[C@H](C(=O)[O-])C1	ZINC000091643581	507999687	/nfs/dbraw/zinc/99/96/87/507999687.db2.gz	DOIMNMRXLGTORE-ZWKOTPCHSA-N	-1	0	356.422	2.859	50	0		FFAARM
O=C(Nc1cccc(F)c1)c1c[nH]nc1S(=O)(=O)[N-]c1ccccc1	ZINC000075476405	508110066	/nfs/dbraw/zinc/11/00/66/508110066.db2.gz	GWMMANBOGOWKPG-UHFFFAOYSA-N	-1	0	360.370	2.602	50	0		FFAARM
CCCCn1c(=O)c(C2=NN[C@@H](c3ccc(OC)cc3)C2)c([O-])[nH]c1=S	ZINC000101763466	508256451	/nfs/dbraw/zinc/25/64/51/508256451.db2.gz	GGRURZNAGAYFSP-CYBMUJFWSA-N	-1	0	374.466	2.859	50	0		FFAARM
Cc1cc2ncc(C(=O)N3CCC[C@@](C)(c4ccccc4)C3)c(=O)n2[n-]1	ZINC000102704567	508282468	/nfs/dbraw/zinc/28/24/68/508282468.db2.gz	FMAMJMFXFNPJQB-HXUWFJFHSA-N	-1	0	350.422	2.525	50	0		FFAARM
Cc1nc2cc(=O)[n-]n2c(C)c1CNC(=O)[C@@H]1CCCC[C@H]1C(F)(F)F	ZINC000114412110	508311050	/nfs/dbraw/zinc/31/10/50/508311050.db2.gz	HBBBEXZBQGNBRS-DGCLKSJQSA-N	-1	0	370.375	2.624	50	0		FFAARM
CCc1nn(C)cc1[N-]S(=O)(=O)c1ccc(Br)cc1C	ZINC000130639184	508825409	/nfs/dbraw/zinc/82/54/09/508825409.db2.gz	ACBMGBVIOCHQNS-UHFFFAOYSA-N	-1	0	358.261	2.854	50	0		FFAARM
COC(=O)C[C@H](c1ccc(OC)c(O)c1)c1c([O-])c2ccccc2oc1=O	ZINC000217858750	509271708	/nfs/dbraw/zinc/27/17/08/509271708.db2.gz	JMQQGAFTFPAARS-CYBMUJFWSA-N	-1	0	370.357	2.908	50	0	biogenic	FFAARM
COc1ccc2c(c1OC)C(=O)O[C@H]2CC(=O)Nc1ccc(C(=O)[O-])cc1	ZINC000217680676	509271715	/nfs/dbraw/zinc/27/17/15/509271715.db2.gz	VOTYVCPRWVFKQU-AWEZNQCLSA-N	-1	0	371.345	2.642	50	0	biogenic	FFAARM
Cn1cc(CC(=O)NCCOc2cccc(C(=O)[O-])c2)c2ccccc21	ZINC000219425270	509287839	/nfs/dbraw/zinc/28/78/39/509287839.db2.gz	TZSFRHZXMFPVGW-UHFFFAOYSA-N	-1	0	352.390	2.614	50	0		FFAARM
CC(=O)N(C)c1ccc(S(=O)(=O)[N-]c2cc(C(C)(C)C)on2)cc1	ZINC000225443315	509372025	/nfs/dbraw/zinc/37/20/25/509372025.db2.gz	CIDZWFOXXVTPPS-UHFFFAOYSA-N	-1	0	351.428	2.756	50	0		FFAARM
CC(C)(C)c1noc(CCCC(=O)N2Cc3ccccc3C[C@@H]2C(=O)[O-])n1	ZINC000236747737	509496219	/nfs/dbraw/zinc/49/62/19/509496219.db2.gz	RTEOEEIKAYQZHC-OAHLLOKOSA-N	-1	0	371.437	2.728	50	0		FFAARM
Cc1oc(-c2ccccc2)nc1CC(=O)N(CCC(=O)[O-])C1CCOCC1	ZINC000237647551	509701379	/nfs/dbraw/zinc/70/13/79/509701379.db2.gz	VAXNDSLRWJYDSB-UHFFFAOYSA-N	-1	0	372.421	2.675	50	0		FFAARM
O=C([O-])c1cnn(-c2cccc(NC(=O)[C@@H]3CCCO3)c2)c1C(F)(F)F	ZINC000237959365	509786180	/nfs/dbraw/zinc/78/61/80/509786180.db2.gz	VEZJHSPABJTITO-LBPRGKRZSA-N	-1	0	369.299	2.707	50	0		FFAARM
O=C(CSCC(=O)N1CCCCC1)Nc1cc(Cl)c([O-])cc1F	ZINC000240934489	509841147	/nfs/dbraw/zinc/84/11/47/509841147.db2.gz	JCLJQQYHDPGIEW-UHFFFAOYSA-N	-1	0	360.838	2.869	50	0		FFAARM
CN(C(=O)c1cc(C(=O)[O-])co1)[C@H]1CCN(c2ccccc2Cl)C1=O	ZINC000183789638	509975989	/nfs/dbraw/zinc/97/59/89/509975989.db2.gz	UQUMCQTXHARKOI-ZDUSSCGKSA-N	-1	0	362.769	2.509	50	0		FFAARM
Cc1cccc2c1CC(C)(C)N(C(=O)c1c[nH]c3nc(=O)[n-]c(=O)c-3c1)C2	ZINC000296157243	511637802	/nfs/dbraw/zinc/63/78/02/511637802.db2.gz	KVXNFSLURDJJJU-UHFFFAOYSA-N	-1	0	364.405	2.722	50	0		FFAARM
Cc1noc(C)c1CO[C@H]1CCN(C(=O)c2cc(F)c(F)c([O-])c2F)C1	ZINC000364014649	511908154	/nfs/dbraw/zinc/90/81/54/511908154.db2.gz	OTQSJPAOGKIHIY-JTQLQIEISA-N	-1	0	370.327	2.846	50	0		FFAARM
COc1ccccc1-c1ncc(CNC(=O)[C@H]2CC[C@@H](C(=O)[O-])C2)s1	ZINC000426445581	513943784	/nfs/dbraw/zinc/94/37/84/513943784.db2.gz	NVKDZBRFUHEICA-NWDGAFQWSA-N	-1	0	360.435	2.936	50	0		FFAARM
Cc1cccc([C@H](NC(=O)N2CCN(Cc3cccs3)CC2)C(=O)[O-])c1	ZINC000426475325	513950274	/nfs/dbraw/zinc/95/02/74/513950274.db2.gz	CCRZKZKSYMDKEH-KRWDZBQOSA-N	-1	0	373.478	2.710	50	0		FFAARM
O=C([O-])Cn1ccc([C@@H]2CCCN(C(=O)Nc3cc(F)ccc3F)C2)n1	ZINC000426513771	513965304	/nfs/dbraw/zinc/96/53/04/513965304.db2.gz	WBIWMFCIRHRZPI-LLVKDONJSA-N	-1	0	364.352	2.657	50	0		FFAARM
CN(c1cccc(CCC(=O)[O-])c1)S(=O)(=O)c1ccc2c(c1)COC2	ZINC000541304791	516976324	/nfs/dbraw/zinc/97/63/24/516976324.db2.gz	ONHJYRSHOPWQDU-UHFFFAOYSA-N	-1	0	361.419	2.559	50	0		FFAARM
NC(=O)C[C@@H]1CCCCN1C(=O)c1cccc(-c2ccccc2C(=O)[O-])c1	ZINC000584894741	518528095	/nfs/dbraw/zinc/52/80/95/518528095.db2.gz	GXADHFMHSNMWPZ-INIZCTEOSA-N	-1	0	366.417	2.922	50	0		FFAARM
O=C([O-])CC[C@H]1CCCN(C(=O)/C=C\c2cnn(-c3ccccc3)c2)C1	ZINC000606445201	521070957	/nfs/dbraw/zinc/07/09/57/521070957.db2.gz	PTKKUIDMXRPKQS-SIJIIQCFSA-N	-1	0	353.422	2.989	50	0		FFAARM
CCOC(=O)c1c(C)[nH]c(C)c1S(=O)(=O)[N-]c1ccc(OC)cc1	ZINC000020574829	521383228	/nfs/dbraw/zinc/38/32/28/521383228.db2.gz	VSQSCTWFQIKVQJ-UHFFFAOYSA-N	-1	0	352.412	2.618	50	0		FFAARM
COC[C@@H](C)N(C(=O)c1cccc(C(=O)[O-])n1)[C@H]1CCc2ccccc21	ZINC000630305935	522780567	/nfs/dbraw/zinc/78/05/67/522780567.db2.gz	UJSOJPDBCRAUCR-ACJLOTCBSA-N	-1	0	354.406	2.944	50	0		FFAARM
Cc1nn(CCC(=O)[O-])c(C)c1NC(=O)[C@H]1C[C@@]12CCc1ccccc12	ZINC000630330843	522795172	/nfs/dbraw/zinc/79/51/72/522795172.db2.gz	GLUQIABFRNQRGA-OXQOHEQNSA-N	-1	0	353.422	2.817	50	0		FFAARM
C[C@H](Sc1ccccc1Cl)C(=O)N1CCC[C@H](c2nnn[n-]2)C1	ZINC000089420091	525994319	/nfs/dbraw/zinc/99/43/19/525994319.db2.gz	NCJJLCDGQZTTHR-QWRGUYRKSA-N	-1	0	351.863	2.740	50	0		FFAARM
O=C([O-])[C@H]1CN(C(=O)c2cc(-c3cccs3)nc3ccccc32)CCO1	ZINC000178280427	526331920	/nfs/dbraw/zinc/33/19/20/526331920.db2.gz	CKHCUTRYXWCRBG-MRXNPFEDSA-N	-1	0	368.414	2.889	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)[C@H]1CCCOC1)c1ccc(Br)cc1	ZINC000238149905	527625568	/nfs/dbraw/zinc/62/55/68/527625568.db2.gz	OFVZEKGKGQKNJG-WCQYABFASA-N	-1	0	356.216	2.508	50	0		FFAARM
CN1C(=O)C[C@H](C(=O)[O-])C12CCN(c1ccnc3cc(Cl)ccc31)CC2	ZINC000095387176	536316937	/nfs/dbraw/zinc/31/69/37/536316937.db2.gz	KAQJCZLPIWZNLN-CQSZACIVSA-N	-1	0	373.840	2.790	50	0		FFAARM
CC(C)c1cc(=O)n2nc(CNc3ccc(Br)cc3)[n-]c2n1	ZINC000101798422	570823783	/nfs/dbraw/zinc/82/37/83/570823783.db2.gz	NDSVGZLFYIAAIX-UHFFFAOYSA-N	-1	0	362.231	2.916	50	0		FFAARM
Cc1cc(=O)n2[n-]cc(C(=O)Nc3ccc(Br)c(C)c3)c2n1	ZINC000102905493	570841525	/nfs/dbraw/zinc/84/15/25/570841525.db2.gz	JSRDCBNTGKBHBS-UHFFFAOYSA-N	-1	0	361.199	2.654	50	0		FFAARM
O=C([O-])[C@@H]1CCCN(C(=O)C2(c3cccc(Cl)c3)CCOCC2)C1	ZINC000109621846	570928832	/nfs/dbraw/zinc/92/88/32/570928832.db2.gz	OPQICHDTIGXYKW-CYBMUJFWSA-N	-1	0	351.830	2.711	50	0		FFAARM
O=C(Nc1ccccc1[N-]S(=O)(=O)c1cccs1)C1CCOCC1	ZINC000084506030	571087449	/nfs/dbraw/zinc/08/74/49/571087449.db2.gz	ZWXZSSZDRBNRNB-UHFFFAOYSA-N	-1	0	366.464	2.914	50	0		FFAARM
Cc1[nH]c(C(=O)N[C@H](Cn2cccn2)c2ccccc2)c(C)c1C(=O)[O-]	ZINC000738153867	600788487	/nfs/dbraw/zinc/78/84/87/600788487.db2.gz	FMSDGOBQLSXZFY-OAHLLOKOSA-N	-1	0	352.394	2.698	50	0		FFAARM
O=C([O-])c1cccc(CNC(=O)CCCc2ccc3c(c2)CC(=O)N3)c1	ZINC000584908035	601919349	/nfs/dbraw/zinc/91/93/49/601919349.db2.gz	WDRGPEGFHLYUIM-UHFFFAOYSA-N	-1	0	352.390	2.519	50	0		FFAARM
CCOc1cc(/C=C2\NC(=S)NC2=O)cc(Br)c1OCC	ZINC000003299736	727774721	/nfs/dbraw/zinc/77/47/21/727774721.db2.gz	HSBFKYPLARTFGO-POHAHGRESA-N	-1	0	371.256	2.592	50	0		FFAARM
O=S(=O)([N-]CCn1nc(C2CC2)cc1C1CC1)c1c(F)cccc1F	ZINC000585300241	845949876	/nfs/dbraw/zinc/94/98/76/845949876.db2.gz	QLICOBUEXXCZKA-UHFFFAOYSA-N	-1	0	367.421	2.895	50	0		FFAARM
CC[C@@](NC(=O)/C=C/c1ccc(C(=O)NC)cc1)(C(=O)[O-])c1ccccc1	ZINC000170671676	939032710	/nfs/dbraw/zinc/03/27/10/939032710.db2.gz	DQFHRJUMXCNPOH-KVDXNUTJSA-N	-1	0	366.417	2.566	50	0		FFAARM
Cc1cc2ncc(C(=O)N3CCCC[C@@H]3c3ccc(F)cc3)c(=O)n2[n-]1	ZINC000102759303	968975410	/nfs/dbraw/zinc/97/54/10/968975410.db2.gz	QTZYBKLVCVEMPV-MRXNPFEDSA-N	-1	0	354.385	2.838	50	0		FFAARM
O=C([O-])CC[C@@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1ccc2c(c1)OCCO2	ZINC000262205373	969087212	/nfs/dbraw/zinc/08/72/12/969087212.db2.gz	VXMHLZPVHRKDTC-HRCADAONSA-N	-1	0	359.422	2.807	50	0		FFAARM
O=C(c1n[n-]c2ccccc2c1=O)N1CCC(OCc2ccccc2)CC1	ZINC000171763509	985401696	/nfs/dbraw/zinc/40/16/96/985401696.db2.gz	RWTIYEMBSHXBKV-UHFFFAOYSA-N	-1	0	363.417	2.745	50	0		FFAARM
CN(Cc1c[nH]nc1-c1ccc(F)cc1)C(=O)N[C@H](C(=O)[O-])C(C)(C)C	ZINC000823633825	999065562	/nfs/dbraw/zinc/06/55/62/999065562.db2.gz	SBEVHNNMFGZUQP-OAHLLOKOSA-N	-1	0	362.405	2.857	50	0		FFAARM
C[C@@H]1CCc2cc(F)cc3c([O-])c(C(=O)NCc4ccco4)c(=O)n1c23	ZINC000004326597	1012365803	/nfs/dbraw/zinc/36/58/03/1012365803.db2.gz	DJKOBSQAIJTFKF-SNVBAGLBSA-N	-1	0	356.353	2.876	50	0		FFAARM
Cc1c(C(=O)N[C@@H]2C[C@@H](C(=O)[O-])c3ccccc32)cnn1C1CCOCC1	ZINC000653327135	1024901866	/nfs/dbraw/zinc/90/18/66/1024901866.db2.gz	RBCQQMZHALPHJU-SJLPKXTDSA-N	-1	0	369.421	2.586	50	0		FFAARM
CC1(C)CO[C@@H](c2cccc(F)c2)CN1C(=O)c1ccnc(C(=O)[O-])c1	ZINC000659198561	1025970286	/nfs/dbraw/zinc/97/02/86/1025970286.db2.gz	GPLHCDWLDOXBTL-MRXNPFEDSA-N	-1	0	358.369	2.911	50	0		FFAARM
COc1ccc([C@H](c2sc3ncnn3c2[O-])N2C[C@H](C)O[C@@H](C)C2)cc1	ZINC000022609441	209687931	/nfs/dbraw/zinc/68/79/31/209687931.db2.gz	UHVPBRKGMCUSBA-SLEUVZQESA-N	-1	0	374.466	2.704	50	0		FFAARM
COC(=O)C[C@@H](c1ccc2c(c1)OCO2)c1c([O-])c2ccccc2oc1=O	ZINC000217821081	209660429	/nfs/dbraw/zinc/66/04/29/209660429.db2.gz	VABSXQDQQNHUSJ-ZDUSSCGKSA-N	-1	0	368.341	2.922	50	0	biogenic	FFAARM
CCO[C@@H]1C[C@@H](O)C12CCN(C(=O)c1ccc3[n-]c(=S)oc3c1)CC2	ZINC000175191537	209563762	/nfs/dbraw/zinc/56/37/62/209563762.db2.gz	PNBQRYVVBYUBDN-HUUCEWRRSA-N	-1	0	362.451	2.509	50	0		FFAARM
O=C([O-])[C@@H](CSC(=O)c1ccccc1)NC(=O)OCc1ccccc1	ZINC000001626959	209490147	/nfs/dbraw/zinc/49/01/47/209490147.db2.gz	SGXFVAMPPOGQON-OAHLLOKOSA-N	-1	0	359.403	2.940	50	0		FFAARM
Cn1c(=O)c(C(=O)NCCc2ccc(Cl)cc2)c([O-])c2ccccc21	ZINC000100820071	209481642	/nfs/dbraw/zinc/48/16/42/209481642.db2.gz	BSVYIXNUCHGZJO-UHFFFAOYSA-N	-1	0	356.809	2.870	50	0		FFAARM
Cc1coc2cc3oc(=O)c(CC(=O)N4CCC[C@H]4C(=O)[O-])c(C)c3cc12	ZINC000004064841	209410658	/nfs/dbraw/zinc/41/06/58/209410658.db2.gz	GYIJLLWCMRKVHP-HNNXBMFYSA-N	-1	0	369.373	2.774	50	0	biogenic	FFAARM
Cc1ccc(-c2noc(CCC(=O)N3CCCC[C@@H]3C(=O)[O-])n2)cc1F	ZINC000136531413	209373994	/nfs/dbraw/zinc/37/39/94/209373994.db2.gz	CHMYISRPONROKI-CQSZACIVSA-N	-1	0	361.373	2.582	50	0		FFAARM
O=C([O-])CN(C(=O)[C@H]1C[C@H]1c1ccccc1C(F)(F)F)C1CCOCC1	ZINC000238105912	209360204	/nfs/dbraw/zinc/36/02/04/209360204.db2.gz	OUAFEDIYTWENKY-KBPBESRZSA-N	-1	0	371.355	2.901	50	0		FFAARM
O=C([O-])C[C@@H]1CN(C(=O)[C@@H]2C[C@@H]2c2ccccc2C(F)(F)F)CCO1	ZINC000238196785	209359942	/nfs/dbraw/zinc/35/99/42/209359942.db2.gz	XVEZOBFPJUVZST-RAIGVLPGSA-N	-1	0	357.328	2.511	50	0		FFAARM
O=C([O-])CCN(C(=O)[C@H]1C[C@@H]1c1ccccc1Cl)C1CCOCC1	ZINC000238069918	209357282	/nfs/dbraw/zinc/35/72/82/209357282.db2.gz	NOZDHAGARZLPEM-CABCVRRESA-N	-1	0	351.830	2.926	50	0		FFAARM
O=C([O-])C1CCC(NC(=O)[C@@H]2CCCCN2Cc2ccc(F)cc2)CC1	ZINC000238011359	209357299	/nfs/dbraw/zinc/35/72/99/209357299.db2.gz	PKXPDMOUSCQFRS-VJFUWPCTSA-N	-1	0	362.445	2.940	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)[C@@H]1CC(=O)Nc2cc(F)ccc21)c1ccc(F)cc1	ZINC000237952831	209356075	/nfs/dbraw/zinc/35/60/75/209356075.db2.gz	VYDRSUBYBXGVTK-CABCVRRESA-N	-1	0	374.343	2.723	50	0		FFAARM
C[C@H](Oc1cccc(Br)c1)C(=O)N1CCC(C(=O)[O-])CC1	ZINC000237645574	209352586	/nfs/dbraw/zinc/35/25/86/209352586.db2.gz	DESWYNDPBVWLDQ-JTQLQIEISA-N	-1	0	356.216	2.540	50	0		FFAARM
CCO[C@@H](C)c1nc(CC(=O)N2CCC[C@H](CCC(=O)[O-])C2)cs1	ZINC000237031923	209325582	/nfs/dbraw/zinc/32/55/82/209325582.db2.gz	TUOXSMAGIRQADX-QWHCGFSZSA-N	-1	0	354.472	2.887	50	0		FFAARM
CN(C(=O)c1ccc(C(=O)[O-])o1)[C@H]1CCN(c2ccccc2Cl)C1=O	ZINC000237033292	209325073	/nfs/dbraw/zinc/32/50/73/209325073.db2.gz	ODXHDAPMVXWBTI-LBPRGKRZSA-N	-1	0	362.769	2.509	50	0		FFAARM
O=C([O-])COc1ccc(S(=O)(=O)Nc2ccc(Cl)c(F)c2)cc1	ZINC000042794426	209265534	/nfs/dbraw/zinc/26/55/34/209265534.db2.gz	ZWENTMXMHKSFIX-UHFFFAOYSA-N	-1	0	359.762	2.743	50	0		FFAARM
CCn1c(=O)c2ccc(C(=O)Nc3ccccc3OC)cc2[n-]c1=S	ZINC000102751634	209240673	/nfs/dbraw/zinc/24/06/73/209240673.db2.gz	IUKFLOGHBLHWRP-UHFFFAOYSA-N	-1	0	355.419	2.966	50	0		FFAARM
COc1ccc(NS(=O)(=O)c2cc3c4c(c2)CCCN4C(=O)[C@H]3C)cc1	ZINC000102675848	209239303	/nfs/dbraw/zinc/23/93/03/209239303.db2.gz	OIXJNOWBZRLPPK-LBPRGKRZSA-N	-1	0	372.446	2.892	50	0		FFAARM
Cc1c2c(cc(=O)n1Cc1ccncc1)[n-]n(-c1ccc(F)cc1)c2=O	ZINC000101557883	209227774	/nfs/dbraw/zinc/22/77/74/209227774.db2.gz	YZUUSNLZRIIMAA-UHFFFAOYSA-N	-1	0	350.353	2.735	50	0		FFAARM
O=C([O-])c1ccccc1-n1nc(-c2ccncc2)nc1C[C@@H]1CCCOC1	ZINC000096135931	209117900	/nfs/dbraw/zinc/11/79/00/209117900.db2.gz	LTTOEGOCYMYPIZ-AWEZNQCLSA-N	-1	0	364.405	2.997	50	0		FFAARM
CCN1CCc2nc(NC(=O)c3c[n-]c4nc(C)ccc4c3=O)sc2C1	ZINC000105646487	250219676	/nfs/dbraw/zinc/21/96/76/250219676.db2.gz	LOZTTYHMTSVENY-UHFFFAOYSA-N	-1	0	369.450	2.731	50	0		FFAARM
CC(C)=C(NC(=O)c1ccccc1)C(=O)N[C@H](Cc1ccccc1)C(=O)[O-]	ZINC000002099841	206901298	/nfs/dbraw/zinc/90/12/98/206901298.db2.gz	OCLPLEFZHZVIIQ-QGZVFWFLSA-N	-1	0	366.417	2.522	50	0	biogenic	FFAARM
CCC(C)(C)[C@H]1CCc2c(sc(NC(=O)/C=C/C(=O)[O-])c2C(N)=O)C1	ZINC000002092956	206901477	/nfs/dbraw/zinc/90/14/77/206901477.db2.gz	RMGAEXNAOYRMGV-JARNTUPDSA-N	-1	0	364.467	2.967	50	0		FFAARM
CCOC(=O)c1c2c(sc1NC(=O)/C=C/C(=O)[O-])CO[C@@H](C(C)C)C2	ZINC000002355660	206910761	/nfs/dbraw/zinc/91/07/61/206910761.db2.gz	OSCOUEYRVLSPSU-MVIFTORASA-N	-1	0	367.423	2.601	50	0		FFAARM
CCOc1ccccc1[N-]S(=O)(=O)c1cc2c3c(c1)CCCN3C(=O)C2	ZINC000004270350	207009314	/nfs/dbraw/zinc/00/93/14/207009314.db2.gz	KXTLOZGAJJXQQE-UHFFFAOYSA-N	-1	0	372.446	2.721	50	0		FFAARM
O=C([O-])[C@H]1CC(=O)N(c2ccc(Br)cc2Br)C1	ZINC000004237862	207007709	/nfs/dbraw/zinc/00/77/09/207007709.db2.gz	ZWBOTACRPPHVCJ-LURJTMIESA-N	-1	0	363.005	2.649	50	0		FFAARM
O=C(NCc1cccnc1)c1ccccc1[N-]S(=O)(=O)c1ccccc1	ZINC000005050481	207075770	/nfs/dbraw/zinc/07/57/70/207075770.db2.gz	LHIYJTMDFFOFHZ-UHFFFAOYSA-N	-1	0	367.430	2.812	50	0		FFAARM
O=C([O-])[C@H]1CCCN1S(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1	ZINC000005065333	207077143	/nfs/dbraw/zinc/07/71/43/207077143.db2.gz	BTQZZDHTYVPHDY-SNVBAGLBSA-N	-1	0	357.737	2.597	50	0		FFAARM
COc1ccc(Cc2nnc(Nc3ccc(OC)c(OC)c3)[n-]c2=O)cc1	ZINC000005154457	207084611	/nfs/dbraw/zinc/08/46/11/207084611.db2.gz	JESIOQKQXBIZPJ-UHFFFAOYSA-N	-1	0	368.393	2.525	50	0		FFAARM
COC(=O)c1ccccc1[N-]S(=O)(=O)C[C@@]12CC[C@@H](CC1=O)C2(C)C	ZINC000006459577	207141130	/nfs/dbraw/zinc/14/11/30/207141130.db2.gz	PICBLCYLIJSIDP-SGTLLEGYSA-N	-1	0	365.451	2.610	50	0		FFAARM
O=C([O-])[C@@H]1CC=CC[C@@H]1C(=O)Nc1sccc1C(=O)N1CCCCC1	ZINC000006741069	207158623	/nfs/dbraw/zinc/15/86/23/207158623.db2.gz	JCPCOLWZLFRBDB-QWHCGFSZSA-N	-1	0	362.451	2.980	50	0		FFAARM
Cc1csc2nc(C)c(S(=O)(=O)[N-]C3CCCCCCC3)c(=O)n12	ZINC000006823619	207170538	/nfs/dbraw/zinc/17/05/38/207170538.db2.gz	YFGUQSVQRMGDCO-UHFFFAOYSA-N	-1	0	369.512	2.764	50	0		FFAARM
CCOC(=O)CCc1c(C)nc2c(-c3ccc(F)cc3)c(C)[n-]n2c1=O	ZINC000009133955	207258315	/nfs/dbraw/zinc/25/83/15/207258315.db2.gz	PONXUMDPQQKVTG-UHFFFAOYSA-N	-1	0	357.385	2.941	50	0		FFAARM
CSc1nnc2n1N=C(c1ccc(Cl)cc1)[C@H](CC(=O)[O-])S2	ZINC000009740607	207285982	/nfs/dbraw/zinc/28/59/82/207285982.db2.gz	ZNDYQTKQJDGAAD-VIFPVBQESA-N	-1	0	354.844	2.855	50	0		FFAARM
CN1C(=O)Cc2cc(S(=O)(=O)[N-]c3cccc4cccnc43)ccc21	ZINC000012552184	207392118	/nfs/dbraw/zinc/39/21/18/207392118.db2.gz	XCHUMBVVJVHLJT-UHFFFAOYSA-N	-1	0	353.403	2.555	50	0		FFAARM
COc1ccc(S(=O)(=O)[N-]c2cnc(-c3ccccc3)nc2)cc1OC	ZINC000012560979	207393523	/nfs/dbraw/zinc/39/35/23/207393523.db2.gz	UIXQSOMMKDWIIS-UHFFFAOYSA-N	-1	0	371.418	2.962	50	0		FFAARM
CCOc1cc(/C=C2\SC(=O)N(C)C2=O)ccc1O[C@@H](C)C(=O)[O-]	ZINC000012629252	207405290	/nfs/dbraw/zinc/40/52/90/207405290.db2.gz	PZYNRPQLKSKNSU-LMRAXHDRSA-N	-1	0	351.380	2.603	50	0		FFAARM
COc1cccc(C(=O)N2CCC(C(=O)[O-])(c3ccccc3)CC2)c1OC	ZINC000013185358	207454989	/nfs/dbraw/zinc/45/49/89/207454989.db2.gz	JBLFEGKGWCSLCZ-UHFFFAOYSA-N	-1	0	369.417	2.962	50	0		FFAARM
CCOc1ccc(O[C@H]2C[C@@H](C(=O)[O-])N(C(=O)OC(C)(C)C)C2)cc1	ZINC000014632496	207524323	/nfs/dbraw/zinc/52/43/23/207524323.db2.gz	RCLJVGZFLTXXID-GJZGRUSLSA-N	-1	0	351.399	2.927	50	0		FFAARM
COc1cc2c(cc1OC)C([O-])=C(S(=O)(=O)c1ccc(Cl)cc1)C2	ZINC000020717401	207751160	/nfs/dbraw/zinc/75/11/60/207751160.db2.gz	KRUOSFBTRHPLTG-MRXNPFEDSA-N	-1	0	366.822	2.939	50	0		FFAARM
COc1ccc2c(ccn2CCC(=O)N[C@@H](C(=O)[O-])c2ccccc2)c1	ZINC000020762356	207754853	/nfs/dbraw/zinc/75/48/53/207754853.db2.gz	CUNBYOKUEPYUCR-LJQANCHMSA-N	-1	0	352.390	2.982	50	0	biogenic	FFAARM
COc1ccc(-n2c(=O)c3[n-][nH]n(-c4ccc(F)c(Cl)c4)c=3c2=O)cc1	ZINC000033274044	208081163	/nfs/dbraw/zinc/08/11/63/208081163.db2.gz	JLCQVCJVEGUNCQ-HUUCEWRRSA-N	-1	0	374.759	2.986	50	0		FFAARM
COc1ccc(NC(=O)CCc2nnc(-c3ccccc3F)[n-]c2=O)cc1	ZINC000034767737	208110347	/nfs/dbraw/zinc/11/03/47/208110347.db2.gz	BZVSOHNIHBYBKY-UHFFFAOYSA-N	-1	0	368.368	2.963	50	0		FFAARM
Cc1cccc(C(=O)[O-])c1NS(=O)(=O)c1ccc(N2CCCC2=O)cc1	ZINC000036833355	208173599	/nfs/dbraw/zinc/17/35/99/208173599.db2.gz	KPZJWRILRCGNKF-UHFFFAOYSA-N	-1	0	374.418	2.621	50	0		FFAARM
CC(C)[C@H](NS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)C(=O)[O-]	ZINC000036293808	208152876	/nfs/dbraw/zinc/15/28/76/208152876.db2.gz	IGSDVRVGWMUAPT-JTQLQIEISA-N	-1	0	359.753	2.746	50	0		FFAARM
O=C([O-])CCCNC(=O)CCn1ccc2c1cccc2Br	ZINC000040313278	208247060	/nfs/dbraw/zinc/24/70/60/208247060.db2.gz	KRWDIVZDYBXOHU-UHFFFAOYSA-N	-1	0	353.216	2.775	50	0	biogenic	FFAARM
COc1cc(/C=C/C(=O)N2CCCC[C@H]2C(=O)[O-])cc(Cl)c1OC	ZINC000299267037	208262600	/nfs/dbraw/zinc/26/26/00/208262600.db2.gz	KAMDWWBTXWJDNI-YBJDMEARSA-N	-1	0	353.802	2.836	50	0		FFAARM
Cc1nn(-c2ccc(F)cc2F)c(C)c1C(=O)N1CCC[C@H](C(=O)[O-])C1	ZINC000299743186	208338183	/nfs/dbraw/zinc/33/81/83/208338183.db2.gz	MLEKVVADPSJUPZ-LBPRGKRZSA-N	-1	0	363.364	2.704	50	0		FFAARM
Cc1oc(CNC(=O)c2ccc3c(c2)NC(=O)[C@@H](C)S3)cc1C(=O)[O-]	ZINC000299747195	208339663	/nfs/dbraw/zinc/33/96/63/208339663.db2.gz	CIRNKABTOYUWDM-SECBINFHSA-N	-1	0	360.391	2.649	50	0		FFAARM
COc1ccc(CNC(=O)C[C@H]2OCCc3ccccc32)cc1C(=O)[O-]	ZINC000299747766	208341671	/nfs/dbraw/zinc/34/16/71/208341671.db2.gz	DZCDIFGSIAIKSL-GOSISDBHSA-N	-1	0	355.390	2.714	50	0		FFAARM
CCOC(=O)Cc1csc([N-]c2nc(CC(=O)OCC)cs2)n1	ZINC000045170293	208327704	/nfs/dbraw/zinc/32/77/04/208327704.db2.gz	YMFPLRZWNDJFTP-UHFFFAOYSA-N	-1	0	355.441	2.554	50	0		FFAARM
O=C([O-])[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)C[C@H]1Sc2ccccc2NC1=O	ZINC000299750604	208358708	/nfs/dbraw/zinc/35/87/08/208358708.db2.gz	OASVCKBLNVIKIT-ZGMNHVEMSA-N	-1	0	374.462	2.734	50	0		FFAARM
Cc1nn(CC(=O)[O-])c2c1[C@@H](c1c[nH]nc1C1CCCCC1)CC(=O)N2	ZINC000067642779	208713603	/nfs/dbraw/zinc/71/36/03/208713603.db2.gz	WCLZZFZQHAYLEA-GFCCVEGCSA-N	-1	0	357.414	2.521	50	0		FFAARM
COCCC[C@@]1(C(=O)[O-])CCCN(C(=O)c2ccc3[nH]c(C)nc3c2)C1	ZINC000091713385	208992324	/nfs/dbraw/zinc/99/23/24/208992324.db2.gz	KZBUUUSYMVODOL-IBGZPJMESA-N	-1	0	359.426	2.605	50	0		FFAARM
CCCn1ncc(C(=O)N2C[C@@H](c3cccc(F)c3)[C@H](C(=O)[O-])C2)c1C	ZINC000091966342	209008083	/nfs/dbraw/zinc/00/80/83/209008083.db2.gz	SDRDTRRIBRINKN-DLBZAZTESA-N	-1	0	359.401	2.681	50	0		FFAARM
Cc1ccc(C(=O)N2CCC[C@H](C(=O)NC3(C(=O)[O-])CCCCC3)C2)cc1	ZINC000095349829	209023076	/nfs/dbraw/zinc/02/30/76/209023076.db2.gz	PDRAVFDDCQTKCZ-KRWDZBQOSA-N	-1	0	372.465	2.751	50	0		FFAARM
COc1ccc2[nH]c3c(c2c1)CN([C@@H](C(=O)[O-])c1c(C)noc1C)CC3	ZINC000095356286	209025885	/nfs/dbraw/zinc/02/58/85/209025885.db2.gz	DOBBIVXAKDJMRT-GOSISDBHSA-N	-1	0	355.394	2.965	50	0		FFAARM
CC(C)=CC[C@@]1(C(=O)[O-])CCCN(C(=O)CN(C)Cc2ccncc2)C1	ZINC000092061634	209015177	/nfs/dbraw/zinc/01/51/77/209015177.db2.gz	PCUXWBUUWBDPCH-FQEVSTJZSA-N	-1	0	359.470	2.563	50	0		FFAARM
Cc1cc(C(=O)N2CCc3[nH]cnc3[C@H]2C(=O)[O-])c(-c2ccccc2)o1	ZINC000095387005	209044259	/nfs/dbraw/zinc/04/42/59/209044259.db2.gz	PQNCINHJDVPKQX-INIZCTEOSA-N	-1	0	351.362	2.802	50	0		FFAARM
CCNc1ncc(C(=O)N2CCC[C@@H](c3ccc(C(=O)[O-])cc3)C2)cn1	ZINC000095372500	209034421	/nfs/dbraw/zinc/03/44/21/209034421.db2.gz	NITBVJGHKPGEQF-OAHLLOKOSA-N	-1	0	354.410	2.626	50	0		FFAARM
Cc1nn(C)c(C)c1[C@@H](C)C(=O)N(Cc1ccccc1)C[C@@H](C)C(=O)[O-]	ZINC000095424404	209048589	/nfs/dbraw/zinc/04/85/89/209048589.db2.gz	MQWKLUHZLZPLDS-ZIAGYGMSSA-N	-1	0	357.454	2.890	50	0		FFAARM
Cc1nn(C)cc1C(=O)NC[C@H](Cc1ccc2ccccc2c1)C(=O)[O-]	ZINC000095425464	209048871	/nfs/dbraw/zinc/04/88/71/209048871.db2.gz	JYZISULPVOFCTE-KRWDZBQOSA-N	-1	0	351.406	2.555	50	0		FFAARM
COc1cccc(-c2cc(C(=O)N[C@H](Cc3ccccc3)C(=O)[O-])[nH]n2)c1	ZINC000095512768	209069714	/nfs/dbraw/zinc/06/97/14/209069714.db2.gz	RPSWFDDBXBZPSI-GOSISDBHSA-N	-1	0	365.389	2.511	50	0		FFAARM
Cc1cccnc1N1CCN(C(=O)c2cc(=O)c3cccc(F)c3[n-]2)CC1	ZINC000077439229	132185222	/nfs/dbraw/zinc/18/52/22/132185222.db2.gz	CTVTVXZSBMWGLI-UHFFFAOYSA-N	-1	0	366.396	2.745	50	0		FFAARM
Cc1[nH]cnc1-c1nccn1-c1ccc(N2CCC[C@@H](C(=O)[O-])C2)cc1	ZINC000077505407	132188286	/nfs/dbraw/zinc/18/82/86/132188286.db2.gz	KTIYBTNTTODQNI-CQSZACIVSA-N	-1	0	351.410	2.872	50	0		FFAARM
CCOc1ccccc1N1CCN([C@H](C(=O)[O-])c2c(C)noc2C)CC1	ZINC000095386618	132210006	/nfs/dbraw/zinc/21/00/06/132210006.db2.gz	SKKXOEMLBYEXSM-SFHVURJKSA-N	-1	0	359.426	2.638	50	0		FFAARM
Cc1ccc(OCc2ccc(C(=O)N(C)C[C@H](C)c3nnn[n-]3)o2)c(C)c1	ZINC000095939709	209086349	/nfs/dbraw/zinc/08/63/49/209086349.db2.gz	NJHUSWGLFDYGTR-AWEZNQCLSA-N	-1	0	369.425	2.864	50	0		FFAARM
O=C([O-])CCC(=O)N1CCN(C2c3ccccc3-c3ccccc32)CC1	ZINC000000156661	506224374	/nfs/dbraw/zinc/22/43/74/506224374.db2.gz	ZXUIBNUAZPYGAQ-UHFFFAOYSA-N	-1	0	350.418	2.765	50	0		FFAARM
O=C(Nc1ccc(S(=O)(=O)[N-]c2ncccn2)cc1)c1cccs1	ZINC000000942080	506240734	/nfs/dbraw/zinc/24/07/34/506240734.db2.gz	JFKBCMLLRYCZIC-UHFFFAOYSA-N	-1	0	360.420	2.591	50	0		FFAARM
CCc1ccccc1N1C(=O)C[C@H](Sc2ncccc2C(=O)[O-])C1=O	ZINC000001129166	506250419	/nfs/dbraw/zinc/25/04/19/506250419.db2.gz	CKYQUZSEGANOPB-AWEZNQCLSA-N	-1	0	356.403	2.766	50	0		FFAARM
Cc1[n-]c(C(Cl)(Cl)Cl)nc2nc(=O)n(-c3ccccc3)c(=O)c1-2	ZINC000001180945	506254308	/nfs/dbraw/zinc/25/43/08/506254308.db2.gz	XYRJPEZSPZNXRL-UHFFFAOYSA-N	-1	0	371.611	2.604	50	0		FFAARM
COc1cccc([N-]S(=O)(=O)c2cc(-c3nnc(C)o3)cs2)c1	ZINC000065098512	506260889	/nfs/dbraw/zinc/26/08/89/506260889.db2.gz	ZECFNOVCCOABQY-UHFFFAOYSA-N	-1	0	351.409	2.916	50	0		FFAARM
CCOc1ccc([N-]S(=O)(=O)c2c(C)nc3sc(C)nn32)cc1	ZINC000065183601	506267338	/nfs/dbraw/zinc/26/73/38/506267338.db2.gz	KPLPOGCOTPDRRM-UHFFFAOYSA-N	-1	0	352.441	2.607	50	0		FFAARM
O=C([O-])[C@@H](COC(=O)OCc1ccccc1)NC(=O)OCc1ccccc1	ZINC000002145475	506272430	/nfs/dbraw/zinc/27/24/30/506272430.db2.gz	KUTZESLKEBHGMZ-MRXNPFEDSA-N	-1	0	373.361	2.719	50	0		FFAARM
CCCCC(=O)N[C@]([N-]c1nccs1)(C(=O)OCC)C(F)(F)F	ZINC000002307333	506275564	/nfs/dbraw/zinc/27/55/64/506275564.db2.gz	XHXMYOURADNFBN-LBPRGKRZSA-N	-1	0	353.366	2.683	50	0		FFAARM
Cc1ccc(C[C@H](CC(=O)NCCc2ccc3c(c2)OCO3)C(=O)[O-])cc1	ZINC000002387745	506278629	/nfs/dbraw/zinc/27/86/29/506278629.db2.gz	WFDVRQOVLBEPIS-QGZVFWFLSA-N	-1	0	369.417	2.716	50	0	biogenic	FFAARM
CC(C)[C@H](NC(=O)/C(=C/c1ccccc1)NC(=O)c1ccccc1)C(=O)[O-]	ZINC000002983312	506305878	/nfs/dbraw/zinc/30/58/78/506305878.db2.gz	UODHKQUGRPVOKE-FDWYHIAWSA-N	-1	0	366.417	2.683	50	0	biogenic	FFAARM
Cc1nnc(NC(=O)C[C@@H]([N-]C(=O)C(F)(F)F)c2ccccc2)s1	ZINC000003088155	506309900	/nfs/dbraw/zinc/30/99/00/506309900.db2.gz	FOEZHKLSBNCHFE-SNVBAGLBSA-N	-1	0	358.345	2.595	50	0		FFAARM
O=C([O-])[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000003239279	506314556	/nfs/dbraw/zinc/31/45/56/506314556.db2.gz	MWFNHAUXOMDUFH-OAHLLOKOSA-N	-1	0	351.811	2.540	50	0		FFAARM
COc1ccc(S(=O)(=O)[N-]c2c3nsnc3ccc2C)cc1OC	ZINC000004001629	506354451	/nfs/dbraw/zinc/35/44/51/506354451.db2.gz	ATTYTFLAXVWTKP-UHFFFAOYSA-N	-1	0	365.436	2.818	50	0		FFAARM
O=C([O-])/C=C/C(=O)N1N=C(c2cccc([N+](=O)[O-])c2)C[C@H]1c1ccccc1	ZINC000005450635	506443832	/nfs/dbraw/zinc/44/38/32/506443832.db2.gz	GZNVPNTXVDNWID-FVNWOWOISA-N	-1	0	365.345	2.913	50	0		FFAARM
CC(=O)c1cc2c(cc1NC(=O)C[C@@H](C(=O)[O-])c1ccccc1)OCO2	ZINC000054500227	506566935	/nfs/dbraw/zinc/56/69/35/506566935.db2.gz	SIICHCQKEXMANP-CQSZACIVSA-N	-1	0	355.346	2.815	50	0		FFAARM
COc1ccc(C)cc1[C@H](C(=O)[O-])N(C)Cc1nc(-c2ccccn2)no1	ZINC000055119524	506682202	/nfs/dbraw/zinc/68/22/02/506682202.db2.gz	DQOPGOYUECCPSE-QGZVFWFLSA-N	-1	0	368.393	2.706	50	0		FFAARM
CCc1nccn1CCn1c2cc(C(=O)[O-])cnc2n(C(CC)CC)c1=O	ZINC000055414027	506747358	/nfs/dbraw/zinc/74/73/58/506747358.db2.gz	WFFJKGLPHGXRDH-UHFFFAOYSA-N	-1	0	371.441	2.716	50	0		FFAARM
O=C([O-])c1nnn(-c2ccc(OC(F)(F)F)cc2)c1-c1ccncc1	ZINC000067323653	506828756	/nfs/dbraw/zinc/82/87/56/506828756.db2.gz	USYHTCNZDKZQPG-UHFFFAOYSA-N	-1	0	350.256	2.926	50	0		FFAARM
O=C([O-])[C@H](CCO)Sc1nnc(-c2c[nH]c3ccccc32)n1C1CC1	ZINC000012751027	506895265	/nfs/dbraw/zinc/89/52/65/506895265.db2.gz	SIQXZBYZFHSGST-AWEZNQCLSA-N	-1	0	358.423	2.689	50	0		FFAARM
COc1cc2c(cc1OC)[C@H](CC(=O)[O-])N(C(=O)c1cccs1)CC2	ZINC000013181771	506930788	/nfs/dbraw/zinc/93/07/88/506930788.db2.gz	SZYSJNXOXLSXPY-ZDUSSCGKSA-N	-1	0	361.419	2.980	50	0		FFAARM
COc1cc(OC)cc(C(=O)N2CCC(C(=O)[O-])(c3ccccc3)CC2)c1	ZINC000013185367	506932204	/nfs/dbraw/zinc/93/22/04/506932204.db2.gz	HKNYDXQYWXDZSY-UHFFFAOYSA-N	-1	0	369.417	2.962	50	0		FFAARM
CC(=O)c1ccc(S(=O)(=O)N[C@@H](CC(=O)[O-])c2ccc(C)cc2)cc1	ZINC000013348171	506939519	/nfs/dbraw/zinc/93/95/19/506939519.db2.gz	DGDLKGFBONLVDQ-KRWDZBQOSA-N	-1	0	361.419	2.692	50	0		FFAARM
O=C([O-])c1cc2n[nH]c(I)c2c(Br)c1	ZINC000014983928	507009857	/nfs/dbraw/zinc/00/98/57/507009857.db2.gz	HKOYFXWLVUSWRR-UHFFFAOYSA-N	-1	0	366.940	2.628	50	0		FFAARM
O=C([O-])[C@@]1(NC(=O)OCC2c3ccccc3-c3ccccc32)CC[C@@H](O)C1	ZINC000015446459	507041986	/nfs/dbraw/zinc/04/19/86/507041986.db2.gz	FPTJRPYTKCYJLR-LRTDBIEQSA-N	-1	0	367.401	2.893	50	0		FFAARM
CC[C@H]1CCc2c(sc(NC(=O)C[C@@H](C)CC(=O)[O-])c2C(N)=O)C1	ZINC000017073062	507113019	/nfs/dbraw/zinc/11/30/19/507113019.db2.gz	MGXNAIHDNDGLSA-ZJUUUORDSA-N	-1	0	352.456	2.801	50	0		FFAARM
COC(=O)c1cc(C)sc1NC(=O)[C@H]1C2CCC(CC2)[C@@H]1C(=O)[O-]	ZINC000017072893	507113418	/nfs/dbraw/zinc/11/34/18/507113418.db2.gz	ZOVUUBNABKYVSE-HFCHRNICSA-N	-1	0	351.424	2.919	50	0		FFAARM
CC[C@@H]1CCc2c(sc(NC(=O)CCC(=O)[O-])c2C(=O)NC2CC2)C1	ZINC000017074924	507115198	/nfs/dbraw/zinc/11/51/98/507115198.db2.gz	ZOEYPJUIASTGSK-SNVBAGLBSA-N	-1	0	364.467	2.959	50	0		FFAARM
Cc1ccc(O)c(S(=O)(=O)[N-]c2ccc(F)c(NC(=O)C3CC3)c2)c1	ZINC000057117232	507173890	/nfs/dbraw/zinc/17/38/90/507173890.db2.gz	JXAVMQIGZDDXPK-UHFFFAOYSA-N	-1	0	364.398	2.989	50	0		FFAARM
COc1ccc(CC(=O)[O-])cc1S(=O)(=O)N(C)c1cccc(C)c1C	ZINC000057119800	507176381	/nfs/dbraw/zinc/17/63/81/507176381.db2.gz	OZWFQXULDSYSAL-UHFFFAOYSA-N	-1	0	363.435	2.764	50	0		FFAARM
O=C([O-])c1cccnc1S[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1=O	ZINC000019881495	507204845	/nfs/dbraw/zinc/20/48/45/507204845.db2.gz	OJTPSWWTNFEMPJ-LBPRGKRZSA-N	-1	0	362.794	2.857	50	0		FFAARM
CCc1ccccc1N1C(=O)C[C@@H](Sc2ncccc2C(=O)[O-])C1=O	ZINC000019878594	507206269	/nfs/dbraw/zinc/20/62/69/507206269.db2.gz	CKYQUZSEGANOPB-CQSZACIVSA-N	-1	0	356.403	2.766	50	0		FFAARM
Cc1nn(Cc2ccccc2C)c(C)c1NC(=O)c1c(C(=O)[O-])cnn1C	ZINC000020602686	507226790	/nfs/dbraw/zinc/22/67/90/507226790.db2.gz	RFEKWVLOBHCSLT-UHFFFAOYSA-N	-1	0	367.409	2.541	50	0		FFAARM
CCc1ccc([C@@H](O)COc2ccc(C[C@H]3SC(=O)[N-]C3=O)cc2)nc1	ZINC000021981315	507275393	/nfs/dbraw/zinc/27/53/93/507275393.db2.gz	RMTFRGFLVHAYCI-DLBZAZTESA-N	-1	0	372.446	2.651	50	0	in-vitro	FFAARM
COc1cccc(-n2c(=O)c3[n-][nH]n(-c4ccc(Cl)cc4)c=3c2=O)c1	ZINC000023125735	507331192	/nfs/dbraw/zinc/33/11/92/507331192.db2.gz	DPSFPTRORFQEDU-LSDHHAIUSA-N	-1	0	356.769	2.846	50	0		FFAARM
COc1ccc(NC(=O)c2c([O-])c3sccc3n(C)c2=O)c(OC)c1	ZINC000049409450	507618639	/nfs/dbraw/zinc/61/86/39/507618639.db2.gz	NWDGBAFMPXFFMX-UHFFFAOYSA-N	-1	0	360.391	2.575	50	0		FFAARM
CC1(C)[C@H](C(=O)Nc2ccc(F)c(C(=O)Nc3cccnc3)c2)[C@@H]1C(=O)[O-]	ZINC000071289103	507700060	/nfs/dbraw/zinc/70/00/60/507700060.db2.gz	VHNLFDDIVPXBAZ-LSDHHAIUSA-N	-1	0	371.368	2.768	50	0		FFAARM
CC1(C)[C@H](C(=O)[O-])[C@H]1C(=O)Nc1cccc(C(=O)Nc2nccs2)c1	ZINC000071288996	507700150	/nfs/dbraw/zinc/70/01/50/507700150.db2.gz	ARNXSRIUXBYBEV-RYUDHWBXSA-N	-1	0	359.407	2.691	50	0		FFAARM
CC(C)NC(=O)c1ccc(NC(=O)[C@@H]2[C@@H](C(=O)[O-])C2(C)C)cc1Cl	ZINC000071286200	507700906	/nfs/dbraw/zinc/70/09/06/507700906.db2.gz	JHUGOOTYSSAQHB-STQMWFEESA-N	-1	0	352.818	2.774	50	0		FFAARM
NC(=O)c1c(Br)cc(Br)c([O-])c1Br	ZINC000071404343	507702666	/nfs/dbraw/zinc/70/26/66/507702666.db2.gz	CKGPDXVULRLYLP-UHFFFAOYSA-N	-1	0	373.826	2.779	50	0		FFAARM
O=C(Nc1cccc([N-]S(=O)(=O)c2ccc(Cl)nc2)c1)C1CC1	ZINC000028251172	507716312	/nfs/dbraw/zinc/71/63/12/507716312.db2.gz	UJLNEZIGRMUFPF-UHFFFAOYSA-N	-1	0	351.815	2.884	50	0		FFAARM
O=c1[n-]c(CCNc2nc(C3CC3)nc3sc4c(c32)CCCC4)n[nH]1	ZINC000072307653	507773963	/nfs/dbraw/zinc/77/39/63/507773963.db2.gz	QFHNIIANNXXMFD-UHFFFAOYSA-N	-1	0	356.455	2.514	50	0		FFAARM
Cc1cccc(C)c1NC(=O)N1CCCn2nc(CCC(=O)[O-])cc2C1	ZINC000072438200	507792077	/nfs/dbraw/zinc/79/20/77/507792077.db2.gz	IGGSJOAELNMZGZ-UHFFFAOYSA-N	-1	0	356.426	2.955	50	0		FFAARM
O=C([O-])C1(n2ccc(-c3ccco3)n2)CCN(C(=O)NC2CCCC2)CC1	ZINC000072479759	507797549	/nfs/dbraw/zinc/79/75/49/507797549.db2.gz	DWRIZUWYZCLHAC-UHFFFAOYSA-N	-1	0	372.425	2.671	50	0		FFAARM
CCOC(=O)c1ccc([N-]S(=O)(=O)c2ccc(F)c(Cl)c2)cn1	ZINC000089984872	507896432	/nfs/dbraw/zinc/89/64/32/507896432.db2.gz	FGIDECDDXKBFMF-UHFFFAOYSA-N	-1	0	358.778	2.852	50	0		FFAARM
Cc1cc(C(=O)N(C)[C@@H](c2ccccc2)C(C)C)[nH]c2nc(=O)[n-]c(=O)c1-2	ZINC000073615296	507937590	/nfs/dbraw/zinc/93/75/90/507937590.db2.gz	LLHXPYTUVOMBLC-MRXNPFEDSA-N	-1	0	366.421	2.801	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)c2ccccc2OC(F)F)C[C@H]1c1cccnc1	ZINC000091563046	507992704	/nfs/dbraw/zinc/99/27/04/507992704.db2.gz	WXSPQKJZUKCAGR-UONOGXRCSA-N	-1	0	362.332	2.623	50	0		FFAARM
Cc1cc(C(=O)N2C[C@@H](c3ccc4c(c3)OCO4)[C@H](C(=O)[O-])C2)c(C)o1	ZINC000091645394	507999553	/nfs/dbraw/zinc/99/95/53/507999553.db2.gz	MNFVKHQRSZCLIY-LSDHHAIUSA-N	-1	0	357.362	2.566	50	0		FFAARM
COCCC[C@@]1(C(=O)[O-])CCCN(C(=O)c2ccccc2-c2ncc[nH]2)C1	ZINC000091707859	508004497	/nfs/dbraw/zinc/00/44/97/508004497.db2.gz	CETGOHVAZYOWPT-FQEVSTJZSA-N	-1	0	371.437	2.810	50	0		FFAARM
Cc1ccc(-n2[n-]c(C(=O)Nc3cccnc3OCC(F)F)cc2=O)cc1	ZINC000129318928	508712340	/nfs/dbraw/zinc/71/23/40/508712340.db2.gz	CLOMNIJUAKCQMN-UHFFFAOYSA-N	-1	0	374.347	2.765	50	0		FFAARM
O=C([O-])[C@@H]1CCCCN1C(=O)C1CCN(c2nc3ccccc3s2)CC1	ZINC000159908223	508909803	/nfs/dbraw/zinc/90/98/03/508909803.db2.gz	PQQJAWOSLUWQBO-HNNXBMFYSA-N	-1	0	373.478	2.978	50	0		FFAARM
CCc1cc(=O)c2cc([N-]S(=O)(=O)c3cn(C(C)C)cn3)ccc2[nH]1	ZINC000182497370	509271678	/nfs/dbraw/zinc/27/16/78/509271678.db2.gz	POCVFLDJKDJFDS-UHFFFAOYSA-N	-1	0	360.439	2.669	50	0		FFAARM
COC(=O)c1ccc(C)c([N-]S(=O)(=O)c2cc(F)cc(F)c2)c1O	ZINC000170597597	509676179	/nfs/dbraw/zinc/67/61/79/509676179.db2.gz	VHPHFARHQUPNGK-UHFFFAOYSA-N	-1	0	357.334	2.566	50	0		FFAARM
N#CCOc1ccc(NC(=O)CC2(C(=O)[O-])Cc3ccccc3C2)cc1	ZINC000170619538	509683584	/nfs/dbraw/zinc/68/35/84/509683584.db2.gz	BMFROHPBSMBPIK-UHFFFAOYSA-N	-1	0	350.374	2.787	50	0		FFAARM
Cc1nc(C2CCCC2)sc1C(=O)[N-]S(=O)(=O)CC1CCOCC1	ZINC000170646110	509693892	/nfs/dbraw/zinc/69/38/92/509693892.db2.gz	KXBPGVFYIZWYSV-UHFFFAOYSA-N	-1	0	372.512	2.595	50	0		FFAARM
Cc1ccc(N2CC[C@H](C(=O)N3CCC[C@@H](CCC(=O)[O-])C3)C2=O)cc1C	ZINC000237639120	509697918	/nfs/dbraw/zinc/69/79/18/509697918.db2.gz	XUDIVKFQVCOTQN-FUHWJXTLSA-N	-1	0	372.465	2.760	50	0		FFAARM
Cc1noc(C)c1COc1cccc(C(=O)N2CC[C@](C)(C(=O)[O-])C2)c1	ZINC000237641451	509699724	/nfs/dbraw/zinc/69/97/24/509699724.db2.gz	RBOLUZGKZNVECB-IBGZPJMESA-N	-1	0	358.394	2.807	50	0		FFAARM
Cc1cc(C(=O)N(CC(=O)[O-])C2CCOCC2)c(C)n1-c1cccc(F)c1	ZINC000237668107	509707044	/nfs/dbraw/zinc/70/70/44/509707044.db2.gz	XWZSITAUJAQYLS-UHFFFAOYSA-N	-1	0	374.412	2.939	50	0		FFAARM
O=C([O-])C[C@@H]1CN(C(=O)c2[nH]c3ccc(Cl)cc3c2Cl)CCO1	ZINC000238198026	509831425	/nfs/dbraw/zinc/83/14/25/509831425.db2.gz	FHSPOZQWTWFDCA-SECBINFHSA-N	-1	0	357.193	2.790	50	0		FFAARM
Cc1nc2c(cnn2C(C)C)cc1C(=O)NC[C@H](C(=O)[O-])c1ccccc1	ZINC000262772705	510405749	/nfs/dbraw/zinc/40/57/49/510405749.db2.gz	MNCMMGXQDSLJHZ-KRWDZBQOSA-N	-1	0	366.421	2.919	50	0		FFAARM
Cc1nc2c(cnn2C(C)C)cc1C(=O)NC[C@@H](C(=O)[O-])c1ccccc1	ZINC000262772710	510405791	/nfs/dbraw/zinc/40/57/91/510405791.db2.gz	MNCMMGXQDSLJHZ-QGZVFWFLSA-N	-1	0	366.421	2.919	50	0		FFAARM
CC(C)[C@@H](NC(=O)c1nn(-c2cccc(F)c2)c2c1CCCC2)C(=O)[O-]	ZINC000263209484	510612104	/nfs/dbraw/zinc/61/21/04/510612104.db2.gz	NIDVQTNNCMCQHF-MRXNPFEDSA-N	-1	0	359.401	2.729	50	0		FFAARM
O=C([O-])c1cnc(C(=O)N(CCc2ccc(F)cc2)C2CCCC2)cn1	ZINC000263578766	510757202	/nfs/dbraw/zinc/75/72/02/510757202.db2.gz	SZQIVPXWDKATAI-UHFFFAOYSA-N	-1	0	357.385	2.941	50	0		FFAARM
COc1cc(C(=O)NC2(C(=O)[O-])CCCC2)cc(OC)c1Br	ZINC000299740689	511668111	/nfs/dbraw/zinc/66/81/11/511668111.db2.gz	BDDSBTJVKYDXEZ-UHFFFAOYSA-N	-1	0	372.215	2.594	50	0		FFAARM
Cc1cnn(CC(=O)N[C@@](C)(C(=O)[O-])c2ccc(Cl)c(Cl)c2)c1	ZINC000455906350	514825052	/nfs/dbraw/zinc/82/50/52/514825052.db2.gz	RXFDFSYPTXRNRJ-OAHLLOKOSA-N	-1	0	356.209	2.615	50	0		FFAARM
CS(=O)(=O)C1=N[N-]c2c(-c3ccccc3)cnn2[C@@H]1c1ccccc1	ZINC000618256198	520966900	/nfs/dbraw/zinc/96/69/00/520966900.db2.gz	FWCGLUWWODTFQQ-MRXNPFEDSA-N	-1	0	352.419	2.923	50	0		FFAARM
O=C([N-]S(=O)(=O)C=Cc1ccccc1)c1cc2c([nH]c1=O)CCCCC2	ZINC000606442767	521068904	/nfs/dbraw/zinc/06/89/04/521068904.db2.gz	KPGAQEJDPHMGAP-QXMHVHEDSA-N	-1	0	372.446	2.787	50	0		FFAARM
COc1ccccc1/C=C(\C(=O)N1CCO[C@H](C(=O)[O-])C1)c1ccccc1	ZINC000606441597	521069257	/nfs/dbraw/zinc/06/92/57/521069257.db2.gz	PTXWLLSDBYLQOC-LYDJUCFBSA-N	-1	0	367.401	2.548	50	0		FFAARM
CCOc1c(Cl)cc(/C=C\C(=O)N2CCC[C@@H]2C(=O)[O-])cc1OC	ZINC000606441252	521069271	/nfs/dbraw/zinc/06/92/71/521069271.db2.gz	KIKLSTSLORVKDF-FMFIFOJESA-N	-1	0	353.802	2.836	50	0		FFAARM
C[C@@H]1C[C@H](C(=O)N[C@@H](c2ccccc2)c2ccc(F)cc2)O[C@H]1C(=O)[O-]	ZINC000630110622	522625273	/nfs/dbraw/zinc/62/52/73/522625273.db2.gz	XBFKOUVRRCAGHD-GQAVTEOGSA-N	-1	0	357.381	2.910	50	0		FFAARM
CCn1cc(C(=O)N[C@@H](C(=O)[O-])c2ccccc2Br)c(C)n1	ZINC000630207267	522699600	/nfs/dbraw/zinc/69/96/00/522699600.db2.gz	LFEQEJOFIHRQJS-CYBMUJFWSA-N	-1	0	366.215	2.530	50	0		FFAARM
Cc1nn(CCC(=O)[O-])c(C)c1NC(=O)[C@@H]1C[C@]12CCc1ccccc12	ZINC000630330839	522795111	/nfs/dbraw/zinc/79/51/11/522795111.db2.gz	GLUQIABFRNQRGA-JXFKEZNVSA-N	-1	0	353.422	2.817	50	0		FFAARM
COc1ccc([N-]S(=O)(=O)c2ccc(-c3cc[nH]n3)s2)c(OC)c1	ZINC000085664823	524688550	/nfs/dbraw/zinc/68/85/50/524688550.db2.gz	HAJWCYNCADAGEU-UHFFFAOYSA-N	-1	0	365.436	2.956	50	0		FFAARM
Cc1ccccc1[C@@H](CC(=O)[O-])NC(=O)[C@H]1CC(=O)Nc2ccccc21	ZINC000237599447	525365882	/nfs/dbraw/zinc/36/58/82/525365882.db2.gz	UACSJFQMNOEEFZ-DOTOQJQBSA-N	-1	0	352.390	2.753	50	0		FFAARM
CSCC[C@H](NC(=O)Cc1csc(-c2ccc(F)cc2)n1)C(=O)[O-]	ZINC000020725631	525588775	/nfs/dbraw/zinc/58/87/75/525588775.db2.gz	JDQCAGWFYZSQAT-ZDUSSCGKSA-N	-1	0	368.455	2.814	50	0		FFAARM
Cc1nn(CCC(=O)N2C[C@@H](c3ccccc3)[C@H](C(=O)[O-])C2)c(C)c1C	ZINC000091643601	526276385	/nfs/dbraw/zinc/27/63/85/526276385.db2.gz	HXXGXMRBEHMRLT-ZWKOTPCHSA-N	-1	0	355.438	2.525	50	0		FFAARM
O=C([O-])[C@@H]1CCN(C(=O)CCCc2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000269186936	526278450	/nfs/dbraw/zinc/27/84/50/526278450.db2.gz	NBIDNXLAWZDION-GFCCVEGCSA-N	-1	0	363.801	2.646	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)C[C@@H]1CCCO1)c1ccc(OC(F)(F)F)cc1	ZINC000299382509	527624215	/nfs/dbraw/zinc/62/42/15/527624215.db2.gz	WVOJKUUBBCVWLX-QWHCGFSZSA-N	-1	0	361.316	2.786	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)c1cc2c(cc1F)NC(=O)CC2)c1ccccc1	ZINC000178277163	527632972	/nfs/dbraw/zinc/63/29/72/527632972.db2.gz	DEENHNJLLYEVMR-INIZCTEOSA-N	-1	0	356.353	2.656	50	0		FFAARM
Cc1cc(C(=O)N2[C@H](C(=O)[O-])C[C@@H]3CCCC[C@@H]32)ccc1N1CCOCC1	ZINC000647730868	568065782	/nfs/dbraw/zinc/06/57/82/568065782.db2.gz	ZMNZYPNDXHRJEM-SNRMKQJTSA-N	-1	0	372.465	2.690	50	0		FFAARM
Cc1cc(C(=O)CSc2nc(=O)cc([O-])n2C2CCCC2)c(C)n1C	ZINC000102796655	570839133	/nfs/dbraw/zinc/83/91/33/570839133.db2.gz	IGDBSBQIKNSBJB-UHFFFAOYSA-N	-1	0	361.467	2.994	50	0		FFAARM
Cc1noc(C)c1S(=O)(=O)[N-]C(=O)c1cc(C)c(OC(F)F)c(C)c1	ZINC000107874694	570898926	/nfs/dbraw/zinc/89/89/26/570898926.db2.gz	ZKZSBFGKGHGCDJ-UHFFFAOYSA-N	-1	0	374.365	2.628	50	0		FFAARM
O=C([O-])c1cc2c(c(S(=O)(=O)Nc3ccc(F)cc3F)c1)CCC2	ZINC000048332668	570947074	/nfs/dbraw/zinc/94/70/74/570947074.db2.gz	CVXLNKJROVGKSS-UHFFFAOYSA-N	-1	0	353.346	2.953	50	0		FFAARM
CCc1n[nH]c(=S)n1CCNC(=O)[C@H]1CCCC[C@@H]1C(F)(F)F	ZINC000073997825	571139130	/nfs/dbraw/zinc/13/91/30/571139130.db2.gz	JBKQPBQXCPWDAS-UWVGGRQHSA-N	-1	0	350.410	2.988	50	0		FFAARM
CCC(CC)(NC(=O)[C@H]1CCCN(C(=O)c2cc(C)cc(C)c2)C1)C(=O)[O-]	ZINC000585083517	600928302	/nfs/dbraw/zinc/92/83/02/600928302.db2.gz	JJDRCIDVLVPPAU-INIZCTEOSA-N	-1	0	374.481	2.915	50	0		FFAARM
CC(C)n1ccc(C(=O)N[C@@H](C(=O)[O-])c2ccccc2Br)n1	ZINC000659189654	731948993	/nfs/dbraw/zinc/94/89/93/731948993.db2.gz	IUSVCYYERBAGMR-CYBMUJFWSA-N	-1	0	366.215	2.782	50	0		FFAARM
O=C(N[C@H]1CC[C@H](n2cnnc2)CC1)c1cc(=O)c2cccc(F)c2[n-]1	ZINC000257372070	971343121	/nfs/dbraw/zinc/34/31/21/971343121.db2.gz	DYXUWMYAJYRZIY-HAQNSBGRSA-N	-1	0	355.373	2.585	50	0		FFAARM
O=C([O-])CC[C@@H]1CCCCN1C(=O)[C@H]1C[C@H]1c1ccc2c(c1)OCCO2	ZINC000262205376	969087439	/nfs/dbraw/zinc/08/74/39/969087439.db2.gz	VXMHLZPVHRKDTC-JYJNAYRXSA-N	-1	0	359.422	2.807	50	0		FFAARM
CC[C@@H](NS(=O)(=O)c1ccsc1C(=O)[O-])c1nc(C)c(C)s1	ZINC000822668922	998918693	/nfs/dbraw/zinc/91/86/93/998918693.db2.gz	YGTPZQIMAWJKOI-SECBINFHSA-N	-1	0	360.482	2.949	50	0		FFAARM
CO[C@](C)(C(=O)[O-])C(=O)NC[C@@H]1CC2c3ccccc3C1c1ccccc12	ZINC000656848923	1025458642	/nfs/dbraw/zinc/45/86/42/1025458642.db2.gz	RPOHUWCQPYQPOV-JOHYLJCLSA-N	-1	0	365.429	2.890	50	0		FFAARM
CCOc1ccccc1N1CCN([C@@H](C(=O)[O-])c2cccc(CO)c2)CC1	ZINC000095355097	1028543713	/nfs/dbraw/zinc/54/37/13/1028543713.db2.gz	WTSOBXJUULBRCU-HXUWFJFHSA-N	-1	0	370.449	2.526	50	0		FFAARM
Cc1nc([C@H](C)N(C)S(=O)(=O)c2ccccc2C(=O)[O-])c(C)s1	ZINC001506397109	1059489438	/nfs/dbraw/zinc/48/94/38/1059489438.db2.gz	YWUUUAVPPXLYLT-VIFPVBQESA-N	-1	0	354.453	2.840	50	0		FFAARM
Cc1nc(C)c(CC(=O)N2C[C@@H](c3ccccc3)O[C@@H](C(C)C)C2)c(=O)[nH]1	ZINC001529187136	1062209956	/nfs/dbraw/zinc/20/99/56/1062209956.db2.gz	OPGARMWYZBOQSN-MOPGFXCFSA-N	-1	0	369.465	2.966	50	0		FFAARM
O=C([O-])c1ccc(NC(=O)[C@H]2CC(=O)N=C(Nc3ccccc3)S2)cc1	ZINC000000710542	219316174	/nfs/dbraw/zinc/31/61/74/219316174.db2.gz	OEERBGJJZFJVNB-CQSZACIVSA-N	-1	0	369.402	2.824	50	0		FFAARM
CCOc1ccc(Cc2c([O-])n(Cc3ccccc3)c(=O)[nH]c2=O)cc1	ZINC000001083567	219366901	/nfs/dbraw/zinc/36/69/01/219366901.db2.gz	AKJKGCHTRNXGLK-KRWDZBQOSA-N	-1	0	352.390	2.523	50	0		FFAARM
CCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)[O-]	ZINC000004760617	209501519	/nfs/dbraw/zinc/50/15/19/209501519.db2.gz	FURGPXPACJJGQX-HOTGVXAUSA-N	-1	0	364.442	2.697	50	0		FFAARM
O=C([O-])[C@@H]1CCCC[C@@H]1C(=O)N1CCN(c2ccc(Cl)cc2)CC1	ZINC000003684649	209497732	/nfs/dbraw/zinc/49/77/32/209497732.db2.gz	PRUPQCIQHAZBHA-JKSUJKDBSA-N	-1	0	350.846	2.880	50	0		FFAARM
CC(C)COc1ccc(C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)[O-])cc1	ZINC000002153586	209393272	/nfs/dbraw/zinc/39/32/72/209393272.db2.gz	JKNPRANEKMMEMO-GOSISDBHSA-N	-1	0	357.406	2.853	50	0	biogenic	FFAARM
O=C([O-])c1ccc(NC2=C(Cl)C(=O)N(Cc3ccccc3)C2=O)cc1	ZINC000001779590	209391673	/nfs/dbraw/zinc/39/16/73/209391673.db2.gz	MHYCQBJZJBGLKV-UHFFFAOYSA-N	-1	0	356.765	2.816	50	0		FFAARM
C[C@H]1Cc2cccc3c2n1c(=O)c(C(=O)NCc1ccccc1F)c3[O-]	ZINC000170624677	209376167	/nfs/dbraw/zinc/37/61/67/209376167.db2.gz	LWDUTMHYBNBYRD-NSHDSACASA-N	-1	0	352.365	2.893	50	0		FFAARM
COc1ccc(CNc2c3ccccc3[nH]c(=O)c2C(=O)[O-])cc1OC	ZINC000170624646	209375336	/nfs/dbraw/zinc/37/53/36/209375336.db2.gz	XNYSRLPEQNMCBC-UHFFFAOYSA-N	-1	0	354.362	2.856	50	0		FFAARM
O=C([O-])Cn1ccc(NC(=O)[C@@H]2C[C@@H]2c2ccccc2C(F)(F)F)n1	ZINC000122743784	209361094	/nfs/dbraw/zinc/36/10/94/209361094.db2.gz	DBUPVBCRYQFTNT-GHMZBOCLSA-N	-1	0	353.300	2.729	50	0		FFAARM
O=C([O-])C[C@H]1CN(C(=O)C2(c3cccc(C(F)(F)F)c3)CCC2)CCO1	ZINC000238050837	209358771	/nfs/dbraw/zinc/35/87/71/209358771.db2.gz	BUMKERHYGCCKQT-AWEZNQCLSA-N	-1	0	371.355	2.829	50	0		FFAARM
Cc1nn(C)c(Cl)c1/C=C/C(=O)N1[C@H](C(=O)[O-])C[C@@H]2CCCC[C@@H]21	ZINC000237725837	209353241	/nfs/dbraw/zinc/35/32/41/209353241.db2.gz	AYEUTBUGBGOVDZ-KCJPBNATSA-N	-1	0	351.834	2.639	50	0		FFAARM
Cc1[nH]c2ccc(F)cc2c1CC(=O)N(CCC(=O)[O-])C[C@@H]1CCCO1	ZINC000237699736	209351629	/nfs/dbraw/zinc/35/16/29/209351629.db2.gz	ZHVJLBHNHNUPLA-AWEZNQCLSA-N	-1	0	362.401	2.640	50	0		FFAARM
Cc1nc(C(F)(F)F)ccc1C(=O)N(CCC(=O)[O-])C[C@H]1CCCO1	ZINC000237563968	209350089	/nfs/dbraw/zinc/35/00/89/209350089.db2.gz	KOKLVSYDACKESU-LLVKDONJSA-N	-1	0	360.332	2.505	50	0		FFAARM
COc1ccccc1-c1nn(C)cc1C(=O)N1CCC[C@H](CCC(=O)[O-])C1	ZINC000237327309	209345323	/nfs/dbraw/zinc/34/53/23/209345323.db2.gz	SEWIWGHRLKVLEW-CQSZACIVSA-N	-1	0	371.437	2.813	50	0		FFAARM
COc1cc(S(=O)(=O)Nc2cccc(Cl)c2)cc(C(=O)[O-])c1OC	ZINC000045945856	209327209	/nfs/dbraw/zinc/32/72/09/209327209.db2.gz	JBHGNXXEHLAZFQ-UHFFFAOYSA-N	-1	0	371.798	2.856	50	0		FFAARM
CC[C@@H](Cc1cccc(Br)c1)C(=O)N1CC[C@H](C(=O)[O-])C1	ZINC000237019498	209313825	/nfs/dbraw/zinc/31/38/25/209313825.db2.gz	KXXCGFYKZOAGDK-STQMWFEESA-N	-1	0	354.244	2.951	50	0		FFAARM
COc1ccc(NC(=O)c2ccc3c(c2)[n-]c(=S)n(C)c3=O)cc1F	ZINC000103549449	209255183	/nfs/dbraw/zinc/25/51/83/209255183.db2.gz	MHHSMBVMWVOJGE-UHFFFAOYSA-N	-1	0	359.382	2.622	50	0		FFAARM
CCOc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccc(F)cc4)c=3c2=O)cc1	ZINC000101417807	209224787	/nfs/dbraw/zinc/22/47/87/209224787.db2.gz	CBWKXJJKOMGWPP-IRXDYDNUSA-N	-1	0	368.368	2.718	50	0		FFAARM
CCc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccc(F)cc4)c=3c2=O)cc1	ZINC000101168025	209222353	/nfs/dbraw/zinc/22/23/53/209222353.db2.gz	YNWWZRCPBFWBLT-SJORKVTESA-N	-1	0	352.369	2.882	50	0		FFAARM
COc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccc(Cl)cc4)c=3c2=O)cc1	ZINC000101167303	209221906	/nfs/dbraw/zinc/22/19/06/209221906.db2.gz	IQHMSWNFNCCDSA-HOTGVXAUSA-N	-1	0	370.796	2.842	50	0		FFAARM
O=c1c2[n-][nH]n(Cc3cccc(F)c3)c=2c(=O)n1-c1ccc(Cl)cc1	ZINC000101167777	209221932	/nfs/dbraw/zinc/22/19/32/209221932.db2.gz	BMFSPEGDPKKYKV-LSDHHAIUSA-N	-1	0	358.760	2.973	50	0		FFAARM
Cc1[n-]n(-c2nc(-c3ccccc3)cc(=O)[nH]2)c(=O)c1Cc1ccccc1	ZINC000100925550	209218591	/nfs/dbraw/zinc/21/85/91/209218591.db2.gz	DVVFIJRUJUCTQP-UHFFFAOYSA-N	-1	0	358.401	2.815	50	0		FFAARM
O=C(NC[C@H]1CCOc2ccccc2C1)c1cc(=O)n(-c2ccccc2)[n-]1	ZINC000097636581	209190423	/nfs/dbraw/zinc/19/04/23/209190423.db2.gz	ABBDZXJQGOFVQN-HNNXBMFYSA-N	-1	0	363.417	2.537	50	0		FFAARM
O=C(CCn1[n-]c(=O)ccc1=O)Nc1cccc(C=Cc2ccccn2)c1	ZINC000096817253	209157162	/nfs/dbraw/zinc/15/71/62/209157162.db2.gz	QIIYUKHAGXGRRK-FPLPWBNLSA-N	-1	0	362.389	2.543	50	0		FFAARM
COc1cc2nc(S[C@H](C(=O)[O-])c3ccccc3)[nH]c(=O)c2cc1OC	ZINC000096309046	209150293	/nfs/dbraw/zinc/15/02/93/209150293.db2.gz	RYGPDXHAAHBAJE-HNNXBMFYSA-N	-1	0	372.402	2.858	50	0		FFAARM
Cc1c(NC(=O)[C@H](C)Cn2cc(Br)cn2)cccc1C(=O)[O-]	ZINC000002795299	206935287	/nfs/dbraw/zinc/93/52/87/206935287.db2.gz	CNXPYBNKZYOSCB-SECBINFHSA-N	-1	0	366.215	2.927	50	0		FFAARM
CSCC[C@H](NC(=O)c1ccccc1NC(=O)c1ccccc1)C(=O)[O-]	ZINC000004043698	206999330	/nfs/dbraw/zinc/99/93/30/206999330.db2.gz	XQBVUFHOZSSWAC-INIZCTEOSA-N	-1	0	372.446	2.875	50	0	biogenic	FFAARM
O=C([O-])CCCC(=O)Nc1ccccc1-c1nc2ccccc2[nH]c1=O	ZINC000004386623	207016383	/nfs/dbraw/zinc/01/63/83/207016383.db2.gz	KCQBUMXOQWVHPV-UHFFFAOYSA-N	-1	0	351.362	2.784	50	0		FFAARM
CC[C@@H](Sc1nnc(C)c(=O)[n-]1)C(=O)Nc1nc2c(s1)CCCC2	ZINC000004386123	207017570	/nfs/dbraw/zinc/01/75/70/207017570.db2.gz	ARSBPNUDPIWNTN-SNVBAGLBSA-N	-1	0	365.484	2.730	50	0		FFAARM
CCN1C(=O)N/C(=C/c2ccc(OCc3ccc(C(=O)[O-])cc3)cc2)C1=O	ZINC000004521031	207025346	/nfs/dbraw/zinc/02/53/46/207025346.db2.gz	YELBVIBPDVQALK-GZTJUZNOSA-N	-1	0	366.373	2.876	50	0		FFAARM
Cc1ccc(CN2CCN(C(=O)[C@H]3C4CCC(CC4)[C@@H]3C(=O)[O-])CC2)cc1	ZINC000006741075	207158798	/nfs/dbraw/zinc/15/87/98/207158798.db2.gz	KVZDBJRDXYZGOE-GUMHCPJTSA-N	-1	0	370.493	2.776	50	0		FFAARM
CC1=C(C)C[C@H](C(=O)N2CCN(Cc3cccc(F)c3)CC2)[C@@H](C(=O)[O-])C1	ZINC000006741885	207160058	/nfs/dbraw/zinc/16/00/58/207160058.db2.gz	RHAWVMBDVZUSKT-OALUTQOASA-N	-1	0	374.456	2.917	50	0		FFAARM
COc1ccccc1[N-]S(=O)(=O)c1ccc2c(c1)NC(=O)[C@H](C)S2	ZINC000006779348	207164106	/nfs/dbraw/zinc/16/41/06/207164106.db2.gz	ZNSKNAQPINXBGP-JTQLQIEISA-N	-1	0	364.448	2.929	50	0		FFAARM
CS(=O)(=O)c1ccc([N-]S(=O)(=O)c2ccc(Cl)s2)cc1	ZINC000007050994	207185661	/nfs/dbraw/zinc/18/56/61/207185661.db2.gz	DUVIUGPWWIWWBW-UHFFFAOYSA-N	-1	0	351.858	2.606	50	0		FFAARM
COc1ccc(NC(C)=O)cc1[N-]S(=O)(=O)c1cc(F)ccc1F	ZINC000008107709	207219445	/nfs/dbraw/zinc/21/94/45/207219445.db2.gz	DWZCOJHGEJBCGR-UHFFFAOYSA-N	-1	0	356.350	2.733	50	0		FFAARM
COc1ccc(NC(=O)Cn2c(=O)c3ccccc3[n-]c2=S)c(OC)c1	ZINC000008747439	207246881	/nfs/dbraw/zinc/24/68/81/207246881.db2.gz	MFSHDPXPAFFDLK-UHFFFAOYSA-N	-1	0	371.418	2.715	50	0		FFAARM
CCCSc1nc(=NC(=O)CN2CCC[C@@H](C(F)(F)F)C2)s[n-]1	ZINC000008718479	207243214	/nfs/dbraw/zinc/24/32/14/207243214.db2.gz	RAXAICUHECXTEO-SECBINFHSA-N	-1	0	368.450	2.675	50	0		FFAARM
Cc1ccc(S(=O)(=O)Nc2cc3c(cc2C(=O)[O-])OCCCO3)cc1	ZINC000008710352	207243826	/nfs/dbraw/zinc/24/38/26/207243826.db2.gz	BOFWIZKLTFOHKS-UHFFFAOYSA-N	-1	0	363.391	2.655	50	0		FFAARM
Cc1[nH]c(C)c(S(=O)(=O)[N-]c2ccc(C)cc2)c1C(=O)N1CCCC1	ZINC000009684306	207281314	/nfs/dbraw/zinc/28/13/14/207281314.db2.gz	BAVJQQXDRHOGAL-UHFFFAOYSA-N	-1	0	361.467	2.977	50	0		FFAARM
CSCC[C@H](NC(=O)Cc1csc(-c2ccccc2F)n1)C(=O)[O-]	ZINC000012389619	207369388	/nfs/dbraw/zinc/36/93/88/207369388.db2.gz	DBKKGRFOPMGGLO-ZDUSSCGKSA-N	-1	0	368.455	2.814	50	0		FFAARM
CCCCC[C@H](O)/C=C/[C@H]1O[C@H](O)C[C@H](O)[C@@H]1C/C=C\CCCC(=O)[O-]	ZINC000012496092	207382586	/nfs/dbraw/zinc/38/25/86/207382586.db2.gz	XNRNNGPBEPRNAR-VTCRGFIFSA-N	-1	0	370.486	2.769	50	0	endogenous,in-man	FFAARM
O=c1ccc(-c2ccc(S(=O)(=O)[N-]c3ccc(F)cc3F)s2)n[nH]1	ZINC000020574711	207745190	/nfs/dbraw/zinc/74/51/90/207745190.db2.gz	CUHFPECBUVKZHX-UHFFFAOYSA-N	-1	0	369.374	2.577	50	0		FFAARM
Cc1ccc(Cn2cc(Cl)c(NC(=O)c3c(C(=O)[O-])cnn3C)n2)cc1	ZINC000020614402	207748883	/nfs/dbraw/zinc/74/88/83/207748883.db2.gz	HXULXJPRPICHLZ-UHFFFAOYSA-N	-1	0	373.800	2.577	50	0		FFAARM
CCNC(=O)C1(c2ccc([N-]S(=O)(=O)c3ccccc3F)cc2)CC1	ZINC000033274652	208081542	/nfs/dbraw/zinc/08/15/42/208081542.db2.gz	JRUIOEJQLLGNJV-UHFFFAOYSA-N	-1	0	362.426	2.794	50	0		FFAARM
CC[C@@H](C)NC(=O)CCc1nnc(-c2cccc(OC(C)C)c2)[n-]c1=O	ZINC000034764337	208108811	/nfs/dbraw/zinc/10/88/11/208108811.db2.gz	VWQFRDWUGJXHMR-CYBMUJFWSA-N	-1	0	358.442	2.879	50	0		FFAARM
COc1ccc2c(ccn2CCC(=O)N[C@H](Cc2ccccc2)C(=O)[O-])c1	ZINC000036585335	208166225	/nfs/dbraw/zinc/16/62/25/208166225.db2.gz	VYJZFCMHYYXRAU-GOSISDBHSA-N	-1	0	366.417	2.852	50	0		FFAARM
Cc1ccc(S(=O)(=O)Nc2ccccc2Cn2cccn2)cc1C(=O)[O-]	ZINC000040088147	208226083	/nfs/dbraw/zinc/22/60/83/208226083.db2.gz	KLGMYARVUOXICK-UHFFFAOYSA-N	-1	0	371.418	2.739	50	0		FFAARM
COc1cccc2ccn(CCC(=O)N[C@@H](Cc3ccccc3)C(=O)[O-])c21	ZINC000040313349	208247790	/nfs/dbraw/zinc/24/77/90/208247790.db2.gz	MJDHJHINLBEOML-KRWDZBQOSA-N	-1	0	366.417	2.852	50	0	biogenic	FFAARM
O=C([O-])CCCOc1ccc(CNC(=O)c2ncoc2[C@H]2CCCO2)cc1	ZINC000299747319	208342010	/nfs/dbraw/zinc/34/20/10/208342010.db2.gz	CPHYVIDUVVKEJC-OAHLLOKOSA-N	-1	0	374.393	2.700	50	0		FFAARM
O=C([O-])[C@H]1CN(C(=O)c2ccc(-c3cccc(Cl)c3)s2)CCO1	ZINC000299750624	208358840	/nfs/dbraw/zinc/35/88/40/208358840.db2.gz	ODFBXEBXWYBAJY-GFCCVEGCSA-N	-1	0	351.811	2.994	50	0		FFAARM
Cc1nc(-c2cnn(C)c2)sc1C(=O)N1[C@@H]2CCCC[C@@H]2C[C@H]1C(=O)[O-]	ZINC000299752729	208360628	/nfs/dbraw/zinc/36/06/28/208360628.db2.gz	VEMNUFPAMQLTQM-BNOWGMLFSA-N	-1	0	374.466	2.710	50	0		FFAARM
O=C([O-])[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1cccc(CN2CCCC2=O)c1	ZINC000299751146	208360719	/nfs/dbraw/zinc/36/07/19/208360719.db2.gz	PRRZSSBNXHOCGO-NJAFHUGGSA-N	-1	0	370.449	2.667	50	0		FFAARM
COc1ccccc1C[C@H](C)N(C)C(=O)c1ccccc1NCC(=O)[O-]	ZINC000065403662	208676004	/nfs/dbraw/zinc/67/60/04/208676004.db2.gz	BSAYAOHMUCROKO-AWEZNQCLSA-N	-1	0	356.422	2.895	50	0		FFAARM
COc1ccc(Br)cc1NC(=O)C[C@]1(C(=O)[O-])CCSC1	ZINC000071846853	208785536	/nfs/dbraw/zinc/78/55/36/208785536.db2.gz	GHHMUYCFGVLNOK-CQSZACIVSA-N	-1	0	374.256	2.994	50	0		FFAARM
O=C([O-])c1cccc(C[C@@H]2CCN(C(=O)Cc3cnc4ccccn34)C2)c1	ZINC000072139124	208806775	/nfs/dbraw/zinc/80/67/75/208806775.db2.gz	ZUKTTXYWPDRRDA-INIZCTEOSA-N	-1	0	363.417	2.666	50	0		FFAARM
Cc1ccncc1C(=O)N1CCC(C(=O)[O-])(n2ccc(C(C)(C)C)n2)CC1	ZINC000072420254	208852967	/nfs/dbraw/zinc/85/29/67/208852967.db2.gz	HMAACLZQSNBVJZ-UHFFFAOYSA-N	-1	0	370.453	2.600	50	0		FFAARM
Cc1nc(C)c(CC(=O)N2C[C@@H](c3ccccc3C)[C@H](C(=O)[O-])C2)s1	ZINC000091468931	208979245	/nfs/dbraw/zinc/97/92/45/208979245.db2.gz	WTEPMZBXGRUZET-JKSUJKDBSA-N	-1	0	358.463	2.938	50	0		FFAARM
O=C([O-])c1ccc([C@H]2CCCN(C(=O)C3(Cn4cccn4)CC3)C2)cc1	ZINC000095358541	209026028	/nfs/dbraw/zinc/02/60/28/209026028.db2.gz	NTUBCENFAWKPSH-KRWDZBQOSA-N	-1	0	353.422	2.768	50	0		FFAARM
COc1ccc([C@H](C(=O)[O-])N(C)Cc2cccc3cccnc32)c(OC)n1	ZINC000095361201	209027559	/nfs/dbraw/zinc/02/75/59/209027559.db2.gz	ILMJWKLEOHHZFI-GOSISDBHSA-N	-1	0	367.405	2.905	50	0		FFAARM
O=C([O-])c1cccc(C[C@@H]2CCN(C(=O)CCCN3CCCCC3=O)C2)c1	ZINC000095386706	209044705	/nfs/dbraw/zinc/04/47/05/209044705.db2.gz	CYFYBCHGUHYCRK-KRWDZBQOSA-N	-1	0	372.465	2.569	50	0		FFAARM
CCNc1ncc(C(=O)N2CCC[C@H](c3ccc(C(=O)[O-])cc3)C2)cn1	ZINC000095372499	209034720	/nfs/dbraw/zinc/03/47/20/209034720.db2.gz	NITBVJGHKPGEQF-HNNXBMFYSA-N	-1	0	354.410	2.626	50	0		FFAARM
O=C([O-])c1ccc([C@@H]2CCCN(C(=O)Cc3ccc(CO)cc3)C2)cc1	ZINC000095378224	209039144	/nfs/dbraw/zinc/03/91/44/209039144.db2.gz	KOOCQZVMZWAQKB-LJQANCHMSA-N	-1	0	353.418	2.826	50	0		FFAARM
COc1cccc(-c2cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)[O-])[nH]n2)c1	ZINC000095512767	209069480	/nfs/dbraw/zinc/06/94/80/209069480.db2.gz	RPSWFDDBXBZPSI-SFHVURJKSA-N	-1	0	365.389	2.511	50	0		FFAARM
O=C([O-])[C@H](c1cccc2c1OCC2)N1CCN(c2ccc(Cl)cn2)CC1	ZINC000095501376	132212313	/nfs/dbraw/zinc/21/23/13/132212313.db2.gz	ZHUORBAGRUFYHL-KRWDZBQOSA-N	-1	0	373.840	2.618	50	0		FFAARM
Cc1cccc(N2CCN(S(=O)(=O)c3ccc(C(=O)[O-])cc3)CC2)c1C	ZINC000006710560	132258612	/nfs/dbraw/zinc/25/86/12/132258612.db2.gz	NWPWTQFTDYDLED-UHFFFAOYSA-N	-1	0	374.462	2.513	50	0		FFAARM
O=C(CCNC(=O)c1c([O-])cc(F)cc1F)N1CCCc2ccccc21	ZINC000066046830	136136795	/nfs/dbraw/zinc/13/67/95/136136795.db2.gz	VVJCISHYEMCWDN-UHFFFAOYSA-N	-1	0	360.360	2.770	50	0		FFAARM
Cc1ccccc1OC1(C(=O)[O-])CCN(c2ncnc3[nH]ccc32)CC1	ZINC000072429058	136146850	/nfs/dbraw/zinc/14/68/50/136146850.db2.gz	KHFDRZJEUVLXIU-UHFFFAOYSA-N	-1	0	352.394	2.769	50	0		FFAARM
CCc1cc(N2CCC(Oc3cccnc3C)(C(=O)[O-])CC2)nc(C)n1	ZINC000072447888	136148358	/nfs/dbraw/zinc/14/83/58/136148358.db2.gz	XMZXJJUUABDGJX-UHFFFAOYSA-N	-1	0	356.426	2.553	50	0		FFAARM
COc1nc2c(cc1C(=O)N(C)[C@H](CC(=O)[O-])c1ccccc1)CCC2	ZINC000095522793	209074793	/nfs/dbraw/zinc/07/47/93/209074793.db2.gz	YVVCPYIEXWOFQV-QGZVFWFLSA-N	-1	0	354.406	2.867	50	0		FFAARM
O=C(NCC1CC1)c1c([O-])c2sccc2n(Cc2ccccc2)c1=O	ZINC000065215733	506269342	/nfs/dbraw/zinc/26/93/42/506269342.db2.gz	VKGSJXVURHUQSQ-UHFFFAOYSA-N	-1	0	354.431	2.957	50	0		FFAARM
CC(C)N1CCn2cc(S(=O)(=O)[N-]c3ccc(Cl)cc3)cc2C1=O	ZINC000065254774	506276308	/nfs/dbraw/zinc/27/63/08/506276308.db2.gz	JPVLRAKOEAWHGO-UHFFFAOYSA-N	-1	0	367.858	2.807	50	0		FFAARM
CC(C)(C)OC(=O)N[C@H](Cc1c(F)c(F)c(F)c(F)c1F)C(=O)[O-]	ZINC000002517128	506281727	/nfs/dbraw/zinc/28/17/27/506281727.db2.gz	UZDKQMIDSLETST-ZCFIWIBFSA-N	-1	0	355.259	2.903	50	0		FFAARM
C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)[C@@H](O)CC(=O)[O-]	ZINC000002562454	506283704	/nfs/dbraw/zinc/28/37/04/506283704.db2.gz	IQAJGZRUBDBAEP-SGTLLEGYSA-N	-1	0	355.390	2.749	50	0		FFAARM
CCc1nn(C)c(Cl)c1[C@H]1CC(=O)Nc2cc(OCC(=O)[O-])ccc21	ZINC000065371324	506291355	/nfs/dbraw/zinc/29/13/55/506291355.db2.gz	HTVSNWLVQCJVRW-NSHDSACASA-N	-1	0	363.801	2.573	50	0		FFAARM
Cc1nn(Cc2cccc(C)c2)c(C)c1[N-]S(=O)(=O)c1cnn(C)c1C	ZINC000002792598	506293157	/nfs/dbraw/zinc/29/31/57/506293157.db2.gz	GQFCGANCEAXIOR-UHFFFAOYSA-N	-1	0	373.482	2.699	50	0		FFAARM
CCOC(=O)[C@@]([N-]c1ccc(F)c(F)c1F)(NC(=O)CC)C(F)(F)F	ZINC000003118485	506311350	/nfs/dbraw/zinc/31/13/50/506311350.db2.gz	HJKZAEBOGGKFRL-CYBMUJFWSA-N	-1	0	372.265	2.864	50	0		FFAARM
O=C([O-])c1cc(I)cc(I)c1	ZINC000004014502	506355815	/nfs/dbraw/zinc/35/58/15/506355815.db2.gz	FHTJRJBWLBXVPO-UHFFFAOYSA-N	-1	0	373.915	2.594	50	0		FFAARM
CCCC[C@H](NC(=O)[C@@H](CCC)NC(=O)OCc1ccccc1)C(=O)[O-]	ZINC000004760571	506393530	/nfs/dbraw/zinc/39/35/30/506393530.db2.gz	XPRXIIXCLWGYHA-CVEARBPZSA-N	-1	0	364.442	2.841	50	0		FFAARM
Cc1nnc2ccc(-c3cccc([N-]S(=O)(=O)c4cccs4)c3)nn12	ZINC000005150942	506424456	/nfs/dbraw/zinc/42/44/56/506424456.db2.gz	ARMPSDYVDHLWSL-UHFFFAOYSA-N	-1	0	371.447	2.962	50	0		FFAARM
O=C(Nc1ccccc1)c1cnc([N-]S(=O)(=O)c2ccccc2)nc1	ZINC000006270580	506474466	/nfs/dbraw/zinc/47/44/66/506474466.db2.gz	PIKXZVQNMCVKLS-UHFFFAOYSA-N	-1	0	354.391	2.530	50	0		FFAARM
Cc1cc([C@@H](C(=O)[O-])N2CCN(Cc3ncccc3C)CC2)ccc1F	ZINC000055060800	506669599	/nfs/dbraw/zinc/66/95/99/506669599.db2.gz	FUEBTXLPJMMVHP-IBGZPJMESA-N	-1	0	357.429	2.781	50	0		FFAARM
CCSc1nc(CC(=O)N(CC(=O)[O-])Cc2ccccc2)cs1	ZINC000055358104	506735688	/nfs/dbraw/zinc/73/56/88/506735688.db2.gz	ROPADNWPTMMUNZ-UHFFFAOYSA-N	-1	0	350.465	2.911	50	0		FFAARM
COc1c(F)cc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2C)cc1F	ZINC000055682509	506824687	/nfs/dbraw/zinc/82/46/87/506824687.db2.gz	XXZCAFKAMCMXMK-UHFFFAOYSA-N	-1	0	357.334	2.781	50	0		FFAARM
CS(=O)(=O)[N-]c1ccccc1C(=O)OCc1cc(-c2ccco2)on1	ZINC000012631439	506887350	/nfs/dbraw/zinc/88/73/50/506887350.db2.gz	YAAOBKQJVWXQQX-UHFFFAOYSA-N	-1	0	362.363	2.663	50	0		FFAARM
CC(=O)c1ccc(S(=O)(=O)N[C@@H](CC(=O)[O-])c2ccc(F)cc2)cc1	ZINC000012859578	506909918	/nfs/dbraw/zinc/90/99/18/506909918.db2.gz	FENPYBGSTPNCEM-INIZCTEOSA-N	-1	0	365.382	2.523	50	0		FFAARM
Cc1ccc(S(=O)(=O)Nc2ccc(N3CCCC3=O)cc2)cc1C(=O)[O-]	ZINC000013060411	506926944	/nfs/dbraw/zinc/92/69/44/506926944.db2.gz	UTBWVNYTPWZZRP-UHFFFAOYSA-N	-1	0	374.418	2.621	50	0		FFAARM
COc1cc(/C=C/C(=O)N2CCC[C@H](C(=O)[O-])C2)ccc1OC(F)F	ZINC000013170549	506930890	/nfs/dbraw/zinc/93/08/90/506930890.db2.gz	FNCKKTNWWUAGMW-PZBABLGHSA-N	-1	0	355.337	2.633	50	0		FFAARM
COc1ccc([C@H](CC(=O)[O-])NC(=O)CCOc2ccccc2OC)cc1	ZINC000013188112	506932690	/nfs/dbraw/zinc/93/26/90/506932690.db2.gz	ZDBHJNVHSBDARM-INIZCTEOSA-N	-1	0	373.405	2.805	50	0		FFAARM
COc1ccc([C@@H](CC(=O)[O-])NC(=O)Cc2ccc3c(c2)CCO3)cc1	ZINC000013427022	506940553	/nfs/dbraw/zinc/94/05/53/506940553.db2.gz	RCCTYPVZGQCXDI-QGZVFWFLSA-N	-1	0	355.390	2.505	50	0		FFAARM
Cc1ccc(S(C)(=O)=O)cc1NC(=O)CC1(C(=O)[O-])CCCCC1	ZINC000013468199	506942709	/nfs/dbraw/zinc/94/27/09/506942709.db2.gz	GKBHEYZNQNBMIS-UHFFFAOYSA-N	-1	0	353.440	2.762	50	0		FFAARM
O=C([O-])[C@H]1CC=CC[C@H]1C(=O)Nc1ccccc1C(=O)N1CCCCC1	ZINC000013466559	506943422	/nfs/dbraw/zinc/94/34/22/506943422.db2.gz	XDRCEVQBCNZWTL-CABCVRRESA-N	-1	0	356.422	2.918	50	0		FFAARM
COc1cc(NC(=O)c2ccc(OC(C)=O)cc2)c(C(=O)[O-])cc1OC	ZINC000013955033	506959614	/nfs/dbraw/zinc/95/96/14/506959614.db2.gz	NORCSUANCZWKPI-UHFFFAOYSA-N	-1	0	359.334	2.580	50	0		FFAARM
O=C([O-])[C@H]1CC=CC[C@H]1C(=O)Nc1sc2c(c1C(=O)NC1CC1)CCC2	ZINC000017076638	507114577	/nfs/dbraw/zinc/11/45/77/507114577.db2.gz	ZAQVOIXDPXEAFA-NEPJUHHUSA-N	-1	0	374.462	2.735	50	0		FFAARM
Cc1cccc(-n2c(=S)[n-]c(=O)c3c2NCN(C[C@H]2CCCO2)C3)c1C	ZINC000020567662	507226766	/nfs/dbraw/zinc/22/67/66/507226766.db2.gz	WRDQBEBLNVVIHB-CQSZACIVSA-N	-1	0	372.494	2.876	50	0		FFAARM
COc1ccccc1N1CCN(Cc2nc(=O)c3sccc3[n-]2)CC1	ZINC000021822049	507268087	/nfs/dbraw/zinc/26/80/87/507268087.db2.gz	HRTXCQPOKYHQPS-UHFFFAOYSA-N	-1	0	356.451	2.728	50	0		FFAARM
COc1ccc([C@@H](c2sc3ncnn3c2[O-])N2C[C@@H](C)O[C@@H](C)C2)cc1	ZINC000022609438	507301077	/nfs/dbraw/zinc/30/10/77/507301077.db2.gz	UHVPBRKGMCUSBA-ZOWXZIJZSA-N	-1	0	374.466	2.704	50	0		FFAARM
Cc1cc(S(=O)(=O)N2c3ccccc3C[C@@H]2C)ccc1OCC(=O)[O-]	ZINC000058377045	507411127	/nfs/dbraw/zinc/41/11/27/507411127.db2.gz	CFSDXXWVNMBWRA-ZDUSSCGKSA-N	-1	0	361.419	2.598	50	0		FFAARM
CC(C)(C)OC(=O)N[C@@H](CCCC(=O)OCc1ccccc1)C(=O)[O-]	ZINC000060114174	507513909	/nfs/dbraw/zinc/51/39/09/507513909.db2.gz	QAMQBROWEMDMOK-AWEZNQCLSA-N	-1	0	351.399	2.878	50	0		FFAARM
O=C([O-])c1nccnc1C(=O)Nc1cc(NC(=O)C2CCC2)ccc1Cl	ZINC000071284323	507700213	/nfs/dbraw/zinc/70/02/13/507700213.db2.gz	AEPUOIOYTLRYRK-UHFFFAOYSA-N	-1	0	374.784	2.819	50	0		FFAARM
CC(C)c1nc(Cc2ccc(NC(=O)c3nccnc3C(=O)[O-])cc2)no1	ZINC000071289025	507700935	/nfs/dbraw/zinc/70/09/35/507700935.db2.gz	NYPPEJZPNYEBSI-UHFFFAOYSA-N	-1	0	367.365	2.524	50	0		FFAARM
COc1cccc(CN(C)c2nccc(-c3cc(C(=O)[O-])ccn3)n2)c1	ZINC000071746248	507709987	/nfs/dbraw/zinc/70/99/87/507709987.db2.gz	GZUHJANLZOYDPQ-UHFFFAOYSA-N	-1	0	350.378	2.882	50	0		FFAARM
COc1cccc(-c2cc(C(=O)[O-])cc(S(=O)(=O)NC3CC3)c2)c1F	ZINC000071756781	507712576	/nfs/dbraw/zinc/71/25/76/507712576.db2.gz	NXWIPQZWNIXMCK-UHFFFAOYSA-N	-1	0	365.382	2.640	50	0		FFAARM
COc1ccc(OC)c(S(=O)(=O)[N-]c2ccnn2C2CCCC2)c1	ZINC000028249195	507715636	/nfs/dbraw/zinc/71/56/36/507715636.db2.gz	ZTZMYMCZXZZSCI-UHFFFAOYSA-N	-1	0	351.428	2.816	50	0		FFAARM
CN(C)c1ccccc1-c1cc(C(=O)[O-])cc(S(=O)(=O)NC2CC2)c1	ZINC000072140179	507756105	/nfs/dbraw/zinc/75/61/05/507756105.db2.gz	OVIZXEQGIWOXQF-UHFFFAOYSA-N	-1	0	360.435	2.559	50	0		FFAARM
O=C([O-])c1cccc(C[C@H]2CCN(C(=O)Cc3cnc4ccccn34)C2)c1	ZINC000072139123	507756262	/nfs/dbraw/zinc/75/62/62/507756262.db2.gz	ZUKTTXYWPDRRDA-MRXNPFEDSA-N	-1	0	363.417	2.666	50	0		FFAARM
C[C@@H](Oc1ccccc1CN(C)Cc1nc(-c2cccnc2)no1)C(=O)[O-]	ZINC000072140119	507756624	/nfs/dbraw/zinc/75/66/24/507756624.db2.gz	SDTKNAUFFSBLKS-CYBMUJFWSA-N	-1	0	368.393	2.616	50	0		FFAARM
Cc1cc2nc(CN3CCC[C@H]3c3nc4cc(F)ccc4[nH]3)cc(=O)n2[n-]1	ZINC000072163870	507767071	/nfs/dbraw/zinc/76/70/71/507767071.db2.gz	VFWMRNDULVJKKJ-INIZCTEOSA-N	-1	0	366.400	2.684	50	0		FFAARM
O=C([O-])c1ccccc1CC(=O)NCc1nc(-c2ccc(Cl)cc2)no1	ZINC000072405272	507783885	/nfs/dbraw/zinc/78/38/85/507783885.db2.gz	KNLVUSXCEIOSJD-UHFFFAOYSA-N	-1	0	371.780	2.947	50	0		FFAARM
Cc1cc2cccc(C(=O)N3CCC(C(=O)[O-])(n4ccnc4)CC3)c2o1	ZINC000072474408	507795712	/nfs/dbraw/zinc/79/57/12/507795712.db2.gz	JCEGQXJDCPQTIB-UHFFFAOYSA-N	-1	0	353.378	2.654	50	0		FFAARM
Cc1ccc(OC2(C(=O)[O-])CCN(C(=O)[C@@H]3CC=CCC3)CC2)c(C)n1	ZINC000072475534	507796466	/nfs/dbraw/zinc/79/64/66/507796466.db2.gz	APIJGMVRIVPGRQ-MRXNPFEDSA-N	-1	0	358.438	2.879	50	0		FFAARM
CCCc1noc(-c2cc(S(=O)(=O)[N-]c3cccnc3)ccc2OC)n1	ZINC000064580065	507803137	/nfs/dbraw/zinc/80/31/37/507803137.db2.gz	GOVUVJOZSUSWQJ-UHFFFAOYSA-N	-1	0	374.422	2.894	50	0		FFAARM
CC(=O)Nc1c(C)ccc(NC(=O)C[C@@]2(C(=O)[O-])CCSC2)c1C	ZINC000064611298	507804329	/nfs/dbraw/zinc/80/43/29/507804329.db2.gz	XGIJPCQHAHZRKW-KRWDZBQOSA-N	-1	0	350.440	2.798	50	0		FFAARM
COc1cccc([C@@H]2CN(C(=O)c3ccccc3N(C)C)C[C@H]2C(=O)[O-])c1	ZINC000091526284	507991222	/nfs/dbraw/zinc/99/12/22/507991222.db2.gz	QKJVUWQKRWLIRR-ZWKOTPCHSA-N	-1	0	368.433	2.702	50	0		FFAARM
COc1ccc(O)cc1-c1c(-c2ccccc2)ncn1[C@@H](CO)C(=O)[O-]	ZINC000091595777	507995111	/nfs/dbraw/zinc/99/51/11/507995111.db2.gz	FYELJOHNQQHDIN-HNNXBMFYSA-N	-1	0	354.362	2.549	50	0		FFAARM
COc1cc(/C=C\C(=O)N2CCC[C@H](C(=O)[O-])C2)ccc1OC(F)F	ZINC000096305165	508212994	/nfs/dbraw/zinc/21/29/94/508212994.db2.gz	FNCKKTNWWUAGMW-HWPRWLFBSA-N	-1	0	355.337	2.633	50	0		FFAARM
Cc1cccc(N(Cc2nn3c([n-]2)nc(C)cc3=O)C(=O)c2ccccc2)c1	ZINC000101802216	508257804	/nfs/dbraw/zinc/25/78/04/508257804.db2.gz	BNSBQSHDKCJBTP-UHFFFAOYSA-N	-1	0	373.416	2.881	50	0		FFAARM
CC(C)c1nc(-c2ccccc2[N-]S(=O)(=O)C[C@@H]2CCCCO2)n[nH]1	ZINC000076936207	508263825	/nfs/dbraw/zinc/26/38/25/508263825.db2.gz	KZUPHSRWAOTERN-ZDUSSCGKSA-N	-1	0	364.471	2.906	50	0		FFAARM
CCOc1ccc(-c2ccnc(N(C)Cc3nc(C)c[nH]3)n2)cc1C(=O)[O-]	ZINC000077516972	508326651	/nfs/dbraw/zinc/32/66/51/508326651.db2.gz	PXWIRXPNQLGSJV-UHFFFAOYSA-N	-1	0	367.409	2.908	50	0		FFAARM
CCn1c(=O)c2ccc(C(=O)OCC(F)(F)C(F)F)cc2[n-]c1=S	ZINC000157476370	508571597	/nfs/dbraw/zinc/57/15/97/508571597.db2.gz	IJYIHJABXRGHKT-UHFFFAOYSA-N	-1	0	364.320	2.762	50	0		FFAARM
O=C([O-])[C@@H]1CCCCN1C(=O)c1ccc(-n2ccc(C(F)(F)F)n2)cc1	ZINC000136488623	508697371	/nfs/dbraw/zinc/69/73/71/508697371.db2.gz	KXORQIHAZJVXMA-ZDUSSCGKSA-N	-1	0	367.327	2.970	50	0		FFAARM
COC(=O)C[C@@H](c1ccc(OC)c(O)c1)c1c([O-])c2ccccc2oc1=O	ZINC000217858841	509271218	/nfs/dbraw/zinc/27/12/18/509271218.db2.gz	JMQQGAFTFPAARS-ZDUSSCGKSA-N	-1	0	370.357	2.908	50	0	biogenic	FFAARM
O=C([O-])c1csc(CNC(=O)/C=C\c2ccccc2Br)n1	ZINC000221369132	509307737	/nfs/dbraw/zinc/30/77/37/509307737.db2.gz	MMRDBABWYXFMHJ-WAYWQWQTSA-N	-1	0	367.224	2.933	50	0		FFAARM
CCC(=O)Nc1ccc(S(=O)(=O)[N-]c2cc(-c3ccncc3)[nH]n2)cc1	ZINC000163204877	509351464	/nfs/dbraw/zinc/35/14/64/509351464.db2.gz	ZJNZBPYVCXKKAI-UHFFFAOYSA-N	-1	0	371.422	2.621	50	0		FFAARM
O=C([O-])[C@H](CNC(=O)CNc1ccccc1Cl)Oc1ccc(F)cc1	ZINC000170592157	509673650	/nfs/dbraw/zinc/67/36/50/509673650.db2.gz	FJZGNTYRIMPKCN-HNNXBMFYSA-N	-1	0	366.776	2.539	50	0		FFAARM
Cc1oc(C)c(S(=O)(=O)N[C@@H]2CCC[C@@H](C(F)(F)F)C2)c1C(=O)[O-]	ZINC000237647052	509701520	/nfs/dbraw/zinc/70/15/20/509701520.db2.gz	LSGMSBXMNLNBCV-NXEZZACHSA-N	-1	0	369.361	2.994	50	0		FFAARM
CC(C)C[C@@H](NC(=O)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1)C(=O)[O-]	ZINC000170671489	509711619	/nfs/dbraw/zinc/71/16/19/509711619.db2.gz	FWPOJKCJEXQCOL-OAHLLOKOSA-N	-1	0	359.426	2.674	50	0		FFAARM
CCO[C@H]1C[C@](NC(=O)c2cnc(-c3ccco3)s2)(C(=O)[O-])C1(C)C	ZINC000193040978	509749629	/nfs/dbraw/zinc/74/96/29/509749629.db2.gz	DMZSXDUIBIBRBJ-SJCJKPOMSA-N	-1	0	364.423	2.791	50	0		FFAARM
O=C([O-])C[C@H]1CN(C(=O)c2[nH]c3ccc(Cl)cc3c2Cl)CCO1	ZINC000238057963	509810623	/nfs/dbraw/zinc/81/06/23/509810623.db2.gz	FHSPOZQWTWFDCA-VIFPVBQESA-N	-1	0	357.193	2.790	50	0		FFAARM
O=C([O-])CCN(Cc1ccc(F)c(F)c1)C(=O)Cc1cn2ccccc2n1	ZINC000238120357	509823520	/nfs/dbraw/zinc/82/35/20/509823520.db2.gz	IDSNDEMNCOMLCQ-UHFFFAOYSA-N	-1	0	373.359	2.659	50	0		FFAARM
O=C(N[C@H](c1cccs1)[C@H]1C[C@@H](O)C1)c1[n-]c(=O)nc2ccccc21	ZINC000253534789	509886530	/nfs/dbraw/zinc/88/65/30/509886530.db2.gz	CXZIYHXVSXXAFN-RWSFTLGLSA-N	-1	0	355.419	2.639	50	0		FFAARM
O=C([O-])[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccc(CN2CCCC2=O)cc1	ZINC000265534074	510104073	/nfs/dbraw/zinc/10/40/73/510104073.db2.gz	BREKUPJPNOEFLC-SQNIBIBYSA-N	-1	0	370.449	2.667	50	0		FFAARM
O=C([O-])[C@H]1c2ccccc2CCN1C(=O)c1ccc(N2CCCC2=O)cc1	ZINC000262506704	510303527	/nfs/dbraw/zinc/30/35/27/510303527.db2.gz	JFGUXIAGXQJTAY-LJQANCHMSA-N	-1	0	364.401	2.638	50	0		FFAARM
O=C([O-])[C@@H](C(=O)NCc1ccccc1CN1CCCC1=O)C1CCCCC1	ZINC000299781111	511679789	/nfs/dbraw/zinc/67/97/89/511679789.db2.gz	VKNMGPUCGJVZJI-LJQANCHMSA-N	-1	0	372.465	2.706	50	0		FFAARM
C[C@@H]1Cc2cc(S(=O)(=O)[N-]c3nnc(C4CCC4)[nH]3)cc(Cl)c2O1	ZINC000508196981	514702597	/nfs/dbraw/zinc/70/25/97/514702597.db2.gz	XGXBFGHOSFBPII-MRVPVSSYSA-N	-1	0	368.846	2.850	50	0		FFAARM
Cc1c2cc(Cl)c([O-])cc2oc(=O)c1CC(=O)NCCn1cccc1	ZINC000524735123	516808831	/nfs/dbraw/zinc/80/88/31/516808831.db2.gz	WSZMYNMZTHROHV-UHFFFAOYSA-N	-1	0	360.797	2.621	50	0		FFAARM
O=S(=O)([N-]C[C@@H](c1ccsc1)n1cccn1)c1c(F)cccc1F	ZINC000575613909	518236542	/nfs/dbraw/zinc/23/65/42/518236542.db2.gz	LRMPSBKSHKNVKV-AWEZNQCLSA-N	-1	0	369.418	2.791	50	0		FFAARM
Cc1ccc(C(=O)Nc2cccc(CNC(=O)C3(C(=O)[O-])CC3)c2)cc1	ZINC000574404785	519140545	/nfs/dbraw/zinc/14/05/45/519140545.db2.gz	UGHKMKGPDLNPDN-UHFFFAOYSA-N	-1	0	352.390	2.728	50	0		FFAARM
COc1cccc([C@H](C)N2CCN(C(=O)c3ccc(C(=O)[O-])cc3)CC2)c1	ZINC000575045894	519471325	/nfs/dbraw/zinc/47/13/25/519471325.db2.gz	XCLSIULJDMSZJQ-HNNXBMFYSA-N	-1	0	368.433	2.912	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)/C(=C\c2ccc(F)cc2)c2cccs2)CCO1	ZINC000606441358	521068231	/nfs/dbraw/zinc/06/82/31/521068231.db2.gz	PZWFEKKJSPBYNS-LTBFUDJGSA-N	-1	0	361.394	2.740	50	0		FFAARM
Cc1nc(COc2ccc(/C=C\C(=O)N3CC[C@@H](C(=O)[O-])C3)cc2)cs1	ZINC000606442069	521068355	/nfs/dbraw/zinc/06/83/55/521068355.db2.gz	PDKXSKGBKVXXAB-IJVDHGTGSA-N	-1	0	372.446	2.977	50	0		FFAARM
COc1cc(/C=C\C(=O)N2CCCC[C@H]2C(=O)[O-])cc(Cl)c1OC	ZINC000606441053	521068779	/nfs/dbraw/zinc/06/87/79/521068779.db2.gz	KAMDWWBTXWJDNI-FWWRYZNZSA-N	-1	0	353.802	2.836	50	0		FFAARM
Cc1nc([C@H]2CCOC2)sc1C(=O)NCCc1ccc(C(=O)[O-])cc1	ZINC000630098452	522617657	/nfs/dbraw/zinc/61/76/57/522617657.db2.gz	SYHTWXSINDTCPT-AWEZNQCLSA-N	-1	0	360.435	2.626	50	0		FFAARM
C[C@@H]1C[C@H](C(=O)NCc2ccc(Oc3cccnc3)c(F)c2)O[C@H]1C(=O)[O-]	ZINC000630164166	522667496	/nfs/dbraw/zinc/66/74/96/522667496.db2.gz	BWBPQSWFPJLJFU-SSKCKEOISA-N	-1	0	374.368	2.507	50	0		FFAARM
COC[C@H](C)N(C(=O)c1cccc(C(=O)[O-])n1)[C@@H]1CCc2ccccc21	ZINC000630305940	522780687	/nfs/dbraw/zinc/78/06/87/522780687.db2.gz	UJSOJPDBCRAUCR-SCLBCKFNSA-N	-1	0	354.406	2.944	50	0		FFAARM
O=C([O-])[C@@H]1C[C@H]1c1ccc(NC(=O)CN2C(=O)CCc3ccccc32)cc1	ZINC000630328036	522793200	/nfs/dbraw/zinc/79/32/00/522793200.db2.gz	FFTLMVPKQFQVFD-DLBZAZTESA-N	-1	0	364.401	2.793	50	0		FFAARM
Cc1nn(CCC(=O)[O-])c(C)c1NC(=O)[C@H]1C[C@@H]1c1ccc(F)c(F)c1	ZINC000630331944	522794976	/nfs/dbraw/zinc/79/49/76/522794976.db2.gz	RMZPZWJNSVLQNB-OLZOCXBDSA-N	-1	0	363.364	2.995	50	0		FFAARM
COC(=O)c1c([S-])nc(-c2ccccc2)n(-c2ccc(C)cc2)c1=O	ZINC000000715364	523668673	/nfs/dbraw/zinc/66/86/73/523668673.db2.gz	DYRSNFLOVVQYNW-HNNXBMFYSA-N	-1	0	352.415	2.905	50	0		FFAARM
Cc1ccccc1[C@@H]1CN(C(=O)CCc2cc(Cl)no2)C[C@H]1C(=O)[O-]	ZINC000091585581	525385460	/nfs/dbraw/zinc/38/54/60/525385460.db2.gz	QMAKDZOYCIZECJ-LSDHHAIUSA-N	-1	0	362.813	2.896	50	0		FFAARM
O=C([O-])[C@@H]1CCCN1CC(=O)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000262613516	526275540	/nfs/dbraw/zinc/27/55/40/526275540.db2.gz	CGYIKPPFNADDOF-OALUTQOASA-N	-1	0	352.434	2.636	50	0		FFAARM
O=C([O-])[C@@]1(NC(=O)OCC2c3ccccc3-c3ccccc32)CCOC1	ZINC000078679993	526296331	/nfs/dbraw/zinc/29/63/31/526296331.db2.gz	SRLUOBNBKTVLPZ-HXUWFJFHSA-N	-1	0	353.374	2.769	50	0		FFAARM
Cc1oc(CN(C)C(=O)c2ccc3c(c2)NC(=O)[C@@H](C)S3)cc1C(=O)[O-]	ZINC000268936541	526768915	/nfs/dbraw/zinc/76/89/15/526768915.db2.gz	OAUAKNOLNHEKPJ-SNVBAGLBSA-N	-1	0	374.418	2.991	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)[C@H]1CCCOC1)c1cccc(Br)c1	ZINC000238149955	527625876	/nfs/dbraw/zinc/62/58/76/527625876.db2.gz	LITPEXUALWNLBW-WCQYABFASA-N	-1	0	356.216	2.508	50	0		FFAARM
Cc1nc(C)n(-c2ccc(C(=O)N3[C@H](C(=O)[O-])C[C@@H]4CCCC[C@@H]43)cc2)n1	ZINC000108377564	570906251	/nfs/dbraw/zinc/90/62/51/570906251.db2.gz	BCRWEPCBZUZZOZ-SZMVWBNQSA-N	-1	0	368.437	2.742	50	0		FFAARM
COc1cc(C)c(CN(C)C(=O)c2n[n-]c3ccccc3c2=O)cc1OC	ZINC000111541087	570933380	/nfs/dbraw/zinc/93/33/80/570933380.db2.gz	GAJUPIJRAUYCHP-UHFFFAOYSA-N	-1	0	367.405	2.521	50	0		FFAARM
Cn1cnnc1-c1ccccc1[N-]S(=O)(=O)c1ccc(Cl)s1	ZINC000048344907	570949305	/nfs/dbraw/zinc/94/93/05/570949305.db2.gz	XSWMFGCRDMQCNH-UHFFFAOYSA-N	-1	0	354.844	2.998	50	0		FFAARM
CS(=O)(=O)[C@@H]1CCC[C@@H](NC(=O)c2ccc3[n-]c(=S)oc3c2)C1	ZINC000073930095	571139044	/nfs/dbraw/zinc/13/90/44/571139044.db2.gz	SFBPURUEVAYNSH-GHMZBOCLSA-N	-1	0	354.453	2.576	50	0		FFAARM
COc1cccc(-c2nc(=NC(=O)c3ccoc3-n3ccnc3)s[n-]2)c1	ZINC000328597257	970437770	/nfs/dbraw/zinc/43/77/70/970437770.db2.gz	GGZZLZBOIRVINA-UHFFFAOYSA-N	-1	0	367.390	2.667	50	0		FFAARM
Cc1c(C(=O)[O-])sc2[nH]cnc(=N[C@@H]3C[C@@H](CO)c4ccccc43)c12	ZINC000952876054	1011006098	/nfs/dbraw/zinc/00/60/98/1011006098.db2.gz	ZTNFTAHQYOQDIS-GXFFZTMASA-N	-1	0	355.419	2.753	50	0		FFAARM
O=C([O-])c1cc(O)cc(C(=O)N[C@H]2CCCN(Cc3ccccc3F)C2)c1	ZINC000952986969	1011044384	/nfs/dbraw/zinc/04/43/84/1011044384.db2.gz	HPSZQBQLGBHVFS-INIZCTEOSA-N	-1	0	372.396	2.624	50	0		FFAARM
CC(C)CCn1c2ccccc2c([O-])c(C(=O)Nc2ncccn2)c1=O	ZINC000005461515	1012704812	/nfs/dbraw/zinc/70/48/12/1012704812.db2.gz	YVSHPENPAAJLRU-UHFFFAOYSA-N	-1	0	352.394	2.796	50	0		FFAARM
CO[C@](C)(C(=O)[O-])C(=O)NC[C@H]1CC2c3ccccc3C1c1ccccc12	ZINC000656848919	1025458458	/nfs/dbraw/zinc/45/84/58/1025458458.db2.gz	RPOHUWCQPYQPOV-ADVMQEMQSA-N	-1	0	365.429	2.890	50	0		FFAARM
CN(C)c1ccnc(NC(=O)N2CCC(c3ccccc3C(=O)[O-])CC2)n1	ZINC000669502329	1027960439	/nfs/dbraw/zinc/96/04/39/1027960439.db2.gz	KUDSYAGXWLDSKZ-UHFFFAOYSA-N	-1	0	369.425	2.652	50	0		FFAARM
Cc1cccc(NC(=O)CC(=O)N[C@H](CC(=O)[O-])c2ccccc2)c1C	ZINC001506396064	1059489452	/nfs/dbraw/zinc/48/94/52/1059489452.db2.gz	BDQFRVJPZJLISN-QGZVFWFLSA-N	-1	0	354.406	2.964	50	0		FFAARM
COc1ccc(Br)cc1S(=O)(=O)[N-]c1ncccc1C	ZINC000000863567	539334834	/nfs/dbraw/zinc/33/48/34/539334834.db2.gz	XUUJFAKVEMCQGR-UHFFFAOYSA-N	-1	0	357.229	2.962	50	0		FFAARM
O=S(=O)([N-]CCc1ncc(C(F)(F)F)cc1Cl)C(F)(F)F	ZINC000263640134	210006509	/nfs/dbraw/zinc/00/65/09/210006509.db2.gz	YSWSDFMEYZHNBD-UHFFFAOYSA-N	-1	0	356.675	2.736	50	0		FFAARM
COc1cc(S(=O)(=O)Nc2ccc(OCC(=O)[O-])cc2)ccc1Cl	ZINC000001072084	219364100	/nfs/dbraw/zinc/36/41/00/219364100.db2.gz	GKKTYHNHOFPZJY-UHFFFAOYSA-N	-1	0	371.798	2.613	50	0		FFAARM
COC(=O)c1ccc(NS(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)cc1	ZINC000020281462	209614937	/nfs/dbraw/zinc/61/49/37/209614937.db2.gz	OYHSEVQQCVZAME-UHFFFAOYSA-N	-1	0	369.782	2.626	50	0		FFAARM
Cc1oc2cc3oc(=O)c(CCC(=O)N[C@@H](C)C(=O)[O-])c(C)c3cc2c1C	ZINC000002154534	209393603	/nfs/dbraw/zinc/39/36/03/209393603.db2.gz	FNZRUUNIOKGVFU-NSHDSACASA-N	-1	0	371.389	2.986	50	0	biogenic	FFAARM
O=C([O-])/C=C/C(=O)N1N=C(c2ccccc2)C[C@H]1c1cccc([N+](=O)[O-])c1	ZINC000000862325	209378553	/nfs/dbraw/zinc/37/85/53/209378553.db2.gz	ZNXCVFGTISGIIR-FVNWOWOISA-N	-1	0	365.345	2.913	50	0		FFAARM
COc1ccc([C@H](C)NC(=O)c2c([O-])c3cccc4c3n(c2=O)CC4)cc1	ZINC000170624806	209376405	/nfs/dbraw/zinc/37/64/05/209376405.db2.gz	YGJMEMYZCKENSQ-LBPRGKRZSA-N	-1	0	364.401	2.763	50	0		FFAARM
CC(C)Oc1cncc(C(=O)[N-]S(=O)(=O)c2ccc(Cl)cc2F)c1	ZINC000124581286	209362336	/nfs/dbraw/zinc/36/23/36/209362336.db2.gz	HKTFNLKSHCMSFQ-UHFFFAOYSA-N	-1	0	372.805	2.780	50	0		FFAARM
O=C([O-])CCN(C[C@H]1CCCO1)C(=O)c1cc2ccc(Cl)cc2[nH]1	ZINC000238108947	209360778	/nfs/dbraw/zinc/36/07/78/209360778.db2.gz	MONBMINJDHQLKL-CYBMUJFWSA-N	-1	0	350.802	2.917	50	0		FFAARM
O=C([O-])C[C@H]1CN(C(=O)c2ccccc2CCc2ccccc2)CCO1	ZINC000238057342	209357448	/nfs/dbraw/zinc/35/74/48/209357448.db2.gz	IZUCLAAKKWBBRH-SFHVURJKSA-N	-1	0	353.418	2.788	50	0		FFAARM
Cc1nn(Cc2ccc(C)cc2)c(C)c1CCC(=O)NC1(C(=O)[O-])CC1	ZINC000237851920	209356756	/nfs/dbraw/zinc/35/67/56/209356756.db2.gz	UYVOXWHWUBKADC-UHFFFAOYSA-N	-1	0	355.438	2.523	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)[C@@H]1CCCOC1)c1ccc(Br)cc1	ZINC000237953816	209356082	/nfs/dbraw/zinc/35/60/82/209356082.db2.gz	OFVZEKGKGQKNJG-YPMHNXCESA-N	-1	0	356.216	2.508	50	0		FFAARM
Cc1nc(-c2cnn(C)c2)sc1C(=O)N1[C@H](C(=O)[O-])C[C@@H]2CCCC[C@@H]21	ZINC000237734296	209354946	/nfs/dbraw/zinc/35/49/46/209354946.db2.gz	VEMNUFPAMQLTQM-UBHSHLNASA-N	-1	0	374.466	2.710	50	0		FFAARM
Cc1nc(-c2cnn(C)c2)sc1C(=O)N1CCCC[C@@H]1CCC(=O)[O-]	ZINC000237733308	209354400	/nfs/dbraw/zinc/35/44/00/209354400.db2.gz	GVSFPNGKCJHEAF-CYBMUJFWSA-N	-1	0	362.455	2.712	50	0		FFAARM
Cc1nc(COc2ccc(/C=C/C(=O)N3CC[C@@H](C(=O)[O-])C3)cc2)cs1	ZINC000237743085	209353583	/nfs/dbraw/zinc/35/35/83/209353583.db2.gz	PDKXSKGBKVXXAB-NFBGWVBBSA-N	-1	0	372.446	2.977	50	0		FFAARM
Cc1c(C(=O)N2CC[C@@H](C(=O)[O-])C2)cnn1-c1cccc(C(F)(F)F)c1	ZINC000237763119	209353503	/nfs/dbraw/zinc/35/35/03/209353503.db2.gz	PVCVNGJRRMVNOA-LLVKDONJSA-N	-1	0	367.327	2.746	50	0		FFAARM
C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)N1CCO[C@@H](CC(=O)[O-])C1	ZINC000237540809	209350368	/nfs/dbraw/zinc/35/03/68/209350368.db2.gz	VVLWDJPRKOTYLH-RISCZKNCSA-N	-1	0	359.344	2.586	50	0		FFAARM
COc1ccc2[nH]cc(CC(=O)N3Cc4ccccc4C[C@H]3C(=O)[O-])c2c1	ZINC000237459859	209348121	/nfs/dbraw/zinc/34/81/21/209348121.db2.gz	YOPPYUAEIJQPPM-IBGZPJMESA-N	-1	0	364.401	2.757	50	0		FFAARM
CCn1cc(Br)cc1C(=O)N1CCC[C@H](CCC(=O)[O-])C1	ZINC000043584443	209307938	/nfs/dbraw/zinc/30/79/38/209307938.db2.gz	FNEBTLDLUCMDGC-LLVKDONJSA-N	-1	0	357.248	2.988	50	0		FFAARM
CCn1c(=O)c2ccc(C(=O)N[C@H](C)c3cccnc3)cc2[n-]c1=S	ZINC000102759849	209241254	/nfs/dbraw/zinc/24/12/54/209241254.db2.gz	SWWSMLCKYFTDAH-LLVKDONJSA-N	-1	0	354.435	2.591	50	0		FFAARM
O=c1cc(CSc2nnnn2-c2ccccc2)[n-]n1-c1ccc(F)cc1	ZINC000101443651	209226930	/nfs/dbraw/zinc/22/69/30/209226930.db2.gz	PPZLBRQAMDFXLO-UHFFFAOYSA-N	-1	0	368.397	2.985	50	0		FFAARM
CCc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccccc4F)c=3c2=O)cc1	ZINC000101167711	209221480	/nfs/dbraw/zinc/22/14/80/209221480.db2.gz	GGYYGYHGSJFWJT-DLBZAZTESA-N	-1	0	352.369	2.882	50	0		FFAARM
Cc1ccc(/C=C\C(=O)[N-]S(=O)(=O)c2ccc3c(c2)OCCO3)c(C)c1	ZINC000098054808	209203527	/nfs/dbraw/zinc/20/35/27/209203527.db2.gz	WODDHDIDTPTOBI-YVMONPNESA-N	-1	0	373.430	2.593	50	0		FFAARM
CC(C)n1c(Cc2ccc3c(c2)OCCCO3)nnc1SCC(=O)[O-]	ZINC000098086492	209204704	/nfs/dbraw/zinc/20/47/04/209204704.db2.gz	HKMLKTJJAVLHMU-UHFFFAOYSA-N	-1	0	363.439	2.788	50	0		FFAARM
CN(C(=O)OC(C)(C)C)[C@H](CCC(=O)OCc1ccccc1)C(=O)[O-]	ZINC000002541553	206920385	/nfs/dbraw/zinc/92/03/85/206920385.db2.gz	NEJPFSNBCOTZHN-CQSZACIVSA-N	-1	0	351.399	2.830	50	0		FFAARM
O=C([O-])[C@@H]1CCCC[C@@H]1C(=O)N1CCN(C/C=C/c2ccccc2)CC1	ZINC000004179204	207004336	/nfs/dbraw/zinc/00/43/36/207004336.db2.gz	JQBIIYXKEFVGST-YLXGYYMFSA-N	-1	0	356.466	2.735	50	0		FFAARM
COc1ccc(-n2c(=O)c3[n-][nH]n(Cc4cccc(Cl)c4)c=3c2=O)cc1	ZINC000004483527	207021230	/nfs/dbraw/zinc/02/12/30/207021230.db2.gz	ZISPBMLHLLCEMR-HZPDHXFCSA-N	-1	0	370.796	2.842	50	0		FFAARM
Cc1cccc(Cn2[nH][n-]c3c(=O)n(-c4ccc(F)c(F)c4)c(=O)c2=3)c1	ZINC000004483756	207020677	/nfs/dbraw/zinc/02/06/77/207020677.db2.gz	FOPMKNFNBXRFIQ-HOTGVXAUSA-N	-1	0	356.332	2.767	50	0		FFAARM
COc1ccc(CCNC(=O)[C@@H]2CC(C)=C(C)C[C@H]2C(=O)[O-])cc1OC	ZINC000004894538	207060593	/nfs/dbraw/zinc/06/05/93/207060593.db2.gz	UYOJBKFIFVXBNI-HZPDHXFCSA-N	-1	0	361.438	2.810	50	0		FFAARM
COc1ccc(Cl)cc1N(CC(=O)[O-])S(=O)(=O)c1ccc(C)cc1	ZINC000005415689	207099586	/nfs/dbraw/zinc/09/95/86/207099586.db2.gz	DCWODOWBOHYQMM-UHFFFAOYSA-N	-1	0	369.826	2.937	50	0		FFAARM
CCOc1ccccc1NC(=O)[C@@H](Cc1cccc(OC)c1)c1nnn[n-]1	ZINC000005444735	207100312	/nfs/dbraw/zinc/10/03/12/207100312.db2.gz	BJQQTHMTKBKFQR-HNNXBMFYSA-N	-1	0	367.409	2.572	50	0		FFAARM
CC1=C(C)C[C@H](C(=O)[O-])[C@H](C(=O)N2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000006699447	207154595	/nfs/dbraw/zinc/15/45/95/207154595.db2.gz	BIWKGQZHLMGLGB-MOPGFXCFSA-N	-1	0	374.456	2.917	50	0		FFAARM
O=C([O-])[C@@H]1CC=CC[C@@H]1C(=O)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000006726761	207157030	/nfs/dbraw/zinc/15/70/30/207157030.db2.gz	CMRMAQFDMFBWPC-DLBZAZTESA-N	-1	0	362.857	2.651	50	0		FFAARM
CSc1nsc(SCC(=O)Nc2cc(C(=O)[O-])ccc2C)n1	ZINC000006719858	207157849	/nfs/dbraw/zinc/15/78/49/207157849.db2.gz	BQRJSSJPAIRXOK-UHFFFAOYSA-N	-1	0	355.466	2.997	50	0		FFAARM
Cc1cc(=O)[nH]c(SCC(=O)Nc2ccc(C(=O)[O-])c(Cl)c2)n1	ZINC000009058585	207255712	/nfs/dbraw/zinc/25/57/12/207255712.db2.gz	CZZDDQKASFSNLA-UHFFFAOYSA-N	-1	0	353.787	2.573	50	0		FFAARM
CN(Cc1nc(=O)c2sccc2[n-]1)C(=O)c1cccc(OC(F)F)c1	ZINC000010720916	207304818	/nfs/dbraw/zinc/30/48/18/207304818.db2.gz	YBNQLAJPLVIVAO-UHFFFAOYSA-N	-1	0	365.361	2.858	50	0		FFAARM
COC(=O)c1ccc(S(=O)(=O)[N-]c2cnc(-c3ccccc3)nc2)cc1	ZINC000012560854	207393897	/nfs/dbraw/zinc/39/38/97/207393897.db2.gz	HLCADSYDWBNYNQ-UHFFFAOYSA-N	-1	0	369.402	2.731	50	0		FFAARM
C[C@H](CC(=O)[O-])CC(=O)Nc1sc2c(c1C(=O)NC1CC1)CCC2	ZINC000017072715	207605461	/nfs/dbraw/zinc/60/54/61/207605461.db2.gz	ITLXCYKHGQFXJE-VIFPVBQESA-N	-1	0	350.440	2.568	50	0		FFAARM
O=C([O-])Cc1ccc(N[C@@H]2CC(=O)N(Cc3ccc(Cl)cc3)C2=O)cc1	ZINC000025665213	207901784	/nfs/dbraw/zinc/90/17/84/207901784.db2.gz	DQDOTRUBXUCWCL-MRXNPFEDSA-N	-1	0	372.808	2.707	50	0		FFAARM
O=c1c2[n-][nH]n(-c3cccc(F)c3)c=2c(=O)n1-c1ccc2c(c1)CCC2	ZINC000033114683	208073074	/nfs/dbraw/zinc/07/30/74/208073074.db2.gz	KWFFTOLQYSTKOC-IAGOWNOFSA-N	-1	0	350.353	2.812	50	0		FFAARM
O=C([O-])/C=C\C(=O)Nc1ccc(OC(F)(F)F)cc1Br	ZINC000033365105	208089358	/nfs/dbraw/zinc/08/93/58/208089358.db2.gz	VUCSNNWLBWXPPJ-ARJAWSKDSA-N	-1	0	354.078	2.927	50	0		FFAARM
CC(=O)N1N=C(c2ccc3c(c2)OCO3)C[C@H]1c1ccc(C(=O)[O-])cc1	ZINC000035655302	208133229	/nfs/dbraw/zinc/13/32/29/208133229.db2.gz	WVSWNNRGSPHBMB-INIZCTEOSA-N	-1	0	352.346	2.811	50	0		FFAARM
CC[C@@H](C)Oc1cccc(-c2nnc(CCC(=O)NC(C)C)c(=O)[n-]2)c1	ZINC000034764922	208110278	/nfs/dbraw/zinc/11/02/78/208110278.db2.gz	BDLGZYBSFQUNHN-CYBMUJFWSA-N	-1	0	358.442	2.879	50	0		FFAARM
CN(CCc1noc(-c2ccc(C(=O)[O-])cc2)n1)C(=O)c1ccc(F)cc1	ZINC000034927212	208116910	/nfs/dbraw/zinc/11/69/10/208116910.db2.gz	RYMRDWRTIULIBA-UHFFFAOYSA-N	-1	0	369.352	2.889	50	0		FFAARM
O=C([O-])c1ccccc1NC(=O)N1CCc2[nH]cnc2[C@@H]1c1ccncc1	ZINC000040309475	208175833	/nfs/dbraw/zinc/17/58/33/208175833.db2.gz	NJNKALKLBBBNRS-KRWDZBQOSA-N	-1	0	363.377	2.683	50	0	biogenic	FFAARM
O=C([O-])c1ccccc1NC(=O)N1CCc2[nH]cnc2[C@H]1c1cccnc1	ZINC000040309825	208176119	/nfs/dbraw/zinc/17/61/19/208176119.db2.gz	QVMVXSYMQSGJHO-QGZVFWFLSA-N	-1	0	363.377	2.683	50	0	biogenic	FFAARM
O=C(Nc1cccc(Cn2[n-]c(=O)ccc2=O)c1)c1cc(F)cc(F)c1	ZINC000040152463	208237458	/nfs/dbraw/zinc/23/74/58/208237458.db2.gz	UFWRDHCXQZFYLC-UHFFFAOYSA-N	-1	0	357.316	2.528	50	0		FFAARM
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)[N-]OCc1ccccc1	ZINC000043936947	208309627	/nfs/dbraw/zinc/30/96/27/208309627.db2.gz	XNDRFJMBZVXYNJ-AWEZNQCLSA-N	-1	0	354.472	2.881	50	0		FFAARM
Cc1cccc(S(=O)(=O)[N-]C(=O)c2cc(Cl)c3c(c2)OCCO3)c1	ZINC000042313421	208290342	/nfs/dbraw/zinc/29/03/42/208290342.db2.gz	LDJMMMTWSAAUQM-UHFFFAOYSA-N	-1	0	367.810	2.538	50	0		FFAARM
O=C([O-])[C@@H]1CCCN1C(=O)c1ccc(-n2ccc(C(F)(F)F)n2)cc1	ZINC000299746002	208341969	/nfs/dbraw/zinc/34/19/69/208341969.db2.gz	UQWHPWJNBARZFN-LBPRGKRZSA-N	-1	0	353.300	2.580	50	0		FFAARM
O=C([O-])[C@@H]1Cc2ccccc2CN1C(=O)c1cc(=O)[nH]c2cc(F)ccc21	ZINC000299749199	208354243	/nfs/dbraw/zinc/35/42/43/208354243.db2.gz	JKRWVCTYEIWPBB-KRWDZBQOSA-N	-1	0	366.348	2.731	50	0		FFAARM
COc1ccc(CNC(=O)C[C@H]2CCOc3ccccc32)cc1C(=O)[O-]	ZINC000299750377	208355199	/nfs/dbraw/zinc/35/51/99/208355199.db2.gz	NHOPNVPRJXDQIX-CQSZACIVSA-N	-1	0	355.390	2.966	50	0		FFAARM
CCOC(=O)CN(C)c1ccc(NC(=O)c2ccccc2F)cc1C(=O)[O-]	ZINC000046053502	208356858	/nfs/dbraw/zinc/35/68/58/208356858.db2.gz	CPWDIAWWZIVRSN-UHFFFAOYSA-N	-1	0	374.368	2.776	50	0		FFAARM
CCc1nc2sc(C)nn2c1S(=O)(=O)[N-]c1ccc(F)cc1F	ZINC000065183906	208639696	/nfs/dbraw/zinc/63/96/96/208639696.db2.gz	MIEYSSCLQUTJJR-UHFFFAOYSA-N	-1	0	358.395	2.741	50	0		FFAARM
O=C(Nc1ccccc1)c1c(=O)[nH]c2c(cnn2Cc2ccccc2)c1[O-]	ZINC000065249847	208652813	/nfs/dbraw/zinc/65/28/13/208652813.db2.gz	JTKFJHSWYKDQJK-UHFFFAOYSA-N	-1	0	360.373	2.731	50	0		FFAARM
CC[C@@H](C(=O)N1CCC(Oc2ccccc2)(C(=O)[O-])CC1)n1cccc1	ZINC000072474838	208872069	/nfs/dbraw/zinc/87/20/69/208872069.db2.gz	PHNJOVAFMYFBCV-KRWDZBQOSA-N	-1	0	356.422	2.964	50	0		FFAARM
COC[C@](C)(CC(=O)[O-])NC(=O)CSCc1nc2ccccc2s1	ZINC000095989853	209093526	/nfs/dbraw/zinc/09/35/26/209093526.db2.gz	XJXPGSOKOZILKQ-INIZCTEOSA-N	-1	0	368.480	2.526	50	0		FFAARM
CCC[C@]1(C(=O)[O-])CCCN(C(=O)c2ccc(SCCO)cc2)C1	ZINC000091986919	209010059	/nfs/dbraw/zinc/01/00/59/209010059.db2.gz	HXKXXXQEZURMPC-SFHVURJKSA-N	-1	0	351.468	2.878	50	0		FFAARM
CCc1cc(C(=O)N2CCC[C@H](c3cccc(C(=O)[O-])c3)C2)cc(=O)[nH]1	ZINC000095392696	209047175	/nfs/dbraw/zinc/04/71/75/209047175.db2.gz	BVVVZZWSCNTHKD-HNNXBMFYSA-N	-1	0	354.406	2.655	50	0		FFAARM
Cc1ccc(Cl)c(CN2CCC3(CC2)[C@H](C(=O)[O-])CC(=O)N3C)c1F	ZINC000095391114	209047776	/nfs/dbraw/zinc/04/77/76/209047776.db2.gz	BXZXNVHBVWMARS-ZDUSSCGKSA-N	-1	0	368.836	2.685	50	0		FFAARM
Cc1cc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)[O-])nn1C(C)(C)C	ZINC000095424578	209049018	/nfs/dbraw/zinc/04/90/18/209049018.db2.gz	RYHIIRJQJXWPSL-KRWDZBQOSA-N	-1	0	368.437	2.854	50	0		FFAARM
Cc1nn(C)c(C)c1[C@H](C)C(=O)N(Cc1ccccc1)C[C@@H](C)C(=O)[O-]	ZINC000095424405	209049921	/nfs/dbraw/zinc/04/99/21/209049921.db2.gz	MQWKLUHZLZPLDS-KGLIPLIRSA-N	-1	0	357.454	2.890	50	0		FFAARM
Cc1c(Cl)cc(C(=O)N2Cc3nc[nH]c3C[C@H]2C(=O)[O-])cc1Cl	ZINC000095496584	209059260	/nfs/dbraw/zinc/05/92/60/209059260.db2.gz	QMWGUSQJWMDRLS-ZDUSSCGKSA-N	-1	0	354.193	2.677	50	0		FFAARM
COc1ccc2c(C)c(C(=O)N[C@@H](Cc3ccc(O)cc3)C(=O)[O-])oc2c1	ZINC000095499396	209061019	/nfs/dbraw/zinc/06/10/19/209061019.db2.gz	AVCORLRRATWRAD-INIZCTEOSA-N	-1	0	369.373	2.881	50	0		FFAARM
O=C([O-])COc1cccc(NC(=O)c2ccccc2OC[C@H]2CCCO2)c1	ZINC000095956942	209089282	/nfs/dbraw/zinc/08/92/82/209089282.db2.gz	MDKBLUUSWVSUEZ-MRXNPFEDSA-N	-1	0	371.389	2.960	50	0		FFAARM
CC(NCc1ccc(F)cc1)=C1C(=O)[N-]C(=O)N(c2ccc(C)cc2)C1=O	ZINC000100647309	533417177	/nfs/dbraw/zinc/41/71/77/533417177.db2.gz	HJOKZENWGZDNOR-GHRIWEEISA-N	-1	0	367.380	2.781	50	0		FFAARM
Cc1cc(N2CCC[C@]3(CN(C)C(=O)O3)C2)nc(-c2ccccc2[O-])n1	ZINC000091289095	132200615	/nfs/dbraw/zinc/20/06/15/132200615.db2.gz	RVJNJWHXSYYGAI-IBGZPJMESA-N	-1	0	354.410	2.579	50	0		FFAARM
O=C([O-])[C@@H](c1cccc2c1OCC2)N1CCN(c2ccc(Cl)cn2)CC1	ZINC000095501377	132212343	/nfs/dbraw/zinc/21/23/43/132212343.db2.gz	ZHUORBAGRUFYHL-QGZVFWFLSA-N	-1	0	373.840	2.618	50	0		FFAARM
C[C@H](Nc1ncc(C(C)(C)C(=O)[O-])c(N2CCOCC2)n1)c1ccccc1	ZINC000096159715	132221322	/nfs/dbraw/zinc/22/13/22/132221322.db2.gz	OLKFMLOXABJPCU-AWEZNQCLSA-N	-1	0	370.453	2.849	50	0		FFAARM
O=C([O-])c1cc2c(nc1N1CCC(OCc3cccnc3)CC1)CCC2	ZINC000096179733	132221875	/nfs/dbraw/zinc/22/18/75/132221875.db2.gz	ZFSXSDHBMGLKOQ-UHFFFAOYSA-N	-1	0	353.422	2.849	50	0		FFAARM
O=C([O-])CC[C@@H]1CCCCN1C(=O)CCN1C(=O)CCc2ccccc21	ZINC000237922688	132248584	/nfs/dbraw/zinc/24/85/84/132248584.db2.gz	RMNXSSJQVUYMKU-INIZCTEOSA-N	-1	0	358.438	2.602	50	0		FFAARM
O=C([O-])c1ccccc1CC(=O)N1CCN(c2ccc(Cl)cc2)CC1	ZINC000072401542	132377725	/nfs/dbraw/zinc/37/77/25/132377725.db2.gz	VBYPMAMZPXHRTA-UHFFFAOYSA-N	-1	0	358.825	2.930	50	0		FFAARM
Cc1n[nH]c(C)c1[C@H](NC(=O)c1csc(Cc2ccccc2)n1)C(=O)[O-]	ZINC000095523889	209074357	/nfs/dbraw/zinc/07/43/57/209074357.db2.gz	LBRBSUFZFLAYMT-INIZCTEOSA-N	-1	0	370.434	2.630	50	0		FFAARM
COc1ccc(/C=C/C(=O)NC(=S)Nc2ccc(C(=O)[O-])cc2)cc1	ZINC000001159897	263143443	/nfs/dbraw/zinc/14/34/43/263143443.db2.gz	OXPUWPKKVUOOJN-NYYWCZLTSA-N	-1	0	356.403	2.920	50	0	aggregator	FFAARM
CSc1ccccc1C(=O)N1CCC[C@H](c2ccn(CC(=O)[O-])n2)C1	ZINC000426434821	263591028	/nfs/dbraw/zinc/59/10/28/263591028.db2.gz	HQBNLFWRNUWZRU-ZDUSSCGKSA-N	-1	0	359.451	2.709	50	0		FFAARM
O=C([O-])[C@@H]1CCCC[C@H]1C(=O)N1CCN(c2ccc(Cl)cc2)CC1	ZINC000000031434	506224428	/nfs/dbraw/zinc/22/44/28/506224428.db2.gz	PRUPQCIQHAZBHA-HZPDHXFCSA-N	-1	0	350.846	2.880	50	0		FFAARM
Cc1ccccc1[N-]S(=O)(=O)c1cc(S(C)(=O)=O)ccc1Cl	ZINC000000643438	506226883	/nfs/dbraw/zinc/22/68/83/506226883.db2.gz	PURLWFBURWHKBN-UHFFFAOYSA-N	-1	0	359.856	2.853	50	0		FFAARM
CC[C@@H](C)C(=O)Nc1ccc(S(=O)(=O)[N-]c2nc(C)cc(C)n2)cc1	ZINC000000683175	506227934	/nfs/dbraw/zinc/22/79/34/506227934.db2.gz	DYNVIZZDKCBNBC-LLVKDONJSA-N	-1	0	362.455	2.879	50	0		FFAARM
O=C1[N-]N(c2ccc(Br)cc2)C(=O)/C1=C/c1ccc(O)cc1	ZINC000000725162	506230093	/nfs/dbraw/zinc/23/00/93/506230093.db2.gz	PBWCUPGEZOQYSN-NTEUORMPSA-N	-1	0	359.179	2.616	50	0		FFAARM
Cc1nn(-c2ccc(F)cc2)c(C)c1S(=O)(=O)[N-]c1ccc(C)cn1	ZINC000064946980	506242279	/nfs/dbraw/zinc/24/22/79/506242279.db2.gz	TXFRJYLJSUJWGG-UHFFFAOYSA-N	-1	0	360.414	3.132	50	0		FFAARM
COc1ccc(S(=O)(=O)[N-]c2cc(-c3ccccc3)nn2C)cc1OC	ZINC000001034675	506243647	/nfs/dbraw/zinc/24/36/47/506243647.db2.gz	RWIUOADIIBGUNZ-UHFFFAOYSA-N	-1	0	373.434	2.905	50	0		FFAARM
COC(=O)c1csc(S(=O)(=O)[N-]c2ccc(Cl)cc2)c1OC	ZINC000001039316	506245456	/nfs/dbraw/zinc/24/54/56/506245456.db2.gz	SNMYFEBRQVOMLZ-UHFFFAOYSA-N	-1	0	361.828	2.998	50	0		FFAARM
Cc1cccc([N-]S(=O)(=O)c2cc(-c3ccc(=O)n(C)n3)cs2)c1	ZINC000065128969	506264281	/nfs/dbraw/zinc/26/42/81/506264281.db2.gz	FCSQKVNVNQDQAJ-UHFFFAOYSA-N	-1	0	361.448	2.618	50	0		FFAARM
CCOC(=O)c1cccc(NC(=O)c2c(=O)[nH]c3ccsc3c2[O-])c1	ZINC000065215251	506269504	/nfs/dbraw/zinc/26/95/04/506269504.db2.gz	AWEPGPYFVLSNOJ-UHFFFAOYSA-N	-1	0	358.375	2.724	50	0		FFAARM
O=C([O-])COc1ccccc1C=NN1C(=S)N=NC1c1ccccc1	ZINC000002212310	506274100	/nfs/dbraw/zinc/27/41/00/506274100.db2.gz	HLOSHADYHWSPDM-UHFFFAOYSA-N	-1	0	354.391	2.579	50	0		FFAARM
CC(C)(C)OC(=O)N[C@@H](CCC(=O)OCc1ccccc1)CC(=O)[O-]	ZINC000002386866	506278543	/nfs/dbraw/zinc/27/85/43/506278543.db2.gz	JABNOCWCLLYHKE-AWEZNQCLSA-N	-1	0	351.399	2.878	50	0		FFAARM
COC(=O)c1ccc2c(c1)[n-]c(=S)n(Cc1ccccc1OC)c2=O	ZINC000002346017	506278787	/nfs/dbraw/zinc/27/87/87/506278787.db2.gz	LJZDEHAONPEPHT-UHFFFAOYSA-N	-1	0	356.403	2.529	50	0		FFAARM
O=S(=O)([N-]c1ncn(Cc2cccc(F)c2)n1)c1ccc(Cl)cc1	ZINC000002779231	506291444	/nfs/dbraw/zinc/29/14/44/506291444.db2.gz	OCFQOOSAKQDDJX-UHFFFAOYSA-N	-1	0	366.805	2.920	50	0		FFAARM
Cc1cc(-n2c(SCC(=O)[O-])nnc2-c2ccccc2Cl)n(C)n1	ZINC000065385871	506293266	/nfs/dbraw/zinc/29/32/66/506293266.db2.gz	MAHSRWGIYDXCHH-UHFFFAOYSA-N	-1	0	363.830	2.806	50	0		FFAARM
CCn1cc(S(=O)(=O)[N-]c2cnn(Cc3ccc(Cl)cc3)c2)cn1	ZINC000002804532	506294452	/nfs/dbraw/zinc/29/44/52/506294452.db2.gz	IFYDYPFLGAQCST-UHFFFAOYSA-N	-1	0	365.846	2.602	50	0		FFAARM
O=C([O-])[C@H]1CCCC[C@H]1C(=O)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000002808339	506295293	/nfs/dbraw/zinc/29/52/93/506295293.db2.gz	JZTMKWZSWJLPMC-SJORKVTESA-N	-1	0	364.873	2.875	50	0		FFAARM
COCCn1c(=O)c2ccc(C(=O)N3CCCCCC3)cc2[n-]c1=S	ZINC000003043490	506307039	/nfs/dbraw/zinc/30/70/39/506307039.db2.gz	AWCJETZWUKCGQJ-UHFFFAOYSA-N	-1	0	361.467	2.722	50	0		FFAARM
COc1ccc([C@@H]2N[C@@H](C(=O)[O-])CS2)cc1COCC(F)(F)F	ZINC000003013659	506307660	/nfs/dbraw/zinc/30/76/60/506307660.db2.gz	ROVUMDZPGHDPPQ-ZYHUDNBSSA-N	-1	0	351.346	2.562	50	0		FFAARM
O=C([C@H]1CC(c2ccccc2)=NO1)N1CCC(c2n[n-]c(=S)o2)CC1	ZINC000065575782	506325550	/nfs/dbraw/zinc/32/55/50/506325550.db2.gz	ITHQWINXLDNUON-CQSZACIVSA-N	-1	0	358.423	2.631	50	0		FFAARM
O=C([O-])/C=C/C(=O)Nc1ccc(N2CCN(c3ccccc3)CC2)cc1	ZINC000033330670	506355528	/nfs/dbraw/zinc/35/55/28/506355528.db2.gz	LXHPGFPZBRNHJB-ZHACJKMWSA-N	-1	0	351.406	2.593	50	0		FFAARM
CCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C(=O)[O-])[C@@H](C)CC	ZINC000004760624	506393265	/nfs/dbraw/zinc/39/32/65/506393265.db2.gz	IYVYOUHROQHPGA-BPUTZDHNSA-N	-1	0	364.442	2.697	50	0		FFAARM
CCC[C@H](NC(=O)[C@H](NC(=O)OCc1ccccc1)[C@@H](C)CC)C(=O)[O-]	ZINC000004761916	506393320	/nfs/dbraw/zinc/39/33/20/506393320.db2.gz	PROMKSSJWWAGTP-CWRNSKLLSA-N	-1	0	364.442	2.697	50	0		FFAARM
O=C(c1c([O-])cc(F)cc1F)N1CCC(n2c(=O)[nH]c3ccccc32)CC1	ZINC000066042678	506414282	/nfs/dbraw/zinc/41/42/82/506414282.db2.gz	JUZCNYJHRNWWSJ-UHFFFAOYSA-N	-1	0	373.359	2.791	50	0		FFAARM
O=C(CC1CCN(C(=O)c2c([O-])cc(F)cc2F)CC1)N1CCCC1	ZINC000066046468	506416525	/nfs/dbraw/zinc/41/65/25/506416525.db2.gz	IRPRZJYVYRAIIN-UHFFFAOYSA-N	-1	0	352.381	2.535	50	0		FFAARM
Cc1cccc(CSc2nc(N)c(NC(=O)c3ccco3)c(=O)[n-]2)c1	ZINC000006309501	506475687	/nfs/dbraw/zinc/47/56/87/506475687.db2.gz	ZTCOLNXGCOIXTM-UHFFFAOYSA-N	-1	0	356.407	2.798	50	0		FFAARM
CSc1cccc([N-]S(=O)(=O)c2cc(Br)cnc2N)c1	ZINC000006778104	506505859	/nfs/dbraw/zinc/50/58/59/506505859.db2.gz	STNUQTOMTJUIKX-UHFFFAOYSA-N	-1	0	374.285	2.949	50	0		FFAARM
CC(C)c1ccc([N-]S(=O)(=O)c2ccc(-c3ccc(=O)[nH]n3)o2)cc1	ZINC000006887553	506513013	/nfs/dbraw/zinc/51/30/13/506513013.db2.gz	JRNMHUIEHBOESB-UHFFFAOYSA-N	-1	0	359.407	2.954	50	0		FFAARM
COc1ccccc1OCC(=O)Nc1cc2c(cc1C(=O)[O-])OCCCO2	ZINC000008132242	506625333	/nfs/dbraw/zinc/62/53/33/506625333.db2.gz	LHXAUTNRUCCGDE-UHFFFAOYSA-N	-1	0	373.361	2.572	50	0		FFAARM
Cc1ccc(N2C(=O)[N-]C(=O)[C@@]3(Cc4cc(C)ccc4N(C)C3)C2=O)cc1	ZINC000009357421	506692901	/nfs/dbraw/zinc/69/29/01/506692901.db2.gz	ZJFHMZNLEKRTFC-NRFANRHFSA-N	-1	0	363.417	2.565	50	0		FFAARM
COc1ccc(C(C)(C)C)cc1[N-]S(=O)(=O)c1ccc(C(N)=O)cc1	ZINC000009515840	506700979	/nfs/dbraw/zinc/70/09/79/506700979.db2.gz	BMGPLNUDBPGIPI-UHFFFAOYSA-N	-1	0	362.451	2.892	50	0		FFAARM
Cc1cc(=O)c(C(=O)[N-]OCc2ccccc2)nn1-c1ccccc1F	ZINC000010319168	506737604	/nfs/dbraw/zinc/73/76/04/506737604.db2.gz	KEKQZKSUJUPDKL-UHFFFAOYSA-N	-1	0	353.353	2.542	50	0		FFAARM
O=S(=O)([N-]c1cccc(-c2nnnn2C2CC2)c1)c1ccccc1F	ZINC000010657300	506750234	/nfs/dbraw/zinc/75/02/34/506750234.db2.gz	JOYJHLXUDQJBGL-UHFFFAOYSA-N	-1	0	359.386	2.615	50	0		FFAARM
COc1ccc(/C=C/C(=O)[O-])cc1S(=O)(=O)N(C)c1ccc(F)cc1	ZINC000055651231	506814301	/nfs/dbraw/zinc/81/43/01/506814301.db2.gz	HMDBLAONMATSGO-ONNFQVAWSA-N	-1	0	365.382	2.757	50	0		FFAARM
Cc1noc(C)c1S(=O)(=O)[N-]c1cccc(NC(=O)c2ccco2)c1	ZINC000012508055	506870486	/nfs/dbraw/zinc/87/04/86/506870486.db2.gz	AUGUMMGHXONVNQ-UHFFFAOYSA-N	-1	0	361.379	2.938	50	0		FFAARM
CN(C)C(=O)c1ccc(NC(=O)[C@H]2CC=CC[C@H]2C(=O)[O-])cc1Cl	ZINC000067456647	506886642	/nfs/dbraw/zinc/88/66/42/506886642.db2.gz	CXWODBOEGWUBHB-NWDGAFQWSA-N	-1	0	350.802	2.647	50	0		FFAARM
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)[C@H]1CC=CC[C@@H]1C(=O)[O-]	ZINC000012649147	506887113	/nfs/dbraw/zinc/88/71/13/506887113.db2.gz	CEVDAKZMDQZIES-IRXDYDNUSA-N	-1	0	353.422	2.772	50	0		FFAARM
[O-]c1ccccc1-c1nc2ccccc2c(NCCN2CCOCC2)n1	ZINC000013127593	506928856	/nfs/dbraw/zinc/92/88/56/506928856.db2.gz	XVAZSZOISVGIDR-UHFFFAOYSA-N	-1	0	350.422	2.747	50	0		FFAARM
O=C(CSC1=NC(=O)C(c2ccccc2)C([O-])=N1)N1CCCCCC1	ZINC000013453945	506941673	/nfs/dbraw/zinc/94/16/73/506941673.db2.gz	YOTPCOKCKXZNBT-UHFFFAOYSA-N	-1	0	359.451	2.637	50	0		FFAARM
COc1ccc(CN2CCN(c3nc4ccccc4o3)CC2)cc1C(=O)[O-]	ZINC000067783664	507008190	/nfs/dbraw/zinc/00/81/90/507008190.db2.gz	BIOYVJYXHQDANU-UHFFFAOYSA-N	-1	0	367.405	2.857	50	0		FFAARM
CCCc1cc(C(N)=O)c(NC(=O)[C@@H]2C3CCC(CC3)[C@H]2C(=O)[O-])s1	ZINC000017074935	507114492	/nfs/dbraw/zinc/11/44/92/507114492.db2.gz	FXFNZVXJGPCMNV-TWZWYRAHSA-N	-1	0	364.467	2.875	50	0		FFAARM
COc1ccc(Cl)cc1[N-]S(=O)(=O)c1cccc(C(=O)N(C)C)c1	ZINC000017395803	507125063	/nfs/dbraw/zinc/12/50/63/507125063.db2.gz	LYWMEYXXECBINK-UHFFFAOYSA-N	-1	0	368.842	2.851	50	0		FFAARM
COc1ccc(CCNC(=O)[C@@]2(C)CC[C@@H](C(=O)[O-])C2(C)C)cc1OC	ZINC000018191965	507145357	/nfs/dbraw/zinc/14/53/57/507145357.db2.gz	SFNLISZDERIUTH-VBKZILBWSA-N	-1	0	363.454	2.890	50	0		FFAARM
O=C([O-])c1ccccc1S[C@@H]1CC(=O)N(CCc2ccccc2)C1=O	ZINC000019881466	507206280	/nfs/dbraw/zinc/20/62/80/507206280.db2.gz	GTRIENYMHDKNML-MRXNPFEDSA-N	-1	0	355.415	2.847	50	0		FFAARM
Cc1noc(C)c1CN1CCN([C@@H](C(=O)[O-])c2c[nH]c3ccccc32)CC1	ZINC000020745894	507232748	/nfs/dbraw/zinc/23/27/48/507232748.db2.gz	JGLBBFXSCBEJIM-LJQANCHMSA-N	-1	0	368.437	2.716	50	0		FFAARM
CC(=O)NC1=NN(C(C)=O)[C@H](c2ccc(-c3cccc(C(=O)[O-])c3)o2)S1	ZINC000020895470	507237441	/nfs/dbraw/zinc/23/74/41/507237441.db2.gz	URHKYMLMDQGRCF-HNNXBMFYSA-N	-1	0	373.390	2.646	50	0		FFAARM
Cc1nc2sc([C@H](c3ccccc3Cl)N3CCOCC3)c([O-])n2n1	ZINC000022626655	507301869	/nfs/dbraw/zinc/30/18/69/507301869.db2.gz	ADMCWHAABMWCHC-ZDUSSCGKSA-N	-1	0	364.858	2.880	50	0		FFAARM
Cc1nc2sc([C@@H](c3ccc(Cl)cc3)N3CCOCC3)c([O-])n2n1	ZINC000023156956	507334841	/nfs/dbraw/zinc/33/48/41/507334841.db2.gz	PWUZSMRXWXHJHZ-CYBMUJFWSA-N	-1	0	364.858	2.880	50	0		FFAARM
COc1ccc(NC(=O)c2ccco2)cc1NC(=O)[C@H]1[C@@H](C(=O)[O-])C1(C)C	ZINC000071280255	507698287	/nfs/dbraw/zinc/69/82/87/507698287.db2.gz	GAPPSYFMDMHCDV-CABCVRRESA-N	-1	0	372.377	2.836	50	0		FFAARM
CC1(C)[C@@H](C(=O)[O-])[C@@H]1C(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1	ZINC000071288308	507700783	/nfs/dbraw/zinc/70/07/83/507700783.db2.gz	RTRMKBSREUZDMA-CHWSQXEVSA-N	-1	0	350.802	2.528	50	0		FFAARM
COc1ccc([C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C(=O)[O-])cc1OC	ZINC000071795176	507716086	/nfs/dbraw/zinc/71/60/86/507716086.db2.gz	FTEPFXQWKWVIIJ-OLZOCXBDSA-N	-1	0	351.399	2.739	50	0		FFAARM
Cc1nccn1CCCC(=O)N1CC[C@H](Cc2cccc(C(=O)[O-])c2)C1	ZINC000072137219	507754525	/nfs/dbraw/zinc/75/45/25/507754525.db2.gz	UYGFYDRPWHSJLV-QGZVFWFLSA-N	-1	0	355.438	2.761	50	0		FFAARM
Cc1c(Cl)c(C(=O)N2CC[C@@H](Cc3cccc(C(=O)[O-])c3)C2)nn1C	ZINC000072152482	507761695	/nfs/dbraw/zinc/76/16/95/507761695.db2.gz	YXBNCRNDXXSQRQ-ZDUSSCGKSA-N	-1	0	361.829	2.785	50	0		FFAARM
COc1ccc(OC)c(CC(=O)N2CC[C@H](c3ccccc3C(=O)[O-])C2)c1	ZINC000072169394	507769257	/nfs/dbraw/zinc/76/92/57/507769257.db2.gz	CMGRYQAYHBPYRP-AWEZNQCLSA-N	-1	0	369.417	2.961	50	0		FFAARM
Cc1nc(C)c(S(=O)(=O)[N-]c2cccc(NC(=O)C3CC3)c2)s1	ZINC000072313017	507775392	/nfs/dbraw/zinc/77/53/92/507775392.db2.gz	MEYUOSLKLDNNDD-UHFFFAOYSA-N	-1	0	351.453	2.909	50	0		FFAARM
CC[C@H](C)N(Cc1ccsc1)C(=O)Cc1nn2c([n-]1)nc(C)cc2=O	ZINC000063848385	507775743	/nfs/dbraw/zinc/77/57/43/507775743.db2.gz	RNJCHCUIOQLIKO-LBPRGKRZSA-N	-1	0	359.455	2.570	50	0		FFAARM
O=C([O-])[C@]1(O)[C@H](c2ccccc2)[C@@H](c2ccc(Cl)cc2)Nc2ncnn21	ZINC000072332371	507776875	/nfs/dbraw/zinc/77/68/75/507776875.db2.gz	HIQAZQFVSMOXKR-IIDMSEBBSA-N	-1	0	370.796	2.612	50	0		FFAARM
CCOC(=O)C[C@@H](c1c(C)nn(C)c1C)c1c(=O)[nH]c2ccccc2c1[O-]	ZINC000072403490	507782896	/nfs/dbraw/zinc/78/28/96/507782896.db2.gz	UEOVFMIQDAFWLX-AWEZNQCLSA-N	-1	0	369.421	2.669	50	0		FFAARM
CCOC(=O)C[C@H](c1c(C)nn(C)c1C)c1c(=O)[nH]c2ccccc2c1[O-]	ZINC000072403491	507782987	/nfs/dbraw/zinc/78/29/87/507782987.db2.gz	UEOVFMIQDAFWLX-CQSZACIVSA-N	-1	0	369.421	2.669	50	0		FFAARM
O=C([O-])[C@H]1c2[nH]cnc2CCN1Cc1ccc(OCc2ccccn2)cc1	ZINC000072440334	507792547	/nfs/dbraw/zinc/79/25/47/507792547.db2.gz	IFSBUZXKOBWXLK-LJQANCHMSA-N	-1	0	364.405	2.568	50	0		FFAARM
O=C([O-])[C@@H](NC(=O)c1nc(C2CC2)n(-c2ccccc2)n1)c1ccccc1	ZINC000089825889	507871450	/nfs/dbraw/zinc/87/14/50/507871450.db2.gz	ARIWZPMPSQRXNG-INIZCTEOSA-N	-1	0	362.389	2.700	50	0		FFAARM
CC1(C)Cc2c(cnn2-c2cccc(F)c2)[C@H](NC(=O)c2cc(=O)[nH][n-]2)C1	ZINC000091435226	507985443	/nfs/dbraw/zinc/98/54/43/507985443.db2.gz	JFHLUDCYOUYIOJ-OAHLLOKOSA-N	-1	0	369.400	2.884	50	0		FFAARM
Cc1ccccc1[C@@H]1CN(C(=O)c2cccc3nccnc32)C[C@H]1C(=O)[O-]	ZINC000091518822	507990558	/nfs/dbraw/zinc/99/05/58/507990558.db2.gz	URTSRWQXMYDVRU-DLBZAZTESA-N	-1	0	361.401	2.879	50	0		FFAARM
COc1ccc(/C=C\C(=O)[O-])cc1S(=O)(=O)N1c2ccccc2C[C@@H]1C	ZINC000096297661	508212937	/nfs/dbraw/zinc/21/29/37/508212937.db2.gz	BYEISBXPTKAUKC-KJJQSCHISA-N	-1	0	373.430	2.933	50	0		FFAARM
CC(C)c1noc([C@H]2CCCN2C(=O)c2cc(=O)n(-c3ccccc3)[n-]2)n1	ZINC000077386011	508309123	/nfs/dbraw/zinc/30/91/23/508309123.db2.gz	SSKMATJXCIONBV-OAHLLOKOSA-N	-1	0	367.409	2.649	50	0		FFAARM
COc1ccccc1[C@@H](C1=C([O-])COC1=O)c1cc2c(cc1O)OCO2	ZINC000106381079	508399955	/nfs/dbraw/zinc/39/99/55/508399955.db2.gz	MPOBHAWPVCZVFX-QGZVFWFLSA-N	-1	0	356.330	2.630	50	0		FFAARM
Cc1ccc(S(=O)(=O)[N-]c2cc(CN3CCOCC3)ccc2C)s1	ZINC000127328109	508432673	/nfs/dbraw/zinc/43/26/73/508432673.db2.gz	CXYMLSRCCPTGEV-UHFFFAOYSA-N	-1	0	366.508	2.998	50	0		FFAARM
O=C(N[C@H]1CCO[C@]2(CCSC2)C1)c1ccc2[n-]c(=S)oc2c1	ZINC000157438398	508566405	/nfs/dbraw/zinc/56/64/05/508566405.db2.gz	ZNWKKRSHXMEFKM-MEDUHNTESA-N	-1	0	350.465	2.901	50	0		FFAARM
O=C(c1c([O-])cccc1F)N1CCC[C@H](c2nnc3n2CCCCC3)C1	ZINC000119615700	508829298	/nfs/dbraw/zinc/82/92/98/508829298.db2.gz	KGNGNAMNMDLIAJ-ZDUSSCGKSA-N	-1	0	358.417	2.869	50	0		FFAARM
CC(C)(C)O[N-]C(=O)[C@@H]1CCCN1C(=O)c1ccc2ccccc2c1O	ZINC000156022786	509112076	/nfs/dbraw/zinc/11/20/76/509112076.db2.gz	CXSNVUGMDVUCLA-INIZCTEOSA-N	-1	0	356.422	2.996	50	0		FFAARM
Cc1nc(C2CCCC2)sc1C(=O)Nc1ccc(-n2nn[n-]c2=O)cc1	ZINC000188786189	509263567	/nfs/dbraw/zinc/26/35/67/509263567.db2.gz	NWIVWYNJSXAVQG-UHFFFAOYSA-N	-1	0	370.438	2.630	50	0		FFAARM
CCOc1ccc(-c2nc(C)c(C(=O)[N-]S(=O)(=O)CC)s2)cc1	ZINC000225383691	509368851	/nfs/dbraw/zinc/36/88/51/509368851.db2.gz	QNHNZDXYGFVRER-UHFFFAOYSA-N	-1	0	354.453	2.597	50	0		FFAARM
O=S(=O)([N-]c1ncccn1)c1cccc2cncc(Br)c21	ZINC000225744288	509386677	/nfs/dbraw/zinc/38/66/77/509386677.db2.gz	REMOBSRMWNTJSB-UHFFFAOYSA-N	-1	0	365.212	2.588	50	0		FFAARM
O=C([O-])[C@H]1CCCN(S(=O)(=O)Cc2ccc(Cl)cc2Cl)C1	ZINC000226087340	509395462	/nfs/dbraw/zinc/39/54/62/509395462.db2.gz	QKILOOYOCAGNHF-VIFPVBQESA-N	-1	0	352.239	2.620	50	0		FFAARM
O=S(=O)(Cc1cnoc1C1CC1)c1nnc(-c2cc(F)cc(F)c2)[n-]1	ZINC000170617137	509681412	/nfs/dbraw/zinc/68/14/12/509681412.db2.gz	GFBVUMWCFOYACH-UHFFFAOYSA-N	-1	0	366.349	2.589	50	0		FFAARM
Cc1nc(COc2cccc(C(=O)N3CCC(C(=O)[O-])CC3)c2)cs1	ZINC000237761806	509728150	/nfs/dbraw/zinc/72/81/50/509728150.db2.gz	XOHTZHGDTKCSBC-UHFFFAOYSA-N	-1	0	360.435	2.967	50	0		FFAARM
O=C([O-])CC[C@H]1CCCN(C(=O)/C=C/c2cnn(-c3ccccc3)c2)C1	ZINC000238016458	509800299	/nfs/dbraw/zinc/80/02/99/509800299.db2.gz	PTKKUIDMXRPKQS-XAVKZTDYSA-N	-1	0	353.422	2.989	50	0		FFAARM
O=C([O-])C1CCN(C(=O)CCCc2nc(-c3ccc(F)cc3)no2)CC1	ZINC000238021834	509801072	/nfs/dbraw/zinc/80/10/72/509801072.db2.gz	RVDIDEGMDBREIE-UHFFFAOYSA-N	-1	0	361.373	2.522	50	0		FFAARM
O=C([O-])C[C@H]1CN(C(=O)c2ccc(-c3nc4ccccc4s3)o2)CCO1	ZINC000238064457	509813047	/nfs/dbraw/zinc/81/30/47/509813047.db2.gz	WWKXOUDHVNMJCA-NSHDSACASA-N	-1	0	372.402	2.872	50	0		FFAARM
CN(c1ccccc1)S(=O)(=O)[N-]C(=O)CCc1ccc(Cl)cc1	ZINC000239359533	509838192	/nfs/dbraw/zinc/83/81/92/509838192.db2.gz	AEOHLJNTRBSONZ-UHFFFAOYSA-N	-1	0	352.843	2.770	50	0		FFAARM
Cc1ccc(S(=O)(=O)[N-]C(=O)CN2c3ccccc3CC[C@H]2C)cc1	ZINC000253433648	509883171	/nfs/dbraw/zinc/88/31/71/509883171.db2.gz	ZQXXYJVKPZFLNW-OAHLLOKOSA-N	-1	0	358.463	2.641	50	0		FFAARM
O=C([O-])[C@H]1CN(C(=O)c2ccc3c(c2)NC(=O)CS3)c2ccccc21	ZINC000299741578	511668298	/nfs/dbraw/zinc/66/82/98/511668298.db2.gz	GNXKCBOKVMTBBT-LBPRGKRZSA-N	-1	0	354.387	2.559	50	0		FFAARM
CCOc1ccncc1S(=O)(=O)[N-]c1ccc(-n2cccn2)c(F)c1	ZINC000328595681	511889278	/nfs/dbraw/zinc/88/92/78/511889278.db2.gz	AKCGAMHIHLFBKQ-UHFFFAOYSA-N	-1	0	362.386	2.606	50	0		FFAARM
CCCN1C[C@H](NC(=O)c2cccc(-c3ccccc3C(=O)[O-])c2)CC1=O	ZINC000584901973	518530527	/nfs/dbraw/zinc/53/05/27/518530527.db2.gz	VCAQRDJZDMMRBF-MRXNPFEDSA-N	-1	0	366.417	2.793	50	0		FFAARM
O=C([O-])CN(C(=O)/C=C\c1csc(Br)c1)C1CCOCC1	ZINC000606441980	521068744	/nfs/dbraw/zinc/06/87/44/521068744.db2.gz	URAVCTUEYTYRFV-UPHRSURJSA-N	-1	0	374.256	2.616	50	0		FFAARM
CC[C@H](Cc1cccc(Br)c1)C(=O)N1CC[C@H](C(=O)[O-])C1	ZINC000269179969	522305828	/nfs/dbraw/zinc/30/58/28/522305828.db2.gz	KXXCGFYKZOAGDK-OLZOCXBDSA-N	-1	0	354.244	2.951	50	0		FFAARM
Cc1nn(C)c(C)c1[C@H](C)C(=O)N1CCc2c(F)ccc(C(=O)[O-])c2C1	ZINC000630237578	522725336	/nfs/dbraw/zinc/72/53/36/522725336.db2.gz	CBKQRNWPKXOTKO-JTQLQIEISA-N	-1	0	359.401	2.563	50	0		FFAARM
O=C([O-])c1ccc2nc(/C=C/c3cn(C[C@@H]4CCOC4)nn3)ccc2c1	ZINC000630950300	523267083	/nfs/dbraw/zinc/26/70/83/523267083.db2.gz	CFULCOVZJVKCBC-IHVVCDCBSA-N	-1	0	350.378	2.731	50	0		FFAARM
Cc1ccccc1[N-]S(=O)(=O)c1cc(OCC(N)=O)c(C)cc1Cl	ZINC000001108839	525271315	/nfs/dbraw/zinc/27/13/15/525271315.db2.gz	PATRHPXTRPXOSE-UHFFFAOYSA-N	-1	0	368.842	2.622	50	0		FFAARM
CC(C)(C)c1ccn(C2(C(=O)[O-])CCN(c3ncnc4c3CCC4)CC2)n1	ZINC000072431568	535133626	/nfs/dbraw/zinc/13/36/26/535133626.db2.gz	SHBZNUGYRGXIIL-UHFFFAOYSA-N	-1	0	369.469	2.540	50	0		FFAARM
CCN1C(=O)COc2cc3c(cc21)[C@H](c1ccc(C(=O)[O-])s1)CC(=O)N3	ZINC000065417565	535431947	/nfs/dbraw/zinc/43/19/47/535431947.db2.gz	WUTUOMLDHVRENC-SNVBAGLBSA-N	-1	0	372.402	2.666	50	0		FFAARM
Cc1oc(C)c(S(=O)(=O)NC[C@H]2CCCCC2(F)F)c1C(=O)[O-]	ZINC000389853120	568278209	/nfs/dbraw/zinc/27/82/09/568278209.db2.gz	VIPRDNBGFIYPHG-SNVBAGLBSA-N	-1	0	351.371	2.698	50	0		FFAARM
CC[C@@H](c1ccccn1)N(C)S(=O)(=O)c1cc(C(=O)[O-])ccc1OC	ZINC001506399328	1059491561	/nfs/dbraw/zinc/49/15/61/1059491561.db2.gz	LZDIFACUNFLLJA-AWEZNQCLSA-N	-1	0	364.423	2.560	50	0		FFAARM
O=C([O-])c1cc2c(nc(Cl)nc2Cl)n1S(=O)(=O)c1ccccc1	ZINC000242620192	209899095	/nfs/dbraw/zinc/89/90/95/209899095.db2.gz	PXOSQSZSTXEOSZ-UHFFFAOYSA-N	-1	0	372.189	2.673	50	0		FFAARM
O=C(c1ccc2c(=O)[nH]c(=S)[n-]c2c1)N1CCS[C@@H]2CCCC[C@@H]21	ZINC000170656848	209552876	/nfs/dbraw/zinc/55/28/76/209552876.db2.gz	PMTQRYJXNAMOOZ-UONOGXRCSA-N	-1	0	361.492	2.712	50	0		FFAARM
Cc1c(C(=O)Nc2ccccc2C)sc2ncn([C@@H](C)C(=O)[O-])c(=O)c12	ZINC000000958444	209384484	/nfs/dbraw/zinc/38/44/84/209384484.db2.gz	SSRZDNMJRDPYIF-NSHDSACASA-N	-1	0	371.418	2.973	50	0		FFAARM
Cc1nc(S(=O)(=O)[N-]c2ccc(OCCc3ccccc3)nc2)cn1C	ZINC000135330447	209371683	/nfs/dbraw/zinc/37/16/83/209371683.db2.gz	AJYORLAEGURWHR-UHFFFAOYSA-N	-1	0	372.450	2.546	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)C1CCOCC1)c1cccc(Br)c1	ZINC000238202108	209359755	/nfs/dbraw/zinc/35/97/55/209359755.db2.gz	DOFNDPLSWIFGTQ-ZDUSSCGKSA-N	-1	0	356.216	2.508	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)C1CCOCC1)c1cccc(Br)c1	ZINC000238092732	209359868	/nfs/dbraw/zinc/35/98/68/209359868.db2.gz	DOFNDPLSWIFGTQ-CYBMUJFWSA-N	-1	0	356.216	2.508	50	0		FFAARM
O=C([O-])CCN(C(=O)c1ccc(Br)cc1)C1CCOCC1	ZINC000238074190	209358508	/nfs/dbraw/zinc/35/85/08/209358508.db2.gz	IGMUVFIQXUZUTR-UHFFFAOYSA-N	-1	0	356.216	2.545	50	0		FFAARM
O=C([O-])CC[C@H]1CCCCN1C(=O)Cc1ccn(-c2ccc(F)cc2)n1	ZINC000237986922	209357625	/nfs/dbraw/zinc/35/76/25/209357625.db2.gz	IEPYCVGHRVHJDX-MRXNPFEDSA-N	-1	0	359.401	2.800	50	0		FFAARM
O=C([O-])CN(C(=O)c1cc2c(cc(Br)cc2F)[nH]1)C1CC1	ZINC000238086445	209357661	/nfs/dbraw/zinc/35/76/61/209357661.db2.gz	PGAFQPQNWGEMGZ-UHFFFAOYSA-N	-1	0	355.163	2.759	50	0		FFAARM
Cc1nn(C)c2sc(C(=O)N3Cc4ccccc4C[C@@H]3C(=O)[O-])cc12	ZINC000237914632	209356507	/nfs/dbraw/zinc/35/65/07/209356507.db2.gz	YLNOXVDOWFCHRE-CQSZACIVSA-N	-1	0	355.419	2.595	50	0		FFAARM
O=C([O-])[C@H]1CCN(C(=O)CCCOc2cccc(Br)c2)C1	ZINC000237955533	209355551	/nfs/dbraw/zinc/35/55/51/209355551.db2.gz	VICSGMIURUZVOO-NSHDSACASA-N	-1	0	356.216	2.541	50	0		FFAARM
C[C@@H]1CCCN(S(=O)(=O)Nc2ccc(C(=O)[O-])c(C(F)(F)F)c2)C1	ZINC000120315991	209352894	/nfs/dbraw/zinc/35/28/94/209352894.db2.gz	BKTSBTMHYFYLQR-SECBINFHSA-N	-1	0	366.361	2.792	50	0		FFAARM
C[C@@H]1CN(Cc2ccc(C(=O)NC(C)(C)CCC(=O)[O-])cc2)C[C@H](C)O1	ZINC000237675885	209352417	/nfs/dbraw/zinc/35/24/17/209352417.db2.gz	WYIGWZOGMRCHRH-GASCZTMLSA-N	-1	0	362.470	2.669	50	0		FFAARM
C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N1CCO[C@@H](CC(=O)[O-])C1	ZINC000237489243	209349648	/nfs/dbraw/zinc/34/96/48/209349648.db2.gz	GDRYTECYSNFNTB-RISCZKNCSA-N	-1	0	359.344	2.586	50	0		FFAARM
CN(Cc1ccc(C(=O)[O-])cc1)C(=O)c1nc(N2CCCC2)ncc1Cl	ZINC000237076227	209333129	/nfs/dbraw/zinc/33/31/29/209333129.db2.gz	AWDDBFSVGQFLMI-UHFFFAOYSA-N	-1	0	374.828	2.701	50	0		FFAARM
COc1cccc(-n2c(=O)c3[n-][nH]n(-c4ccc(C)c(C)c4)c=3c2=O)c1	ZINC000102819711	209241859	/nfs/dbraw/zinc/24/18/59/209241859.db2.gz	BJJHOKUVWRUEGK-IRXDYDNUSA-N	-1	0	350.378	2.810	50	0		FFAARM
CCn1c(=O)c2ccc(C(=O)Nc3cccc(OC)c3)cc2[n-]c1=S	ZINC000102333615	209234400	/nfs/dbraw/zinc/23/44/00/209234400.db2.gz	BAOGENPLZBEQQT-UHFFFAOYSA-N	-1	0	355.419	2.966	50	0		FFAARM
CC(C)=CC[C@]1(C(=O)[O-])CCCN(C(=O)CC2=CSC3=NCCN23)C1	ZINC000101773840	209230086	/nfs/dbraw/zinc/23/00/86/209230086.db2.gz	OWGRPYVAQQDIPF-GOSISDBHSA-N	-1	0	363.483	2.686	50	0		FFAARM
CCCCn1c([O-])c(C2=NN[C@@H](c3ccc(C(C)C)cc3)C2)c(=O)[nH]c1=O	ZINC000101761934	209229718	/nfs/dbraw/zinc/22/97/18/209229718.db2.gz	FIKQTXSEBQUZOP-OAHLLOKOSA-N	-1	0	370.453	2.604	50	0		FFAARM
CCc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccccc4F)c=3c2=O)cc1	ZINC000101167709	209221749	/nfs/dbraw/zinc/22/17/49/209221749.db2.gz	GGYYGYHGSJFWJT-IRXDYDNUSA-N	-1	0	352.369	2.882	50	0		FFAARM
CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)NCc1cccc(C(=O)[O-])c1	ZINC000236829992	209201383	/nfs/dbraw/zinc/20/13/83/209201383.db2.gz	SSVWUIVDJINSDX-LJQANCHMSA-N	-1	0	364.401	2.965	50	0		FFAARM
O=C([O-])c1ccc(C(=O)NC[C@@H](c2cccnc2)N2CCCCC2)s1	ZINC000097642171	209189830	/nfs/dbraw/zinc/18/98/30/209189830.db2.gz	IGDFAEODFACYJK-AWEZNQCLSA-N	-1	0	359.451	2.798	50	0		FFAARM
CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)CCC(=O)[O-])c2C(N)=O)C1	ZINC000000908714	206845331	/nfs/dbraw/zinc/84/53/31/206845331.db2.gz	WQRIMHPJBNLIPB-SECBINFHSA-N	-1	0	352.456	2.801	50	0		FFAARM
COc1cc(CN2Cc3cccc(C(=O)[O-])c3C2=O)cc(OC)c1OC	ZINC000004085210	207000274	/nfs/dbraw/zinc/00/02/74/207000274.db2.gz	KCOTYEPYPXIJSZ-UHFFFAOYSA-N	-1	0	357.362	2.567	50	0	biogenic	FFAARM
Cc1ccc([C@@H]2NC(=O)N[C@@](O)(C(F)(F)F)C2=C([O-])c2cccs2)o1	ZINC000004101966	207000822	/nfs/dbraw/zinc/00/08/22/207000822.db2.gz	NICRJXXZPLAFMD-MJVIPROJSA-N	-1	0	374.340	2.753	50	0		FFAARM
Cc1ccc(S(=O)(=O)[N-]C(=O)NCCSCc2ccco2)cc1	ZINC000004364734	207016693	/nfs/dbraw/zinc/01/66/93/207016693.db2.gz	AOPSSYPGYKTWDZ-UHFFFAOYSA-N	-1	0	354.453	2.509	50	0		FFAARM
CC(C)(C)OC(=O)NCCC[C@H](NC(=O)OCc1ccccc1)C(=O)[O-]	ZINC000004764531	207046020	/nfs/dbraw/zinc/04/60/20/207046020.db2.gz	RWQCKACYKKSOKK-AWEZNQCLSA-N	-1	0	366.414	2.671	50	0		FFAARM
CC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccnn2-c2ccccc2)cc1	ZINC000004722458	207042456	/nfs/dbraw/zinc/04/24/56/207042456.db2.gz	PSFOMYYDCTXBHG-UHFFFAOYSA-N	-1	0	356.407	2.632	50	0		FFAARM
COc1ccc(S(=O)(=O)N(CC(=O)[O-])c2ccc(Cl)cc2)cc1	ZINC000004818684	207051376	/nfs/dbraw/zinc/05/13/76/207051376.db2.gz	CERIRWRTSUSBNL-UHFFFAOYSA-N	-1	0	355.799	2.629	50	0		FFAARM
O=C([O-])c1ccccc1C(=O)Nc1ccccc1C(=O)NC[C@@H]1CCCO1	ZINC000005044050	207074881	/nfs/dbraw/zinc/07/48/81/207074881.db2.gz	UVMIWOBFCWOAMC-ZDUSSCGKSA-N	-1	0	368.389	2.546	50	0		FFAARM
COc1ccc(Nc2nnc(Cc3ccc(C)cc3)c(=O)[n-]2)c(OC)c1	ZINC000005154326	207085038	/nfs/dbraw/zinc/08/50/38/207085038.db2.gz	LYYDGQBSLTXPIQ-UHFFFAOYSA-N	-1	0	352.394	2.825	50	0		FFAARM
CCOc1ccc(-c2cccc([N-]S(=O)(=O)c3c(C)noc3C)c2)nn1	ZINC000005204279	207087474	/nfs/dbraw/zinc/08/74/74/207087474.db2.gz	WXLLZJXLHBZDEB-UHFFFAOYSA-N	-1	0	374.422	2.948	50	0		FFAARM
COc1ccccc1CN1C(=O)[C@@]([O-])(C(F)(F)F)N=C1c1ccccc1	ZINC000005244342	207088485	/nfs/dbraw/zinc/08/84/85/207088485.db2.gz	CSAWEZXAQFISDP-QGZVFWFLSA-N	-1	0	364.323	2.735	50	0		FFAARM
COc1ccc(NC(C)=O)cc1[N-]S(=O)(=O)c1ccc2c(c1)CCC2	ZINC000006905511	207177753	/nfs/dbraw/zinc/17/77/53/207177753.db2.gz	PSAUYCJRIGJODR-UHFFFAOYSA-N	-1	0	360.435	2.943	50	0		FFAARM
O=C([O-])Cc1ccc(N[C@@H]2CC(=O)N(c3cccc(Cl)c3)C2=O)cc1	ZINC000006831290	207170510	/nfs/dbraw/zinc/17/05/10/207170510.db2.gz	BYZULDMWZQNAHF-OAHLLOKOSA-N	-1	0	358.781	2.711	50	0		FFAARM
CC[C@H](C)c1ccc(S(=O)(=O)[N-]NC(=S)NCc2ccco2)cc1	ZINC000006954620	207181855	/nfs/dbraw/zinc/18/18/55/207181855.db2.gz	VSECGDYDZFHYRH-LBPRGKRZSA-N	-1	0	367.496	2.651	50	0		FFAARM
Cc1ccc([C@@H](CC(=O)[O-])NS(=O)(=O)c2ccc(F)cc2F)cc1	ZINC000007990193	207216298	/nfs/dbraw/zinc/21/62/98/207216298.db2.gz	PFMWVTLWVBJNGL-CQSZACIVSA-N	-1	0	355.362	2.768	50	0		FFAARM
O=C([O-])c1ccc(NC(=O)c2ccccc2NC(=O)[C@H]2CCCO2)cc1	ZINC000008189546	207222310	/nfs/dbraw/zinc/22/23/10/207222310.db2.gz	NXFWMCJHVBVBAW-MRXNPFEDSA-N	-1	0	354.362	2.755	50	0		FFAARM
Cc1cc(C(=O)[N-]n2cnc3scc(-c4cccs4)c3c2=O)on1	ZINC000008775118	207249895	/nfs/dbraw/zinc/24/98/95/207249895.db2.gz	WXXSRSGLFVSVEI-UHFFFAOYSA-N	-1	0	358.404	2.867	50	0		FFAARM
Cc1c(C(=O)N2CCCC2)c(S(=O)(=O)[N-]c2ccccc2)c(C)n1C	ZINC000009684879	207281361	/nfs/dbraw/zinc/28/13/61/207281361.db2.gz	RPMCCUMTLYUMEI-UHFFFAOYSA-N	-1	0	361.467	2.679	50	0		FFAARM
O=C([O-])[C@@H](Cc1ccccc1)NC(=O)CCn1ccc2ccc(F)cc21	ZINC000036576235	207285781	/nfs/dbraw/zinc/28/57/81/207285781.db2.gz	NQEDZORQBDRZQV-QGZVFWFLSA-N	-1	0	354.381	2.983	50	0		FFAARM
CC(C)c1ccc(OCc2n[nH]c(=S)n2[N-]C(=O)c2cnccn2)cc1	ZINC000010704384	207304253	/nfs/dbraw/zinc/30/42/53/207304253.db2.gz	HJQJLOQKPDPCCV-UHFFFAOYSA-N	-1	0	370.438	2.817	50	0		FFAARM
COc1cc2c(cc1OC)CN(C(=O)Nc1ccccc1C(=O)[O-])CC2	ZINC000011766992	207320034	/nfs/dbraw/zinc/32/00/34/207320034.db2.gz	BWCUEKZNVWQRTD-UHFFFAOYSA-N	-1	0	356.378	2.992	50	0	biogenic	FFAARM
O=C([O-])C[C@H](NC(=O)c1cnn(-c2ccccc2)c1)c1ccc(F)cc1	ZINC000013257822	207454979	/nfs/dbraw/zinc/45/49/79/207454979.db2.gz	AYMULZQKKOCWIY-KRWDZBQOSA-N	-1	0	353.353	2.957	50	0		FFAARM
COc1cc(/C=C/C(=O)N2CCC(C(=O)[O-])CC2)cc(Cl)c1OC	ZINC000013167360	207455161	/nfs/dbraw/zinc/45/51/61/207455161.db2.gz	GTIVFSBZSQCFKC-ONEGZZNKSA-N	-1	0	353.802	2.694	50	0		FFAARM
COc1ccc(CNC(=O)CCc2cccc(OC)c2OC)cc1C(=O)[O-]	ZINC000013393083	207460124	/nfs/dbraw/zinc/46/01/24/207460124.db2.gz	PQONOQQVFGZHFI-UHFFFAOYSA-N	-1	0	373.405	2.660	50	0		FFAARM
O=C([O-])[C@H]1C2CCC(CC2)[C@@H]1C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000017075898	207612208	/nfs/dbraw/zinc/61/22/08/207612208.db2.gz	QJYMVHPWVBCBQO-GNNGFNCTSA-N	-1	0	370.449	2.998	50	0		FFAARM
NC(=O)c1ccc([N-]S(=O)(=O)c2cc(Cl)sc2Cl)cc1	ZINC000020627073	207749123	/nfs/dbraw/zinc/74/91/23/207749123.db2.gz	LLBWOGWYDWEGMQ-UHFFFAOYSA-N	-1	0	351.236	2.955	50	0		FFAARM
O=C([O-])/C=C/c1ccc(S(=O)(=O)Nc2ccc(-n3cccn3)cc2)cc1	ZINC000032595412	208032278	/nfs/dbraw/zinc/03/22/78/208032278.db2.gz	MPPMIDHKJFFHGI-NYYWCZLTSA-N	-1	0	369.402	2.771	50	0		FFAARM
COc1cc2c(cc1OC)[C@H]1[C@H](C(=O)[O-])c3ccccc3C(=O)N1CC2	ZINC000032916833	208056769	/nfs/dbraw/zinc/05/67/69/208056769.db2.gz	MXBNJFLOBHEONN-MSOLQXFVSA-N	-1	0	353.374	2.625	50	0		FFAARM
COC(=O)c1ccc(C)c(S(=O)(=O)Nc2ccc(C)c(C(=O)[O-])c2)c1	ZINC000078789772	208201352	/nfs/dbraw/zinc/20/13/52/208201352.db2.gz	OCSIGDAMFUKSQY-UHFFFAOYSA-N	-1	0	363.391	2.589	50	0		FFAARM
O=C([O-])[C@@H]1CCCN(C(=O)Cn2ccc3ccc(Br)cc32)C1	ZINC000040283668	208245304	/nfs/dbraw/zinc/24/53/04/208245304.db2.gz	QOYAPMTXYLIBTE-GFCCVEGCSA-N	-1	0	365.227	2.727	50	0		FFAARM
O=C([O-])[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2cccc(Br)c2)C1	ZINC000299743123	208337529	/nfs/dbraw/zinc/33/75/29/208337529.db2.gz	LYDLREABJYIISG-KWCYVHTRSA-N	-1	0	352.228	2.876	50	0		FFAARM
Cc1c(C(=O)[O-])cnn1-c1ccc(C(=O)N[C@@H]2CCC[C@@H]3OCC[C@H]32)cc1	ZINC000299746472	208339656	/nfs/dbraw/zinc/33/96/56/208339656.db2.gz	XPVIPDGFDPGVPT-JQHSSLGASA-N	-1	0	369.421	2.566	50	0		FFAARM
O=C([O-])[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1ccc(Cn2cccn2)cc1	ZINC000299743550	208340543	/nfs/dbraw/zinc/34/05/43/208340543.db2.gz	LGLFETURCKJNKR-KURKYZTESA-N	-1	0	353.422	2.789	50	0		FFAARM
O=C([O-])[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc2c(c1)CCO2	ZINC000299739741	208326316	/nfs/dbraw/zinc/32/63/16/208326316.db2.gz	ANOYKCGLURIVKB-KRWDZBQOSA-N	-1	0	350.374	2.529	50	0		FFAARM
COc1cccc([N-]S(=O)(=O)c2cc(C(=O)N3CCCC3)cs2)c1	ZINC000045961542	208353871	/nfs/dbraw/zinc/35/38/71/208353871.db2.gz	TZEFGPSFSMKTHJ-UHFFFAOYSA-N	-1	0	366.464	2.794	50	0		FFAARM
O=C([O-])[C@@H]1Cc2ccccc2CN1C(=O)C[C@H]1CCOc2ccccc21	ZINC000299749914	208356312	/nfs/dbraw/zinc/35/63/12/208356312.db2.gz	MAAPOKSEWXCILR-QAPCUYQASA-N	-1	0	351.402	2.981	50	0		FFAARM
COc1ccc(C(NC(=O)[C@@H]2C[C@@H]2C(=O)[O-])c2ccc(OC)cc2)cc1	ZINC000299753612	208362838	/nfs/dbraw/zinc/36/28/38/208362838.db2.gz	YUFIDRRBKHGYJX-SJORKVTESA-N	-1	0	355.390	2.630	50	0		FFAARM
O=C([O-])COc1cccc(CNC(=O)C[C@H]2CCOc3ccccc32)c1	ZINC000299753104	208363323	/nfs/dbraw/zinc/36/33/23/208363323.db2.gz	WVRVZWBGBZCKHE-OAHLLOKOSA-N	-1	0	355.390	2.723	50	0		FFAARM
O=C(CSc1nc2[nH]c(=O)cc([O-])c2s1)Nc1ccc(F)cc1F	ZINC000065363025	208666843	/nfs/dbraw/zinc/66/68/43/208666843.db2.gz	WCWCJQMOVRLCBE-UHFFFAOYSA-N	-1	0	369.374	2.699	50	0		FFAARM
O=C([O-])C1(CC(=O)Nc2cc(N3CCOC3=O)ccc2F)CCCC1	ZINC000067456217	208705421	/nfs/dbraw/zinc/70/54/21/208705421.db2.gz	FERCWWJBPZILBP-UHFFFAOYSA-N	-1	0	350.346	2.756	50	0		FFAARM
COCCC[C@]1(C(=O)[O-])CCCN(C(=O)c2ccccc2-c2ncc[nH]2)C1	ZINC000091707856	208992123	/nfs/dbraw/zinc/99/21/23/208992123.db2.gz	CETGOHVAZYOWPT-HXUWFJFHSA-N	-1	0	371.437	2.810	50	0		FFAARM
COc1ccccc1[C@@H]1CN(C(=O)c2ccc(C(C)=O)s2)C[C@H]1C(=O)[O-]	ZINC000091943128	209005378	/nfs/dbraw/zinc/00/53/78/209005378.db2.gz	CXQFXAGSNPJPTI-UONOGXRCSA-N	-1	0	373.430	2.900	50	0		FFAARM
O=C([O-])[C@H](Cc1ccc(F)cc1)NC(=O)c1ncoc1-c1cccs1	ZINC000095989715	209093829	/nfs/dbraw/zinc/09/38/29/209093829.db2.gz	LSSNELHASUKKCX-LBPRGKRZSA-N	-1	0	360.366	2.968	50	0		FFAARM
O=C([O-])[C@@H](Cc1c[nH]c2cc(F)ccc12)NC(=O)CC[C@H]1CCCCO1	ZINC000095989865	209093382	/nfs/dbraw/zinc/09/33/82/209093382.db2.gz	FBDADPPUHSKQPJ-RHSMWYFYSA-N	-1	0	362.401	2.768	50	0		FFAARM
Cc1cc(=O)[nH]c(C)c1C(=O)N1CCC[C@H](c2cccc(C(=O)[O-])c2)C1	ZINC000095353536	209022736	/nfs/dbraw/zinc/02/27/36/209022736.db2.gz	ZCLJUJIWQGTHCF-INIZCTEOSA-N	-1	0	354.406	2.710	50	0		FFAARM
C[C@@H](SCc1ccccc1)C(=O)Nc1cccc(C(=O)NCC(=O)[O-])c1	ZINC000095389894	209045719	/nfs/dbraw/zinc/04/57/19/209045719.db2.gz	LQTIFIQHIHRTBE-CYBMUJFWSA-N	-1	0	372.446	2.761	50	0		FFAARM
O=C([O-])[C@]12CN(C(=O)c3ccccc3F)C[C@H]1COc1ccccc1C2	ZINC000095384177	209042791	/nfs/dbraw/zinc/04/27/91/209042791.db2.gz	IPWSJALFKGOMDZ-VBKZILBWSA-N	-1	0	355.365	2.604	50	0		FFAARM
CCOc1ccccc1[C@H](CC(=O)Nc1ccc(C(=O)[O-])cc1)NC(C)=O	ZINC000095424261	209049145	/nfs/dbraw/zinc/04/91/45/209049145.db2.gz	BZJPGNBPJPIVER-KRWDZBQOSA-N	-1	0	370.405	2.990	50	0		FFAARM
CC(C)c1cccc(S(=O)(=O)[N-]c2cccc3c2C(=O)N(C)C3=O)c1	ZINC000095466354	209055556	/nfs/dbraw/zinc/05/55/56/209055556.db2.gz	SGRBDBKXYXFBJL-UHFFFAOYSA-N	-1	0	358.419	2.837	50	0		FFAARM
COc1ccc2c(cc(C(=O)NCCc3nc(C)c(C(=O)[O-])s3)n2C)c1	ZINC000095516366	209070200	/nfs/dbraw/zinc/07/02/00/209070200.db2.gz	BTGHRGLRXXSUDG-UHFFFAOYSA-N	-1	0	373.434	2.623	50	0		FFAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)c2ccc(N3CCCCC3=O)cc2)C1	ZINC000237970161	132248942	/nfs/dbraw/zinc/24/89/42/132248942.db2.gz	IWAXYEZJPDFKDD-HNNXBMFYSA-N	-1	0	358.438	2.921	50	0		FFAARM
COc1nc2c(cc1C(=O)N(C)[C@@H](CC(=O)[O-])c1ccccc1)CCC2	ZINC000095522792	209074532	/nfs/dbraw/zinc/07/45/32/209074532.db2.gz	YVVCPYIEXWOFQV-KRWDZBQOSA-N	-1	0	354.406	2.867	50	0		FFAARM
COc1ccccc1-n1cc(C(=O)NCc2ccc(C(=O)[O-])s2)cn1	ZINC000095528728	209077586	/nfs/dbraw/zinc/07/75/86/209077586.db2.gz	LBXNZUAOBLMTRE-UHFFFAOYSA-N	-1	0	357.391	2.571	50	0		FFAARM
COc1cccc([C@@H]2CN(C(=O)c3onc4c3CCCC4)C[C@H]2C(=O)[O-])c1	ZINC000426474376	263598184	/nfs/dbraw/zinc/59/81/84/263598184.db2.gz	ONAKGPYHBDNMCD-JKSUJKDBSA-N	-1	0	370.405	2.502	50	0		FFAARM
CCN(Cc1noc(C2CC2)n1)C(=O)N[C@H](C(=O)[O-])c1cccc(C)c1	ZINC000426689345	263657851	/nfs/dbraw/zinc/65/78/51/263657851.db2.gz	WWMZGUPLNYJAQQ-HNNXBMFYSA-N	-1	0	358.398	2.613	50	0		FFAARM
CCCC(=O)[N-]S(=O)(=O)c1ccc2nc(NC(=O)CCC)sc2c1	ZINC000005553817	506447593	/nfs/dbraw/zinc/44/75/93/506447593.db2.gz	GXXIXXHCUACPHU-UHFFFAOYSA-N	-1	0	369.468	2.640	50	0		FFAARM
Cc1cc(C)n(-c2cc(C)nc([N-]S(=O)(=O)c3ccc(C)cc3)n2)n1	ZINC000000754036	506229636	/nfs/dbraw/zinc/22/96/36/506229636.db2.gz	RGQRYDCBPDEQSA-UHFFFAOYSA-N	-1	0	357.439	2.697	50	0		FFAARM
Cc1ccccc1OCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)[O-]	ZINC000000790589	506232015	/nfs/dbraw/zinc/23/20/15/506232015.db2.gz	XBIUBLLFSQQXGR-KRWDZBQOSA-N	-1	0	352.390	2.667	50	0	biogenic,in-vitro	FFAARM
COc1ccc(-c2ccc(=O)[nH]n2)cc1S(=O)(=O)[N-]c1ccccc1C	ZINC000064837088	506233749	/nfs/dbraw/zinc/23/37/49/506233749.db2.gz	ZAPJKEMXSWAKDT-UHFFFAOYSA-N	-1	0	371.418	2.555	50	0		FFAARM
CC(=O)N1CCCSc2ccc(S(=O)(=O)[N-]c3ccccn3)cc21	ZINC000064952183	506243084	/nfs/dbraw/zinc/24/30/84/506243084.db2.gz	SSPDKBOKZKQWNO-UHFFFAOYSA-N	-1	0	363.464	2.731	50	0		FFAARM
CCc1ccccc1[N-]S(=O)(=O)c1cc2[nH]c(=O)[nH]c2cc1Cl	ZINC000064976603	506247411	/nfs/dbraw/zinc/24/74/11/506247411.db2.gz	IGHQSWKNBLTTJN-UHFFFAOYSA-N	-1	0	351.815	2.873	50	0		FFAARM
COc1ccc(-c2cc3ccc(OCC(=O)[O-])cc3oc2=O)cc1OC	ZINC000001237887	506256256	/nfs/dbraw/zinc/25/62/56/506256256.db2.gz	CUBJYGSQJQQUNX-UHFFFAOYSA-N	-1	0	356.330	2.941	50	0	biogenic	FFAARM
FC(F)(F)COc1nc(Nc2ccccn2)nc(OCC(F)(F)F)n1	ZINC000001440010	506262534	/nfs/dbraw/zinc/26/25/34/506262534.db2.gz	CHPKQHHAWHMXOT-UHFFFAOYSA-N	-1	0	369.225	2.892	50	0		FFAARM
COc1ccc(-c2nnnn2C(C)C)cc1S(=O)(=O)[N-]c1ccccc1	ZINC000001464731	506264466	/nfs/dbraw/zinc/26/44/66/506264466.db2.gz	AMQIJFKWIFCAJI-UHFFFAOYSA-N	-1	0	373.438	2.730	50	0		FFAARM
CCc1ccc(C(=O)COc2ccc(C[C@@H]3SC(=O)[N-]C3=O)cc2)nc1	ZINC000001482950	506264584	/nfs/dbraw/zinc/26/45/84/506264584.db2.gz	IRNJSRAGRIZIHD-KRWDZBQOSA-N	-1	0	370.430	2.800	50	0	investigational	FFAARM
CCc1nc2sc(C)nn2c1S(=O)(=O)[N-]c1ccc(C)c(F)c1	ZINC000065183889	506268453	/nfs/dbraw/zinc/26/84/53/506268453.db2.gz	PMTZHQZCZWPPFZ-UHFFFAOYSA-N	-1	0	354.432	2.910	50	0		FFAARM
Cc1coc2c1cc1c(C)c(CC(=O)NCCCC(=O)[O-])c(=O)oc1c2C	ZINC000002096577	506272062	/nfs/dbraw/zinc/27/20/62/506272062.db2.gz	BYMSIFQSHIFFMM-UHFFFAOYSA-N	-1	0	371.389	2.988	50	0	biogenic	FFAARM
O=S(=O)([N-]c1ncn(Cc2ccc(F)cc2)n1)c1ccc(Cl)cc1	ZINC000002778308	506291267	/nfs/dbraw/zinc/29/12/67/506291267.db2.gz	SSVGUDKKHWCVLL-UHFFFAOYSA-N	-1	0	366.805	2.920	50	0		FFAARM
O=C1NC[C@H](c2ccccc2)Cc2[n-]c(-c3nc(-c4ccccn4)no3)nc21	ZINC000065432051	506299335	/nfs/dbraw/zinc/29/93/35/506299335.db2.gz	UHHZMKRRSNFNFY-CYBMUJFWSA-N	-1	0	372.388	2.591	50	0		FFAARM
O=C([O-])c1ccc(Cl)c(S(=O)(=O)NCCc2ccc(F)cc2)c1	ZINC000003222742	506312576	/nfs/dbraw/zinc/31/25/76/506312576.db2.gz	LNLYOYZSMOBPMW-UHFFFAOYSA-N	-1	0	357.790	2.698	50	0		FFAARM
O=C([O-])c1ccc(NC(=S)NC(=O)COc2ccccc2Cl)cc1	ZINC000004674100	506386471	/nfs/dbraw/zinc/38/64/71/506386471.db2.gz	QJNWIFXGEHEWPT-UHFFFAOYSA-N	-1	0	364.810	2.930	50	0		FFAARM
CC(=O)c1cccc(S(=O)(=O)[N-]c2ccccc2C(=O)NC2CC2)c1	ZINC000007054345	506529066	/nfs/dbraw/zinc/52/90/66/506529066.db2.gz	FJXMVECZYIDJIT-UHFFFAOYSA-N	-1	0	358.419	2.582	50	0		FFAARM
O=C([O-])[C@@H]1CC=CC[C@@H]1C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1	ZINC000055150496	506687069	/nfs/dbraw/zinc/68/70/69/506687069.db2.gz	UNWMZUURJPDCDL-DLBZAZTESA-N	-1	0	356.422	2.965	50	0		FFAARM
Cc1cccc(N2C(=O)[N-]C(=O)[C@]3(Cc4cc(C)ccc4N(C)C3)C2=O)c1	ZINC000009358266	506692918	/nfs/dbraw/zinc/69/29/18/506692918.db2.gz	MLPUERASAJNOJS-OAQYLSRUSA-N	-1	0	363.417	2.565	50	0		FFAARM
COc1ccc(CCC(=O)N2[C@H](C(=O)[O-])C[C@@H]3CCCC[C@@H]32)cc1OC	ZINC000013225510	506932891	/nfs/dbraw/zinc/93/28/91/506932891.db2.gz	GZJOMPUUNLBZPA-JYJNAYRXSA-N	-1	0	361.438	2.881	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)c1ccc2c(c1)OCCCO2)c1ccc(F)cc1	ZINC000013257946	506934296	/nfs/dbraw/zinc/93/42/96/506934296.db2.gz	HKIUGLKXOFFTGE-HNNXBMFYSA-N	-1	0	359.353	2.933	50	0		FFAARM
COc1cccc(CCC(=O)N2C[C@@H](C(=O)[O-])Oc3ccccc32)c1OC	ZINC000013436061	506940822	/nfs/dbraw/zinc/94/08/22/506940822.db2.gz	JVCWFIIGKCFHBV-KRWDZBQOSA-N	-1	0	371.389	2.515	50	0		FFAARM
Cc1noc(C)c1S(=O)(=O)[N-]c1cccc(Cl)c1N1CCOCC1	ZINC000014097864	506966021	/nfs/dbraw/zinc/96/60/21/506966021.db2.gz	QTFAXBVQCAYEKF-UHFFFAOYSA-N	-1	0	371.846	2.582	50	0		FFAARM
CCc1ccc(-c2cn3c(C(=O)N[C@H](C)c4nnn[n-]4)csc3n2)cc1	ZINC000067894264	507045424	/nfs/dbraw/zinc/04/54/24/507045424.db2.gz	UDBWTLDPHJVHKB-SNVBAGLBSA-N	-1	0	367.438	2.629	50	0		FFAARM
COc1ccc(N2C(=O)C[C@@H](Sc3ccccc3C(=O)[O-])C2=O)cc1	ZINC000019765475	507198974	/nfs/dbraw/zinc/19/89/74/507198974.db2.gz	XANJWJGQROHIQR-OAHLLOKOSA-N	-1	0	357.387	2.818	50	0		FFAARM
Cn1cnnc1Sc1ccc([N-]S(=O)(=O)c2ccccc2F)cc1	ZINC000022095419	507278608	/nfs/dbraw/zinc/27/86/08/507278608.db2.gz	FBXACGYSLXAILP-UHFFFAOYSA-N	-1	0	364.427	2.906	50	0		FFAARM
CCc1nc2sc([C@H](c3cccc(F)c3)N3CCOCC3)c([O-])n2n1	ZINC000022854212	507316275	/nfs/dbraw/zinc/31/62/75/507316275.db2.gz	IDMMTUKCLBRQCP-AWEZNQCLSA-N	-1	0	362.430	2.620	50	0		FFAARM
COc1cccc(-n2c(=O)c3[n-][nH]n(-c4ccc(C)c(C)c4)c=3c2=O)c1	ZINC000023125915	507332101	/nfs/dbraw/zinc/33/21/01/507332101.db2.gz	BJJHOKUVWRUEGK-SJORKVTESA-N	-1	0	350.378	2.810	50	0		FFAARM
Cc1cc(Br)c([O-])c(C(=O)NCc2ccc(N(C)C)nc2)c1	ZINC000057991341	507360613	/nfs/dbraw/zinc/36/06/13/507360613.db2.gz	RODIPNLQIUTIBH-UHFFFAOYSA-N	-1	0	364.243	2.854	50	0		FFAARM
Cc1cc(S(=O)(=O)[N-]c2ccn(CCc3ccncc3)n2)c(C)s1	ZINC000058214090	507387058	/nfs/dbraw/zinc/38/70/58/507387058.db2.gz	ODIMEMBXENSBGQ-UHFFFAOYSA-N	-1	0	362.480	3.000	50	0		FFAARM
CCC[C@H](NC(=O)[C@H](NC(=O)OCc1ccccc1)[C@H](C)CC)C(=O)[O-]	ZINC000025664130	507520285	/nfs/dbraw/zinc/52/02/85/507520285.db2.gz	PROMKSSJWWAGTP-VNQPRFMTSA-N	-1	0	364.442	2.697	50	0		FFAARM
COc1ccccc1[C@@H]1CC(=O)Nc2c(C(=O)[O-])cn(-c3cc(C)on3)c21	ZINC000061718928	507633278	/nfs/dbraw/zinc/63/32/78/507633278.db2.gz	NQYFENJJVPSDBR-LBPRGKRZSA-N	-1	0	367.361	2.955	50	0		FFAARM
CCOC(=O)c1[nH]c2ccc(OC)cc2c1NC(=O)[C@H]1[C@H](C(=O)[O-])C1(C)C	ZINC000071279452	507699142	/nfs/dbraw/zinc/69/91/42/507699142.db2.gz	UQYQULXLCVFVSY-CHWSQXEVSA-N	-1	0	374.393	2.649	50	0		FFAARM
O=C([O-])[C@]1(C/C=C/c2ccccc2)CCCN(C(=O)c2ccc(=O)[nH]c2)C1	ZINC000071730230	507707963	/nfs/dbraw/zinc/70/79/63/507707963.db2.gz	JUYQDTBGCSVJMW-FAZYEBOESA-N	-1	0	366.417	2.785	50	0		FFAARM
O=C([O-])[C@]1(O)[C@H](c2ccccc2)[C@H](c2ccc(Cl)cc2)Nc2ncnn21	ZINC000072332369	507776981	/nfs/dbraw/zinc/77/69/81/507776981.db2.gz	HIQAZQFVSMOXKR-RVKKMQEKSA-N	-1	0	370.796	2.612	50	0		FFAARM
COc1ccc(C(=O)N2CCC(Oc3cccc(C)c3)(C(=O)[O-])CC2)o1	ZINC000072407360	507784073	/nfs/dbraw/zinc/78/40/73/507784073.db2.gz	MKZAYNYDIAGLRW-UHFFFAOYSA-N	-1	0	359.378	2.735	50	0		FFAARM
CC(C)(C)c1ccn(C2(C(=O)[O-])CCN(C(=O)N3CCCCC3)CC2)n1	ZINC000072424604	507788219	/nfs/dbraw/zinc/78/82/19/507788219.db2.gz	HMELCTWFWKGPKV-UHFFFAOYSA-N	-1	0	362.474	2.662	50	0		FFAARM
Cc1nccc(-c2ccccc2)c1C(=O)N1CCc2[nH]cnc2[C@H]1C(=O)[O-]	ZINC000072428607	507788871	/nfs/dbraw/zinc/78/88/71/507788871.db2.gz	BSVODFXCSGOWLF-SFHVURJKSA-N	-1	0	362.389	2.604	50	0		FFAARM
COCC[C@]1(C(=O)[O-])CCCN(C(=O)c2scc3c2CCCC3)C1	ZINC000091320289	507980499	/nfs/dbraw/zinc/98/04/99/507980499.db2.gz	QCZWECNQEHWGAO-GOSISDBHSA-N	-1	0	351.468	2.970	50	0		FFAARM
COc1ccc([N-]S(=O)(=O)c2c(C)[nH]c(C)c2-c2nc(C)no2)cc1	ZINC000075505038	508111976	/nfs/dbraw/zinc/11/19/76/508111976.db2.gz	FDALCLREPONTIP-UHFFFAOYSA-N	-1	0	362.411	2.799	50	0		FFAARM
O=S(=O)([N-]c1cnn([C@H]2CCOC2)c1)c1cc(Cl)ccc1Cl	ZINC000096123289	508207528	/nfs/dbraw/zinc/20/75/28/508207528.db2.gz	RZILPKGMVCKSQU-NSHDSACASA-N	-1	0	362.238	2.952	50	0		FFAARM
O=C([O-])[C@@]12CN(C(=O)c3cccc4cnccc43)C[C@@H]1c1ccccc1OC2	ZINC000096149288	508208353	/nfs/dbraw/zinc/20/83/53/508208353.db2.gz	ZEGFTFIMFVDRAG-XMSQKQJNSA-N	-1	0	374.396	2.938	50	0		FFAARM
Cc1cc2ncc(C(=O)N3CCC[C@](C)(c4ccccc4)C3)c(=O)n2[n-]1	ZINC000102704571	508282225	/nfs/dbraw/zinc/28/22/25/508282225.db2.gz	FMAMJMFXFNPJQB-FQEVSTJZSA-N	-1	0	350.422	2.525	50	0		FFAARM
CCC[C@@H](NC(=O)c1cc(C2CC2)nc2ccc(OC)cc21)c1nnn[n-]1	ZINC000119610051	508828218	/nfs/dbraw/zinc/82/82/18/508828218.db2.gz	ZKDDYHUDUHYXGH-MRXNPFEDSA-N	-1	0	366.425	2.905	50	0		FFAARM
COc1ccc(/C=C\C(=O)Nc2cccc(OCC(=O)[O-])c2)cc1OC	ZINC000222161533	509312882	/nfs/dbraw/zinc/31/28/82/509312882.db2.gz	OTJPYCAJEHGUOD-CLFYSBASSA-N	-1	0	357.362	2.819	50	0		FFAARM
CN(Cc1ccc(OC(F)(F)F)cc1)C(=O)c1ccc(C(=O)[O-])nc1	ZINC000237102507	509572400	/nfs/dbraw/zinc/57/24/00/509572400.db2.gz	WKAMTHXLBCKXHA-UHFFFAOYSA-N	-1	0	354.284	2.951	50	0		FFAARM
COC(=O)[C@@H]([N-]S(=O)(=O)c1c(F)cccc1F)c1c(C)cccc1C	ZINC000170598306	509675964	/nfs/dbraw/zinc/67/59/64/509675964.db2.gz	QYXVSTVOBYOSJV-HNNXBMFYSA-N	-1	0	369.389	2.774	50	0		FFAARM
CCn1c(=O)c2ccc(C(=O)NCC3CCSCC3)cc2[n-]c1=S	ZINC000170626428	509685223	/nfs/dbraw/zinc/68/52/23/509685223.db2.gz	VVOSVWFHKIMQSV-UHFFFAOYSA-N	-1	0	363.508	2.578	50	0		FFAARM
Cc1nc(C)n(-c2ccc(C(=O)N3CCC[C@H](CCC(=O)[O-])C3)cc2)n1	ZINC000237696971	509713698	/nfs/dbraw/zinc/71/36/98/509713698.db2.gz	HKOJCRUVHUEHEV-OAHLLOKOSA-N	-1	0	356.426	2.601	50	0		FFAARM
CCOC(=O)c1ccc(F)c(S(=O)(=O)[N-]c2cc(C(C)C)[nH]n2)c1	ZINC000253417989	509880180	/nfs/dbraw/zinc/88/01/80/509880180.db2.gz	WERHPEHNQJGESM-UHFFFAOYSA-N	-1	0	355.391	2.650	50	0		FFAARM
CCOC(=O)c1ccc2nc(NC(=O)[C@H]3CC[C@H](C(=O)[O-])C3)sc2c1	ZINC000253473057	509884659	/nfs/dbraw/zinc/88/46/59/509884659.db2.gz	REMWYSZLJZYGFU-UWVGGRQHSA-N	-1	0	362.407	2.912	50	0		FFAARM
O=C([O-])c1ccc(C(=O)N2CCC3(C[C@@H]3C(=O)N3CCCCC3)CC2)cc1	ZINC000262345615	510251348	/nfs/dbraw/zinc/25/13/48/510251348.db2.gz	XWMCCTLSLXPYHM-QGZVFWFLSA-N	-1	0	370.449	2.640	50	0		FFAARM
C[C@@H](CN(Cc1ccccc1)C(=O)c1ccc2c(c1)CCC(=O)N2)C(=O)[O-]	ZINC000178017098	510379359	/nfs/dbraw/zinc/37/93/59/510379359.db2.gz	SVXXCXUKJMUSSP-AWEZNQCLSA-N	-1	0	366.417	2.934	50	0		FFAARM
Cc1ccc(F)c(-n2nc(C(=O)N[C@H](C(=O)[O-])C(C)C)c3c2CCC3)c1	ZINC000263225182	510619227	/nfs/dbraw/zinc/61/92/27/510619227.db2.gz	PWESJUWPLINCEO-INIZCTEOSA-N	-1	0	359.401	2.648	50	0		FFAARM
O=C([O-])C1CCC(NC(=O)N2CCO[C@@H](c3ccc(F)cc3)C2)CC1	ZINC000263483641	510720760	/nfs/dbraw/zinc/72/07/60/510720760.db2.gz	OQYBUPSLEMWSIR-AVVWSFFYSA-N	-1	0	350.390	2.552	50	0		FFAARM
O=C([O-])[C@@H]1CCN(C(=O)Nc2ccc(C(=O)NCc3ccccc3)cc2)C1	ZINC000263488857	510723334	/nfs/dbraw/zinc/72/33/34/510723334.db2.gz	NUYNHCDTTRMPIC-MRXNPFEDSA-N	-1	0	367.405	2.555	50	0		FFAARM
Cc1cc(=O)c(C(=O)[O-])c(CC2CCCC2)n1CCCN1CCCC1=O	ZINC000299796653	511684002	/nfs/dbraw/zinc/68/40/02/511684002.db2.gz	ODRCNNLRVHJYFD-UHFFFAOYSA-N	-1	0	360.454	2.600	50	0		FFAARM
C[C@H]1Sc2ccc(C(=O)NCc3cccc(C(=O)[O-])c3)cc2NC1=O	ZINC000521364870	517706657	/nfs/dbraw/zinc/70/66/57/517706657.db2.gz	ABALJVMFIITEIM-SNVBAGLBSA-N	-1	0	356.403	2.748	50	0		FFAARM
C[C@H]1Sc2ccc(C(=O)NCCc3ccc(C(=O)[O-])cc3)cc2NC1=O	ZINC000521402332	517714493	/nfs/dbraw/zinc/71/44/93/517714493.db2.gz	MNZOSAFPALHILC-LLVKDONJSA-N	-1	0	370.430	2.790	50	0		FFAARM
CC(C)(C)OC(=O)N1CC[C@@H](CS(=O)(=O)c2nc3ccccc3[n-]2)C1	ZINC000078791035	518812249	/nfs/dbraw/zinc/81/22/49/518812249.db2.gz	CTEHCCZGHASYDM-GFCCVEGCSA-N	-1	0	365.455	2.594	50	0		FFAARM
COc1cc2c(cc1OC)[C@@H](CC(=O)[O-])N(C(=O)/C=C\c1ccco1)CC2	ZINC000606441152	521068472	/nfs/dbraw/zinc/06/84/72/521068472.db2.gz	JFHMTWQEBIFUCV-OGZRUICASA-N	-1	0	371.389	2.911	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)CCC(=O)c2ccc(F)cc2)C[C@H]1c1ccncc1	ZINC000091304450	526284321	/nfs/dbraw/zinc/28/43/21/526284321.db2.gz	ZADLIZBRYQVVKS-DLBZAZTESA-N	-1	0	370.380	2.510	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)c2cc(-c3cccs3)nc3ccccc32)CCO1	ZINC000178280416	526286539	/nfs/dbraw/zinc/28/65/39/526286539.db2.gz	CKHCUTRYXWCRBG-INIZCTEOSA-N	-1	0	368.414	2.889	50	0		FFAARM
O=C([O-])[C@H]1CCN(C(=O)c2ccc(-c3ccc4c(c3)OCCO4)s2)C1	ZINC000269197383	526327046	/nfs/dbraw/zinc/32/70/46/526327046.db2.gz	QHYHKLRVPUWMRF-LBPRGKRZSA-N	-1	0	359.403	2.733	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)C[C@@H]1CCOC1)c1ccc(Br)cc1	ZINC000299742083	527625051	/nfs/dbraw/zinc/62/50/51/527625051.db2.gz	GTNTZGAZHPDWIT-GXFFZTMASA-N	-1	0	356.216	2.508	50	0		FFAARM
Cc1nn(C)c(Oc2cccnc2)c1[N-]S(=O)(=O)Cc1ccccc1	ZINC000089512524	527680649	/nfs/dbraw/zinc/68/06/49/527680649.db2.gz	PZZUKNNDSBDQQH-UHFFFAOYSA-N	-1	0	358.423	2.858	50	0		FFAARM
CN1C(=O)CC(C)(C)c2cc(S(=O)(=O)[N-]c3nccs3)ccc21	ZINC000096101184	536306925	/nfs/dbraw/zinc/30/69/25/536306925.db2.gz	PYIJGEFORWMVIL-UHFFFAOYSA-N	-1	0	351.453	2.588	50	0		FFAARM
COc1ccccc1OC1(C(=O)[O-])CCN(c2cc(C3CC3)ncn2)CC1	ZINC000082099540	537087712	/nfs/dbraw/zinc/08/77/12/537087712.db2.gz	YSDBHCPTJATHQI-UHFFFAOYSA-N	-1	0	369.421	2.865	50	0		FFAARM
COc1ccc(CC(=O)[O-])cc1S(=O)(=O)Nc1ccc(F)cc1Cl	ZINC000048355105	570951090	/nfs/dbraw/zinc/95/10/90/570951090.db2.gz	DRFDMFUEITULAI-UHFFFAOYSA-N	-1	0	373.789	2.916	50	0		FFAARM
Cc1cc2ncc(C(=O)OCc3csc(Br)c3)c(=O)n2[n-]1	ZINC000084129425	571074636	/nfs/dbraw/zinc/07/46/36/571074636.db2.gz	BAVDFJBMNBCUCB-UHFFFAOYSA-N	-1	0	368.212	2.924	50	0		FFAARM
C[S@](=O)Cc1cccc(NC(=O)CC2(C(=O)[O-])Cc3ccccc3C2)c1	ZINC000169987663	571260317	/nfs/dbraw/zinc/26/03/17/571260317.db2.gz	LOWIZNONJKESGC-SANMLTNESA-N	-1	0	371.458	2.764	50	0		FFAARM
CC(C)(C)n1cc(CN2CCN(Cc3cccc(C(=O)[O-])c3)CC2)cn1	ZINC000666573525	599964864	/nfs/dbraw/zinc/96/48/64/599964864.db2.gz	SYKCDDQQEFISFU-UHFFFAOYSA-N	-1	0	356.470	2.654	50	0		FFAARM
O=C([O-])C1(C(=O)Nc2nnc(Cc3cccc(Cl)c3)s2)CCC1	ZINC000663091625	732382689	/nfs/dbraw/zinc/38/26/89/732382689.db2.gz	LGCCGRJYUNNWDD-UHFFFAOYSA-N	-1	0	351.815	2.976	50	0		FFAARM
C[C@@H]1OCCC[C@H]1C(=O)N[C@@H](C(=O)[O-])c1ccccc1Br	ZINC000668295082	733103776	/nfs/dbraw/zinc/10/37/76/733103776.db2.gz	IZLRQVOKBAXQRC-OPQQBVKSSA-N	-1	0	356.216	2.506	50	0		FFAARM
O=S(=O)([N-]c1ccc(N2CCOCC2)cn1)c1ccc(C(F)F)cc1	ZINC000585083523	845948739	/nfs/dbraw/zinc/94/87/39/845948739.db2.gz	PXSSWENDGUYXTL-UHFFFAOYSA-N	-1	0	369.393	2.657	50	0		FFAARM
O=C([O-])[C@@H](NC(=O)[C@H]1C[C@@H]1c1cccc(C(F)(F)F)c1)[C@@H]1CCCOC1	ZINC000262705299	939066743	/nfs/dbraw/zinc/06/67/43/939066743.db2.gz	AKOKVMLNINLOGP-RZFFKMDDSA-N	-1	0	371.355	2.805	50	0		FFAARM
Cc1cc(C)nc([N-]S(=O)(=O)c2ccc(NC(=O)[C@@H](C)C3CC3)cc2)n1	ZINC000888093343	976556060	/nfs/dbraw/zinc/55/60/60/976556060.db2.gz	BWHURBXHOGJOGN-ZDUSSCGKSA-N	-1	0	374.466	2.879	50	0		FFAARM
CN(Cc1cc(-c2ccccn2)no1)c1nc2cc(C(=O)[O-])ccc2n1C	ZINC001529187738	1062210566	/nfs/dbraw/zinc/21/05/66/1062210566.db2.gz	ZXFRCSFVLNMGFP-UHFFFAOYSA-N	-1	0	363.377	2.958	50	0		FFAARM
CCOC(=O)COc1ccc(C([O-])(C(F)(F)F)C(F)(F)F)c(O)c1	ZINC000001089654	219368541	/nfs/dbraw/zinc/36/85/41/219368541.db2.gz	BQLVJAWHWRHIFD-UHFFFAOYSA-N	-1	0	362.222	2.646	50	0		FFAARM
Cc1nn(-c2cccc(Cl)c2)nc1C(=O)NCc1ccc(C(=O)[O-])cc1	ZINC000225441843	209811400	/nfs/dbraw/zinc/81/14/00/209811400.db2.gz	CXALHVAMWHWOOR-UHFFFAOYSA-N	-1	0	370.796	2.857	50	0		FFAARM
COc1cc2c(cc1OC)[C@@H](c1c([O-])c3ccccc3oc1=O)NCC2	ZINC000020759071	209631115	/nfs/dbraw/zinc/63/11/15/209631115.db2.gz	HWRSRINZSFJLAW-SFHVURJKSA-N	-1	0	353.374	2.751	50	0	biogenic	FFAARM
CC1CCN(S(=O)(=O)c2ccc(Br)c(C(=O)[O-])c2)CC1	ZINC000000753262	209482594	/nfs/dbraw/zinc/48/25/94/209482594.db2.gz	MZCGRCDKTRZYAU-UHFFFAOYSA-N	-1	0	362.245	2.568	50	0		FFAARM
O=C([O-])/C=C/C(=O)N1N=C(c2ccccc2)C[C@@H]1c1cccc([N+](=O)[O-])c1	ZINC000000862323	209378395	/nfs/dbraw/zinc/37/83/95/209378395.db2.gz	ZNXCVFGTISGIIR-OAGJVSPASA-N	-1	0	365.345	2.913	50	0		FFAARM
O=C([O-])c1ccc(S(=O)(=O)N[C@@H]2CCCC[C@H]2C(F)(F)F)c(F)c1	ZINC000225436630	209363470	/nfs/dbraw/zinc/36/34/70/209363470.db2.gz	XFUCACKIMWFIBN-MWLCHTKSSA-N	-1	0	369.336	2.923	50	0		FFAARM
O=C([O-])CN(C(=O)[C@@H]1C[C@H]1c1cccc(C(F)(F)F)c1)C1CCOCC1	ZINC000238104175	209360770	/nfs/dbraw/zinc/36/07/70/209360770.db2.gz	LWCHWTCZLNNJBI-LSDHHAIUSA-N	-1	0	371.355	2.901	50	0		FFAARM
O=C([O-])CN(C(=O)[C@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1)C1CCOCC1	ZINC000238104742	209360030	/nfs/dbraw/zinc/36/00/30/209360030.db2.gz	PDKVPQKQEAJEKL-CABCVRRESA-N	-1	0	371.355	2.901	50	0		FFAARM
O=C([O-])[C@H]1Cc2ccccc2CN1C(=O)c1cccc(Nc2cnccn2)c1	ZINC000238045471	209358002	/nfs/dbraw/zinc/35/80/02/209358002.db2.gz	AQWNRXKMCGVNEI-GOSISDBHSA-N	-1	0	374.400	2.872	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)c1cc(N2CCCC2=O)ccc1F)c1ccccc1	ZINC000237996996	209357337	/nfs/dbraw/zinc/35/73/37/209357337.db2.gz	WPWPFBXXHKMJFL-KRWDZBQOSA-N	-1	0	370.380	2.898	50	0		FFAARM
Cc1ccc(-n2ncc(C(=O)N3CC[C@H](C(=O)[O-])C3)c2C(F)(F)F)cc1	ZINC000237843020	209355646	/nfs/dbraw/zinc/35/56/46/209355646.db2.gz	OJTWWUBKUQFNDZ-NSHDSACASA-N	-1	0	367.327	2.746	50	0		FFAARM
Cc1nc(-c2ccccc2)sc1C(=O)N(CC(=O)[O-])C1CCOCC1	ZINC000237708058	209351803	/nfs/dbraw/zinc/35/18/03/209351803.db2.gz	UWMUYTVOOHFBGG-UHFFFAOYSA-N	-1	0	360.435	2.824	50	0		FFAARM
Cc1nc(C(=O)N(C[C@@H](C)C(=O)[O-])C2CC2)nn1-c1ccc(Cl)cc1	ZINC000237388855	209346089	/nfs/dbraw/zinc/34/60/89/209346089.db2.gz	KNBNZSLNAVHYBF-SNVBAGLBSA-N	-1	0	362.817	2.554	50	0		FFAARM
CSc1ncc2c([O-])c(C(=O)Nc3ccc(Cl)cn3)sc2n1	ZINC000103098270	209245775	/nfs/dbraw/zinc/24/57/75/209245775.db2.gz	GOBJYFDMUAGFQL-JTQLQIEISA-N	-1	0	352.828	2.543	50	0		FFAARM
COc1ccccc1[N-]S(=O)(=O)c1cc2c3c(c1)CCCN3C(=O)[C@@H]2C	ZINC000102655088	209239966	/nfs/dbraw/zinc/23/99/66/209239966.db2.gz	PPNODIGRFZORJE-GFCCVEGCSA-N	-1	0	372.446	2.892	50	0		FFAARM
Cn1c(=O)c2ccc(C(=O)N[C@H]3CCc4ccccc43)cc2[n-]c1=S	ZINC000102262587	209233430	/nfs/dbraw/zinc/23/34/30/209233430.db2.gz	AQORZMVEYBEGGM-HNNXBMFYSA-N	-1	0	351.431	2.640	50	0		FFAARM
CC(C)=CC[C@@]1(C(=O)[O-])CCCN(C(=O)CC2=CSC3=NCCN23)C1	ZINC000101773843	209230098	/nfs/dbraw/zinc/23/00/98/209230098.db2.gz	OWGRPYVAQQDIPF-SFHVURJKSA-N	-1	0	363.483	2.686	50	0		FFAARM
CCOc1ccc(Cn2[nH][n-]c3c(=O)n(-c4ccc(F)cc4)c(=O)c2=3)cc1	ZINC000101167790	209221875	/nfs/dbraw/zinc/22/18/75/209221875.db2.gz	HNBNATATXINMOD-DLBZAZTESA-N	-1	0	368.368	2.718	50	0		FFAARM
Cc1cc(C)n(CC2(CNC(=O)c3cc(=O)c4cccc(F)c4[n-]3)CC2)n1	ZINC000097334300	209178560	/nfs/dbraw/zinc/17/85/60/209178560.db2.gz	PGFARRYHQGLSJZ-UHFFFAOYSA-N	-1	0	368.412	2.691	50	0		FFAARM
COc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccccc4Cl)c=3c2=O)cc1	ZINC000096286252	209150493	/nfs/dbraw/zinc/15/04/93/209150493.db2.gz	NZQBOKANXRQAPA-CVEARBPZSA-N	-1	0	370.796	2.842	50	0		FFAARM
O=C([O-])Cn1nc(-c2c[nH]c3ccccc32)nc1CCc1cc(Cl)no1	ZINC000096180030	209130949	/nfs/dbraw/zinc/13/09/49/209130949.db2.gz	ONUJZCNUTDJRHZ-UHFFFAOYSA-N	-1	0	371.784	2.938	50	0		FFAARM
COc1cccc2c1OC[C@]1(C(=O)[O-])CN(C(=O)c3ccccc3F)C[C@H]21	ZINC000096161246	209128068	/nfs/dbraw/zinc/12/80/68/209128068.db2.gz	NSOKVGYYGFBWHE-JLTOFOAXSA-N	-1	0	371.364	2.537	50	0		FFAARM
Cc1nc(CCC(=O)N2CCCCCC2)n(-c2ccccc2C(=O)[O-])n1	ZINC000096151811	209124575	/nfs/dbraw/zinc/12/45/75/209124575.db2.gz	NGEQKEBRHGSACE-UHFFFAOYSA-N	-1	0	356.426	2.609	50	0		FFAARM
COc1cc(/C=C/C(=O)N2CCC[C@H](C(=O)[O-])C2)cc(Cl)c1OC	ZINC000013170992	249318829	/nfs/dbraw/zinc/31/88/29/249318829.db2.gz	UKFZZSKNQUWDRW-FYJFLYSWSA-N	-1	0	353.802	2.694	50	0		FFAARM
O=C(CSc1nc2ccccc2o1)N[C@H](Cc1ccccc1)C(=O)[O-]	ZINC000009026962	206801881	/nfs/dbraw/zinc/80/18/81/206801881.db2.gz	UQDMWDZYPGVNMA-CQSZACIVSA-N	-1	0	356.403	2.732	50	0		FFAARM
C#Cc1cccc(NS(=O)(=O)c2cc(Cl)c(F)c(C(=O)[O-])c2)c1	ZINC000089261936	206804123	/nfs/dbraw/zinc/80/41/23/206804123.db2.gz	UANXHUYIJGOWRB-UHFFFAOYSA-N	-1	0	353.758	2.959	50	0		FFAARM
CC(=O)[N-]S(=O)(=O)c1ccc(NC(=O)C[C@@H](C)c2ccccc2)cc1	ZINC000001151508	206862605	/nfs/dbraw/zinc/86/26/05/206862605.db2.gz	MFSDUWFVFGLXGX-CYBMUJFWSA-N	-1	0	360.435	2.644	50	0		FFAARM
COc1ccc(OC)c(/C=C2/SC(=O)N(CCCC(=O)[O-])C2=O)c1	ZINC000002418852	206915393	/nfs/dbraw/zinc/91/53/93/206915393.db2.gz	MEVDFVSZJDLBQR-UKTHLTGXSA-N	-1	0	351.380	2.605	50	0		FFAARM
CCOC(=O)c1c(NC(=O)CSCC(=O)[O-])sc2c1CCCC2	ZINC000004324131	207013201	/nfs/dbraw/zinc/01/32/01/207013201.db2.gz	AAMRZMICYKYEQJ-UHFFFAOYSA-N	-1	0	357.453	2.560	50	0		FFAARM
COc1ccc(S(=O)(=O)N(CC(=O)[O-])C2CCCCC2)cc1Cl	ZINC000004408164	207017953	/nfs/dbraw/zinc/01/79/53/207017953.db2.gz	XBPNNDJTQMGHSP-UHFFFAOYSA-N	-1	0	361.847	2.757	50	0		FFAARM
O=C(NC12CC3CC(CC(C3)C1)C2)c1c([O-])c2cccc3c2n(c1=O)CC3	ZINC000004366758	207016688	/nfs/dbraw/zinc/01/66/88/207016688.db2.gz	CGTBTHXAXKZADJ-UHFFFAOYSA-N	-1	0	364.445	2.962	50	0		FFAARM
O=C([O-])c1cc2n(n1)[C@H](C(F)(F)F)C[C@@H](c1ccc3c(c1)OCO3)N2	ZINC000004812139	207050200	/nfs/dbraw/zinc/05/02/00/207050200.db2.gz	XLRYNLAQFRRTLC-UFBFGSQYSA-N	-1	0	355.272	2.970	50	0		FFAARM
COc1ccc(C)cc1[N-]S(=O)(=O)c1ccc2c(c1)CCN2C(C)=O	ZINC000004884394	207058853	/nfs/dbraw/zinc/05/88/53/207058853.db2.gz	PYBRZNVKSZGSIF-UHFFFAOYSA-N	-1	0	360.435	2.713	50	0		FFAARM
O=C(N[C@]1(C(F)(F)F)[N-]c2nc3ccccc3n2C1=O)c1ccccc1	ZINC000005209852	207087567	/nfs/dbraw/zinc/08/75/67/207087567.db2.gz	HMNWHHJKIKCOET-INIZCTEOSA-N	-1	0	360.295	2.791	50	0		FFAARM
Cc1ccc(C(=O)COC(=O)c2ccccc2[N-]S(C)(=O)=O)c(C)c1	ZINC000005574308	207106748	/nfs/dbraw/zinc/10/67/48/207106748.db2.gz	JRKFWEKKAJQACD-UHFFFAOYSA-N	-1	0	361.419	2.715	50	0		FFAARM
CCN(CC)C(=O)c1ccc([N-]S(=O)(=O)c2ccccc2OC)cc1	ZINC000005602584	207107578	/nfs/dbraw/zinc/10/75/78/207107578.db2.gz	ZTOKNRXUNDZFOY-UHFFFAOYSA-N	-1	0	362.451	2.978	50	0		FFAARM
COc1ccc(C[C@H](C(=O)Nc2cc(C)ccc2C)c2nnn[n-]2)cc1	ZINC000005682079	207111713	/nfs/dbraw/zinc/11/17/13/207111713.db2.gz	QNOICPGXUJRLSU-INIZCTEOSA-N	-1	0	351.410	2.790	50	0		FFAARM
O=C([O-])c1cccc(NC2=C(Cl)C(=O)O[C@H]2OC(=O)c2ccccc2)c1	ZINC000005899605	207121414	/nfs/dbraw/zinc/12/14/14/207121414.db2.gz	DQXGRTBQRWDJHU-GOSISDBHSA-N	-1	0	373.748	2.987	50	0		FFAARM
CCC(=O)N1CCc2cc(S(=O)(=O)[N-]c3ccccc3OC)ccc21	ZINC000006729112	207156719	/nfs/dbraw/zinc/15/67/19/207156719.db2.gz	SLEFANLVTUULFG-UHFFFAOYSA-N	-1	0	360.435	2.795	50	0		FFAARM
O=C([O-])[C@H](NC(=O)COc1ccc2ccccc2c1)c1ccc(O)cc1	ZINC000006760727	207163186	/nfs/dbraw/zinc/16/31/86/207163186.db2.gz	COFCMTWZPMKYIH-LJQANCHMSA-N	-1	0	351.358	2.866	50	0		FFAARM
COc1ccccc1[N-]S(=O)(=O)c1cc(C(=O)N2CCC2)ccc1C	ZINC000008725694	207245242	/nfs/dbraw/zinc/24/52/42/207245242.db2.gz	QSTKUARWJFYYMF-UHFFFAOYSA-N	-1	0	360.435	2.650	50	0		FFAARM
O=C([N-]N1C(=O)NC2(CCCCC2)C1=O)c1ccc(Cl)cc1Cl	ZINC000036112477	207261875	/nfs/dbraw/zinc/26/18/75/207261875.db2.gz	WAKGEHWCSYZNJP-UHFFFAOYSA-N	-1	0	356.209	2.893	50	0		FFAARM
CCc1ccccc1NC(=O)c1cccc(N2C[C@H](C(=O)[O-])CC2=O)c1	ZINC000009592133	207278154	/nfs/dbraw/zinc/27/81/54/207278154.db2.gz	ISVDLXNWWWHZCP-OAHLLOKOSA-N	-1	0	352.390	2.939	50	0		FFAARM
COc1ccc(NC(C)=O)cc1S(=O)(=O)[N-]c1ccc(C(C)=O)cc1	ZINC000009968768	207291222	/nfs/dbraw/zinc/29/12/22/207291222.db2.gz	KDDWXVNXEFIXNM-UHFFFAOYSA-N	-1	0	362.407	2.657	50	0		FFAARM
Cn1ccc([N-]S(=O)(=O)c2ccc(Br)cc2Cl)n1	ZINC000012526153	207385035	/nfs/dbraw/zinc/38/50/35/207385035.db2.gz	AQRJMGPQDRYUFN-UHFFFAOYSA-N	-1	0	350.625	2.637	50	0		FFAARM
O=C([O-])[C@@H](Cc1c[nH]c2ccccc12)NC(=O)NCc1cccc(F)c1F	ZINC000013236829	207454340	/nfs/dbraw/zinc/45/43/40/207454340.db2.gz	DQTKMDMKJTWHDB-MRXNPFEDSA-N	-1	0	373.359	2.941	50	0		FFAARM
CCOc1cc(C(=O)N2CCC[C@H](C(=O)[O-])C2)cc(OCC)c1OCC	ZINC000013170238	207454375	/nfs/dbraw/zinc/45/43/75/207454375.db2.gz	KOMGPYNSVIBDAA-ZDUSSCGKSA-N	-1	0	365.426	2.820	50	0		FFAARM
Cc1sc(NC(=O)[C@@H]2CC(C)=C(C)C[C@H]2C(=O)[O-])c(C(N)=O)c1C	ZINC000017072720	207605405	/nfs/dbraw/zinc/60/54/05/207605405.db2.gz	CXJGDABQUUDLPG-VXGBXAGGSA-N	-1	0	350.440	2.850	50	0		FFAARM
COC(=O)c1cc(C)sc1NC(=O)[C@H]1C2CCC(CC2)[C@H]1C(=O)[O-]	ZINC000017072895	207605545	/nfs/dbraw/zinc/60/55/45/207605545.db2.gz	ZOVUUBNABKYVSE-XYJRBWASSA-N	-1	0	351.424	2.919	50	0		FFAARM
COc1ccc(-c2nc(CC(=O)N[C@@H](CC(C)C)C(=O)[O-])cs2)cc1	ZINC000032124383	208026621	/nfs/dbraw/zinc/02/66/21/208026621.db2.gz	ZZKWMCYMXOQYRP-HNNXBMFYSA-N	-1	0	362.451	2.977	50	0	biogenic	FFAARM
C[C@@](CC(=O)Nc1ccc(C(=O)NC2CC2)cc1)(C(=O)[O-])c1ccccc1	ZINC000032771949	208040952	/nfs/dbraw/zinc/04/09/52/208040952.db2.gz	CCTIGNAMXBSTPM-NRFANRHFSA-N	-1	0	366.417	2.950	50	0		FFAARM
O=C([O-])Cn1cc([C@H](C(=O)[O-])[NH+]2CCCCC2)c2ccc(Cl)cc21	ZINC000036365415	208160211	/nfs/dbraw/zinc/16/02/11/208160211.db2.gz	NBZDNITZYAJBEV-MRXNPFEDSA-N	-1	0	350.802	2.991	50	0		FFAARM
O=C([O-])[C@@H]1CCCN(C(=O)Cn2ccc3c2cccc3Br)C1	ZINC000040282907	208245443	/nfs/dbraw/zinc/24/54/43/208245443.db2.gz	XJKDOSBLMYYJCT-LLVKDONJSA-N	-1	0	365.227	2.727	50	0		FFAARM
CCCSc1ncc(Cl)c(C(=O)N[C@@H](CCSC)C(=O)[O-])n1	ZINC000041156838	208283164	/nfs/dbraw/zinc/28/31/64/208283164.db2.gz	VAGPNQDPQGOAHA-VIFPVBQESA-N	-1	0	363.892	2.568	50	0		FFAARM
O=C([O-])[C@@H]1CCCN(C(=O)[C@H]2C[C@@H]2c2ccc(Br)cc2)C1	ZINC000299742453	208339789	/nfs/dbraw/zinc/33/97/89/208339789.db2.gz	JGMSNNHVUQHNLC-BNOWGMLFSA-N	-1	0	352.228	2.876	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)c1ccc2c(c1)NC(=O)CS2)c1ccc(F)cc1	ZINC000299744842	208340713	/nfs/dbraw/zinc/34/07/13/208340713.db2.gz	QEQCAASFIFATNC-CYBMUJFWSA-N	-1	0	374.393	2.816	50	0		FFAARM
CN(Cc1ccc(C(=O)[O-])cc1)C(=O)[C@@H]1C[C@@H]1c1ccc2c(c1)OCCO2	ZINC000299747614	208342464	/nfs/dbraw/zinc/34/24/64/208342464.db2.gz	DKFLKNCHKFSRKF-IAGOWNOFSA-N	-1	0	367.401	2.918	50	0		FFAARM
O=C(c1csc(S(=O)(=O)[N-]c2cccnc2)c1)N1CCCCCC1	ZINC000045961707	208343791	/nfs/dbraw/zinc/34/37/91/208343791.db2.gz	BMRLTDCWUXAYJE-UHFFFAOYSA-N	-1	0	365.480	2.960	50	0		FFAARM
CCOC(=O)CN(C)c1ccc(NC(=O)c2ccc(F)cc2)cc1C(=O)[O-]	ZINC000046053501	208356677	/nfs/dbraw/zinc/35/66/77/208356677.db2.gz	LWPBIGYAONKBRX-UHFFFAOYSA-N	-1	0	374.368	2.776	50	0		FFAARM
Cc1nc(-c2cccc(C(=O)N3[C@@H]4CCCC[C@H]4C[C@H]3C(=O)[O-])c2)no1	ZINC000299750360	208359183	/nfs/dbraw/zinc/35/91/83/208359183.db2.gz	NFJURMYHIGVHLG-MAZHCROVSA-N	-1	0	355.394	2.903	50	0		FFAARM
COc1cccc2c(C)c(C(=O)N(CCC(=O)[O-])C3CCOCC3)oc21	ZINC000299753716	208362225	/nfs/dbraw/zinc/36/22/25/208362225.db2.gz	ZBVAPJBEPPLILZ-UHFFFAOYSA-N	-1	0	361.394	2.846	50	0		FFAARM
O=C(c1ccc(CS(=O)(=O)c2nc3ccccc3[n-]2)cc1)N1CCCC1	ZINC000047940025	208385470	/nfs/dbraw/zinc/38/54/70/208385470.db2.gz	KNSAROPEEZKZQO-UHFFFAOYSA-N	-1	0	369.446	2.773	50	0		FFAARM
CN(CC(=O)Nc1ccccc1Cl)Cc1c([O-])nnn1-c1ccccc1	ZINC000057085106	208499245	/nfs/dbraw/zinc/49/92/45/208499245.db2.gz	FVUWOYWYJJBJCS-UHFFFAOYSA-N	-1	0	371.828	2.697	50	0		FFAARM
Cc1cccc(C)c1OC[C@@H](C)NC(=O)c1ccccc1NCC(=O)[O-]	ZINC000065383253	208669947	/nfs/dbraw/zinc/66/99/47/208669947.db2.gz	WATJIICYBDWCEX-OAHLLOKOSA-N	-1	0	356.422	2.997	50	0		FFAARM
CC1(C)[C@H](C(=O)[O-])[C@H]1C(=O)Nc1ccccc1C(=O)NCc1ccco1	ZINC000071286473	208760437	/nfs/dbraw/zinc/76/04/37/208760437.db2.gz	NOFWFTOHAHKXJQ-GJZGRUSLSA-N	-1	0	356.378	2.505	50	0		FFAARM
CC1(C)[C@H](C(=O)[O-])[C@@H]1C(=O)Nc1ccccc1C(=O)NCc1ccco1	ZINC000071286475	208760491	/nfs/dbraw/zinc/76/04/91/208760491.db2.gz	NOFWFTOHAHKXJQ-CABCVRRESA-N	-1	0	356.378	2.505	50	0		FFAARM
COc1cc(NC(=O)[C@H]2[C@H](C(=O)[O-])C2(C)C)ccc1NC(=O)c1ccco1	ZINC000071280377	208758726	/nfs/dbraw/zinc/75/87/26/208758726.db2.gz	XZJQARGVAKCOTF-HUUCEWRRSA-N	-1	0	372.377	2.836	50	0		FFAARM
COc1ccccc1[C@@H]1CN(C(=O)Cc2sc(C)nc2C)C[C@H]1C(=O)[O-]	ZINC000092036841	209012767	/nfs/dbraw/zinc/01/27/67/209012767.db2.gz	XJPHWTVXJCAPPA-LSDHHAIUSA-N	-1	0	374.462	2.638	50	0		FFAARM
Cc1cc(=O)[nH]c(C)c1C(=O)N1CCC[C@@H](c2cccc(C(=O)[O-])c2)C1	ZINC000095353537	209022712	/nfs/dbraw/zinc/02/27/12/209022712.db2.gz	ZCLJUJIWQGTHCF-MRXNPFEDSA-N	-1	0	354.406	2.710	50	0		FFAARM
CSc1ccccc1[C@@H](C(=O)[O-])N1CCN(Cc2ccccn2)CC1	ZINC000095360127	209028332	/nfs/dbraw/zinc/02/83/32/209028332.db2.gz	ONLWQBKYCJLFDQ-SFHVURJKSA-N	-1	0	357.479	2.747	50	0		FFAARM
Cc1nn(C)c(C)c1CCC(=O)N1CC[C@H](Cc2cccc(C(=O)[O-])c2)C1	ZINC000095389509	209045468	/nfs/dbraw/zinc/04/54/68/209045468.db2.gz	IRLSNHZPGZQIJV-QGZVFWFLSA-N	-1	0	369.465	2.759	50	0		FFAARM
NS(=O)(=O)c1ccc(-c2csc(-c3cccc(C(=O)[O-])c3)n2)cc1	ZINC000095952837	209090376	/nfs/dbraw/zinc/09/03/76/209090376.db2.gz	CQAIDIPTVWUHOJ-UHFFFAOYSA-N	-1	0	360.416	2.823	50	0		FFAARM
CC(C)Cc1cc(C(=O)N[C@H](Cc2cc(F)c(F)c(F)c2)C(=O)[O-])on1	ZINC000095504388	209066009	/nfs/dbraw/zinc/06/60/09/209066009.db2.gz	HCHGYXGJRJNDRZ-CYBMUJFWSA-N	-1	0	370.327	2.716	50	0		FFAARM
O=C([O-])CC[C@H]1CCCCN1C(=O)CCN1C(=O)CCc2ccccc21	ZINC000237981422	132248842	/nfs/dbraw/zinc/24/88/42/132248842.db2.gz	RMNXSSJQVUYMKU-MRXNPFEDSA-N	-1	0	358.438	2.602	50	0		FFAARM
O=C([O-])C[C@@H](CC(=O)N1CCN(c2ccccc2)CC1)c1ccccc1	ZINC000226748872	132288027	/nfs/dbraw/zinc/28/80/27/132288027.db2.gz	SPUMLYWIFHNHPN-GOSISDBHSA-N	-1	0	352.434	2.984	50	0		FFAARM
O=C([O-])c1cccc2c1OCCN2S(=O)(=O)c1ccc(Cl)s1	ZINC000089774297	132377731	/nfs/dbraw/zinc/37/77/31/132377731.db2.gz	HAKHUEAXZNYGJK-UHFFFAOYSA-N	-1	0	359.812	2.687	50	0		FFAARM
O=C([O-])CCC(=O)Nc1ccc(N2CCN(c3ccc(F)cc3)CC2)cc1	ZINC000004661695	132387065	/nfs/dbraw/zinc/38/70/65/132387065.db2.gz	VOEACBSCNZYOPR-UHFFFAOYSA-N	-1	0	371.412	2.956	50	0		FFAARM
O=C([O-])C1(Oc2ccc(F)cc2)CCN(c2ncnc3[nH]ccc32)CC1	ZINC000072410170	136145444	/nfs/dbraw/zinc/14/54/44/136145444.db2.gz	NRUGLSIAWIRXCU-UHFFFAOYSA-N	-1	0	356.357	2.600	50	0		FFAARM
Cc1cc(N2CCC(C(=O)[O-])(n3ccnc3)CC2)nc2cc(F)ccc12	ZINC000072438819	136147471	/nfs/dbraw/zinc/14/74/71/136147471.db2.gz	FYOUTSNAWMKGCN-UHFFFAOYSA-N	-1	0	354.385	2.959	50	0		FFAARM
CCC[C@H](C)C(=O)Nc1ccc(S(=O)(=O)[N-]c2nccc(C)n2)cc1	ZINC000000892636	506238367	/nfs/dbraw/zinc/23/83/67/506238367.db2.gz	VYLJKBHIINZIPE-LBPRGKRZSA-N	-1	0	362.455	2.961	50	0		FFAARM
O=C(Nc1ccc(S(=O)(=O)[N-]c2ncccn2)cc1)C1CCCCC1	ZINC000000939934	506239825	/nfs/dbraw/zinc/23/98/25/506239825.db2.gz	QTGWFUZJBCHEDF-UHFFFAOYSA-N	-1	0	360.439	2.796	50	0		FFAARM
CC(=NN=C1NC(=O)[C@H](CC(=O)[O-])S1)c1ccc(OCC(C)C)cc1	ZINC000000984858	506242001	/nfs/dbraw/zinc/24/20/01/506242001.db2.gz	NAJLIGAGWHNXGW-AWEZNQCLSA-N	-1	0	363.439	2.508	50	0		FFAARM
CC[C@@H](C)Oc1c(Br)cc(/C=C2/NC(=O)[N-]C2=O)cc1OC	ZINC000001149233	506251266	/nfs/dbraw/zinc/25/12/66/506251266.db2.gz	MSLTUFNTPJJNDR-JMUHATKESA-N	-1	0	369.215	2.815	50	0		FFAARM
COc1ccc(/C=C/C(=O)[O-])cc1S(=O)(=O)N1CCc2ccccc21	ZINC000001184637	506253453	/nfs/dbraw/zinc/25/34/53/506253453.db2.gz	PBPUTEGLEQSTHM-VQHVLOKHSA-N	-1	0	359.403	2.544	50	0		FFAARM
CCc1nc2sc(C)nn2c1S(=O)(=O)[N-]c1ccc(OC)cc1C	ZINC000065183924	506268491	/nfs/dbraw/zinc/26/84/91/506268491.db2.gz	NXAZFPBWHSDVCK-UHFFFAOYSA-N	-1	0	366.468	2.779	50	0		FFAARM
Cc1ccc(C)c([N-]S(=O)(=O)c2cc3n(c2)CCN(C(C)C)C3=O)c1	ZINC000065254748	506275819	/nfs/dbraw/zinc/27/58/19/506275819.db2.gz	JWLYHXYOXRZIFO-UHFFFAOYSA-N	-1	0	361.467	2.770	50	0		FFAARM
O=C([O-])C[C@@H](C(=O)N(c1ccccc1)c1ccccc1)N1CCOCC1	ZINC000002246350	506276179	/nfs/dbraw/zinc/27/61/79/506276179.db2.gz	LSIICUZIHOSMKT-SFHVURJKSA-N	-1	0	354.406	2.527	50	0		FFAARM
COc1ccc(S(=O)(=O)[N-]c2cccn3nc(C4CCC4)nc23)cc1	ZINC000065284035	506280561	/nfs/dbraw/zinc/28/05/61/506280561.db2.gz	LOWZJJYEFRZXPI-UHFFFAOYSA-N	-1	0	358.423	2.806	50	0		FFAARM
Cc1n[nH]c(C)c1S(=O)(=O)[N-]c1ccn(Cc2cccc(Cl)c2)n1	ZINC000002805006	506295306	/nfs/dbraw/zinc/29/53/06/506295306.db2.gz	DPSHDVLIJHVSRW-UHFFFAOYSA-N	-1	0	365.846	2.726	50	0		FFAARM
O=C([O-])C1(NS(=O)(=O)c2cccc(C(F)(F)F)c2)CCCCC1	ZINC000002889455	506300247	/nfs/dbraw/zinc/30/02/47/506300247.db2.gz	DDEMDTVJTHGHDA-UHFFFAOYSA-N	-1	0	351.346	2.771	50	0		FFAARM
Cc1cc2c[nH]nc2cc1[N-]S(=O)(=O)c1cc2c(cc1F)NC(=O)CC2	ZINC000065587889	506329491	/nfs/dbraw/zinc/32/94/91/506329491.db2.gz	WGNVAUAYAWMTTI-UHFFFAOYSA-N	-1	0	374.397	2.696	50	0		FFAARM
O=C([O-])[C@@H](Cc1ccccc1)NS(=O)(=O)c1cccc(C(F)(F)F)c1	ZINC000003640620	506348658	/nfs/dbraw/zinc/34/86/58/506348658.db2.gz	JFDJLMGVJXHLOF-CQSZACIVSA-N	-1	0	373.352	2.680	50	0		FFAARM
CSCC[C@@H](NC(=O)c1ccccc1NC(=O)c1ccccc1)C(=O)[O-]	ZINC000004043699	506355830	/nfs/dbraw/zinc/35/58/30/506355830.db2.gz	XQBVUFHOZSSWAC-MRXNPFEDSA-N	-1	0	372.446	2.875	50	0	biogenic	FFAARM
COc1ccc(C)cc1S(=O)(=O)N(CC(=O)[O-])c1cc(C)cc(C)c1	ZINC000004806143	506395339	/nfs/dbraw/zinc/39/53/39/506395339.db2.gz	ZSAJGRBEXJEIHM-UHFFFAOYSA-N	-1	0	363.435	2.900	50	0		FFAARM
CCN(C(=O)CSc1nnc(-c2ccccc2)c(=O)[n-]1)c1ccccc1	ZINC000005625421	506451601	/nfs/dbraw/zinc/45/16/01/506451601.db2.gz	JEVATQGIECOSGL-UHFFFAOYSA-N	-1	0	366.446	2.977	50	0		FFAARM
O=C([O-])c1ccc(Nc2nc3ccccc3c(N3CCOCC3)n2)cc1	ZINC000041148872	506494617	/nfs/dbraw/zinc/49/46/17/506494617.db2.gz	WUYBQDGOFBMADH-UHFFFAOYSA-N	-1	0	350.378	2.908	50	0		FFAARM
CC1(C)COc2cc([N-]S(=O)(=O)c3cccs3)ccc2NC1=O	ZINC000009168620	506686126	/nfs/dbraw/zinc/68/61/26/506686126.db2.gz	JLSBONSOWSEOIU-UHFFFAOYSA-N	-1	0	352.437	2.906	50	0		FFAARM
Cc1ccc(N[C@@](C)(C(=O)NCCCc2nnn[n-]2)c2ccccc2)cc1	ZINC000055211542	506698190	/nfs/dbraw/zinc/69/81/90/506698190.db2.gz	SPWSZQIHGQAESV-HXUWFJFHSA-N	-1	0	364.453	2.584	50	0		FFAARM
Cc1ccc(C(=O)[O-])c(N2Cc3cnn(Cc4ccc(F)cc4)c3C2)n1	ZINC000067446532	506884700	/nfs/dbraw/zinc/88/47/00/506884700.db2.gz	YWUAQIZCJHXYPS-UHFFFAOYSA-N	-1	0	352.369	2.992	50	0		FFAARM
CCCn1c(=O)cc([O-])nc1SCC(=O)Nc1cc(F)ccc1C	ZINC000012922565	506915366	/nfs/dbraw/zinc/91/53/66/506915366.db2.gz	HLFQTGWTKQZMEJ-UHFFFAOYSA-N	-1	0	351.403	2.537	50	0		FFAARM
CCOc1ccc(NS(=O)(=O)c2cccc(C(=O)[O-])c2)cc1OCC	ZINC000013348276	506939231	/nfs/dbraw/zinc/93/92/31/506939231.db2.gz	XYBMFMQTVYUINH-UHFFFAOYSA-N	-1	0	365.407	2.983	50	0		FFAARM
CS(=O)(=O)[N-]c1nc2ccc(C(=O)Nc3ccc(O)cc3)cc2s1	ZINC000013728923	506953483	/nfs/dbraw/zinc/95/34/83/506953483.db2.gz	DVQUNGXLHHPCJT-UHFFFAOYSA-N	-1	0	363.420	2.626	50	0		FFAARM
Cc1cc(-c2nnc(SCC(=O)[O-])n2[C@H](C)c2ccccc2)nn1C	ZINC000067689180	506978478	/nfs/dbraw/zinc/97/84/78/506978478.db2.gz	KZRBQBGURIEDCV-GFCCVEGCSA-N	-1	0	357.439	2.773	50	0		FFAARM
O=C1[N-]C(=O)N(Cc2ccccc2)C(=O)C1=C1C[C@H](c2ccccc2)NN1	ZINC000016995097	507111132	/nfs/dbraw/zinc/11/11/32/507111132.db2.gz	MUBADWQPHFIWNO-KSPIOAOGSA-N	-1	0	362.389	2.599	50	0		FFAARM
Cc1cc(=O)[nH]c2c(C)cc(S(=O)(=O)Nc3ccc(C(=O)[O-])cc3)cc12	ZINC000017043557	507113125	/nfs/dbraw/zinc/11/31/25/507113125.db2.gz	XGSAFXJQTPCGII-UHFFFAOYSA-N	-1	0	372.402	2.644	50	0		FFAARM
Cc1sc(NC(=O)[C@H]2CC(C)=C(C)C[C@@H]2C(=O)[O-])c(C(N)=O)c1C	ZINC000017072719	507113796	/nfs/dbraw/zinc/11/37/96/507113796.db2.gz	CXJGDABQUUDLPG-RYUDHWBXSA-N	-1	0	350.440	2.850	50	0		FFAARM
Cc1nn(-c2ccc(NC(=O)c3nn(C)cc3C(=O)[O-])cc2)c(C)c1Cl	ZINC000020614836	507230277	/nfs/dbraw/zinc/23/02/77/507230277.db2.gz	ZFZCCCZWTKWAJI-UHFFFAOYSA-N	-1	0	373.800	2.827	50	0		FFAARM
COc1cc(C)c(S(=O)(=O)[N-]c2cnn(Cc3ccccn3)c2)c(C)c1	ZINC000058180576	507380389	/nfs/dbraw/zinc/38/03/89/507380389.db2.gz	GJIOBSBHOUPTGH-UHFFFAOYSA-N	-1	0	372.450	2.753	50	0		FFAARM
O=C([O-])CCC(=O)N1N=C(c2ccc3c(c2)OCO3)C[C@H]1c1ccccc1	ZINC000058196776	507383867	/nfs/dbraw/zinc/38/38/67/507383867.db2.gz	GNPPGEGZYWMWFN-INIZCTEOSA-N	-1	0	366.373	2.958	50	0		FFAARM
Cc1cc(Br)c([O-])c(C(=O)NCCC(=O)N2CCCCC2)c1	ZINC000058393472	507411798	/nfs/dbraw/zinc/41/17/98/507411798.db2.gz	IBBQNKZEJIYEGO-UHFFFAOYSA-N	-1	0	369.259	2.596	50	0		FFAARM
C[C@@H](COCC(F)(F)F)NC(=O)c1ccc2c(c1)[n-]c(=S)[nH]c2=O	ZINC000058420771	507417165	/nfs/dbraw/zinc/41/71/65/507417165.db2.gz	JQVCLRKOVJSLMN-ZETCQYMHSA-N	-1	0	361.345	2.695	50	0		FFAARM
Nc1c(C(=O)Nc2cccc(C(=O)[O-])c2)cnc2c(-c3ccccc3)cnn21	ZINC000071283835	507700873	/nfs/dbraw/zinc/70/08/73/507700873.db2.gz	SSJPHDSUAUXDNN-UHFFFAOYSA-N	-1	0	373.372	2.929	50	0		FFAARM
COCCNS(=O)(=O)c1cc(C(=O)[O-])cc(-c2cccc(Cl)c2)c1	ZINC000071416391	507704900	/nfs/dbraw/zinc/70/49/00/507704900.db2.gz	KJWDZYZJYBDJTH-UHFFFAOYSA-N	-1	0	369.826	2.630	50	0		FFAARM
COc1ccc(CN2CCO[C@@H](Cc3ccc(F)cc3)C2)cc1C(=O)[O-]	ZINC000071745581	507707601	/nfs/dbraw/zinc/70/76/01/507707601.db2.gz	QCMLIINTYMLFBV-KRWDZBQOSA-N	-1	0	359.397	2.976	50	0		FFAARM
CO[N-]C(=O)C1(Oc2ccccc2)CCN(C(=O)OC(C)(C)C)CC1	ZINC000063727113	507765771	/nfs/dbraw/zinc/76/57/71/507765771.db2.gz	BOJCNBSDOWWVIL-UHFFFAOYSA-N	-1	0	350.415	2.513	50	0		FFAARM
CCCn1ccnc1CN1CCC(C(=O)[O-])(n2ccc(C(C)C)n2)CC1	ZINC000072407842	507784410	/nfs/dbraw/zinc/78/44/10/507784410.db2.gz	PJTOXVQXMGUTAE-UHFFFAOYSA-N	-1	0	359.474	2.689	50	0		FFAARM
CSc1ccccc1NC(=O)N1CCn2nc(CCC(=O)[O-])cc2C1	ZINC000072433533	507790405	/nfs/dbraw/zinc/79/04/05/507790405.db2.gz	PIWQVGJMSSRPSU-UHFFFAOYSA-N	-1	0	360.439	2.670	50	0		FFAARM
CCc1ncc(CN2CCC(Oc3cc(C)ccc3F)(C(=O)[O-])CC2)cn1	ZINC000072440255	507792239	/nfs/dbraw/zinc/79/22/39/507792239.db2.gz	VDVYGGHEWVIRIJ-UHFFFAOYSA-N	-1	0	373.428	2.985	50	0		FFAARM
O=C([O-])c1ccc(C[C@@H]2CCN(C(=O)COc3ccc(F)cc3)C2)cc1	ZINC000072479901	507797410	/nfs/dbraw/zinc/79/74/10/507797410.db2.gz	CVUFNXXGJDSVBP-HNNXBMFYSA-N	-1	0	357.381	2.994	50	0		FFAARM
COc1ccccc1OC1(C(=O)[O-])CCN(C(=O)[C@@H]2CC=CCC2)CC1	ZINC000072481415	507797926	/nfs/dbraw/zinc/79/79/26/507797926.db2.gz	QRNBRPMAPUWRGC-OAHLLOKOSA-N	-1	0	359.422	2.876	50	0		FFAARM
CCc1cc(C(=O)N2C[C@@H](c3ccccc3OC)[C@H](C(=O)[O-])C2)ccn1	ZINC000091587301	507993945	/nfs/dbraw/zinc/99/39/45/507993945.db2.gz	RTOJNXGQEBSPRN-DLBZAZTESA-N	-1	0	354.406	2.593	50	0		FFAARM
COc1ccc([N-]S(=O)(=O)c2cc(-c3cc[nH]n3)oc2C)cc1OC	ZINC000075518814	508113234	/nfs/dbraw/zinc/11/32/34/508113234.db2.gz	HLRDOCXUOLSCET-UHFFFAOYSA-N	-1	0	363.395	2.796	50	0		FFAARM
CCN(CC)C(=O)N1CCc2nc3cc(-c4ccccc4)[n-]n3c(=O)c2C1	ZINC000097087010	508218711	/nfs/dbraw/zinc/21/87/11/508218711.db2.gz	FMIPXUZJODFONG-UHFFFAOYSA-N	-1	0	365.437	2.510	50	0		FFAARM
COc1ccccc1CNC(=O)c1c([O-])c2cccc3c2n(c1=O)CCC3	ZINC000100613721	508239513	/nfs/dbraw/zinc/23/95/13/508239513.db2.gz	IYDJAAFFLXSYIA-UHFFFAOYSA-N	-1	0	364.401	2.592	50	0	biogenic	FFAARM
O=C(CCc1cc(=O)[n-]o1)N1CCC[C@H]1c1nc(-c2ccccc2)no1	ZINC000077419675	508314254	/nfs/dbraw/zinc/31/42/54/508314254.db2.gz	FPZISDUBHFFUIT-AWEZNQCLSA-N	-1	0	354.366	2.727	50	0		FFAARM
O=C([O-])[C@@H](NC(=O)c1nn(-c2ccccc2)c2c1CCC2)c1ccccc1	ZINC000156485836	508427497	/nfs/dbraw/zinc/42/74/97/508427497.db2.gz	MNHVMPKJTVEHIP-SFHVURJKSA-N	-1	0	361.401	2.917	50	0		FFAARM
Cn1nc(C2CCCCC2)cc1NC(=O)c1n[n-]c2ccccc2c1=O	ZINC000151016498	508940416	/nfs/dbraw/zinc/94/04/16/508940416.db2.gz	HLVPUMTUKDPCBU-UHFFFAOYSA-N	-1	0	351.410	2.957	50	0		FFAARM
CCO[C@H]1C[C@@H](N(C)C(=O)c2ccc3c(c2)[n-]c(=S)[nH]c3=O)C12CCC2	ZINC000160541687	509000478	/nfs/dbraw/zinc/00/04/78/509000478.db2.gz	OROIFRRWOUFPOM-CABCVRRESA-N	-1	0	373.478	2.632	50	0		FFAARM
CCC[C@H](C)c1cc([N-]S(=O)(=O)c2cnc3c(c2)c(C)nn3C)n[nH]1	ZINC000162675293	509276958	/nfs/dbraw/zinc/27/69/58/509276958.db2.gz	RRYSMEXVEYNIGE-JTQLQIEISA-N	-1	0	362.459	2.704	50	0		FFAARM
Cc1ccc(C(C)(C)NC(=O)CC[C@@]2(CCC(=O)[O-])CCC(=O)N2)cc1	ZINC000219263668	509285855	/nfs/dbraw/zinc/28/58/55/509285855.db2.gz	QNLZWOKKPMHHPK-FQEVSTJZSA-N	-1	0	360.454	2.640	50	0		FFAARM
Cc1nn(C)c(C)c1S(=O)(=O)[N-]c1cc(F)ccc1OCC1CC1	ZINC000189476148	509593015	/nfs/dbraw/zinc/59/30/15/509593015.db2.gz	BMSNLCLIJGHVTK-UHFFFAOYSA-N	-1	0	353.419	2.766	50	0		FFAARM
COC(=O)[C@H]([N-]S(=O)(=O)c1c(F)cccc1F)c1c(C)cccc1C	ZINC000170598307	509676053	/nfs/dbraw/zinc/67/60/53/509676053.db2.gz	QYXVSTVOBYOSJV-OAHLLOKOSA-N	-1	0	369.389	2.774	50	0		FFAARM
C[C@H]1CC[C@@H](CCC(=O)[N-]S(=O)(=O)c2ccc(F)c3ncccc23)O1	ZINC000170645642	509693826	/nfs/dbraw/zinc/69/38/26/509693826.db2.gz	IUXIAFDJLXYMDI-RYUDHWBXSA-N	-1	0	366.414	2.527	50	0		FFAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)c2ccc(C(=O)c3cc[nH]c3)cc2)C1	ZINC000237969528	509787204	/nfs/dbraw/zinc/78/72/04/509787204.db2.gz	CEUITMYDJYURCN-AWEZNQCLSA-N	-1	0	354.406	2.963	50	0		FFAARM
O=C([O-])CC[C@H]1CCCN(C(=O)c2ccc(C(=O)c3cc[nH]c3)cc2)C1	ZINC000238018950	509801017	/nfs/dbraw/zinc/80/10/17/509801017.db2.gz	CEUITMYDJYURCN-CQSZACIVSA-N	-1	0	354.406	2.963	50	0		FFAARM
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)c1ccc(C(=O)[O-])cc1	ZINC000262313318	510241537	/nfs/dbraw/zinc/24/15/37/510241537.db2.gz	QFAIDUVPLRCUFA-UHFFFAOYSA-N	-1	0	368.389	2.882	50	0		FFAARM
O=C([O-])COc1cccc(C(=O)N[C@@H]2CCO[C@@H](c3ccccc3)C2)c1	ZINC000262850793	510439072	/nfs/dbraw/zinc/43/90/72/510439072.db2.gz	WWLUVJMSSZXYFW-SJLPKXTDSA-N	-1	0	355.390	2.800	50	0		FFAARM
O=C([O-])COc1cccc(C(=O)N[C@@H]2CCO[C@H](c3ccccc3)C2)c1	ZINC000262850789	510439217	/nfs/dbraw/zinc/43/92/17/510439217.db2.gz	WWLUVJMSSZXYFW-AEFFLSMTSA-N	-1	0	355.390	2.800	50	0		FFAARM
O=C([O-])[C@H]1CCCN(C(=O)N[C@H](Cc2ccccn2)c2ccccc2)C1	ZINC000263408199	510694087	/nfs/dbraw/zinc/69/40/87/510694087.db2.gz	UHMCQACKDXSXKL-FUHWJXTLSA-N	-1	0	353.422	2.872	50	0		FFAARM
Cc1nc(NC(=O)CN2CCCC[C@H]2c2ccccn2)sc1C(=O)[O-]	ZINC000299767294	511673400	/nfs/dbraw/zinc/67/34/00/511673400.db2.gz	FWKMBVLHFYMECQ-ZDUSSCGKSA-N	-1	0	360.439	2.710	50	0		FFAARM
CSCC[C@H](NC(=O)N(C)Cc1cc2cc(F)ccc2[nH]1)C(=O)[O-]	ZINC000426658509	514008347	/nfs/dbraw/zinc/00/83/47/514008347.db2.gz	QRDVZPWGWNKQLS-AWEZNQCLSA-N	-1	0	353.419	2.655	50	0		FFAARM
O=C([O-])c1cccc(CNC(=O)C2CCC(NC(=O)C3CCCC3)CC2)c1	ZINC000531744209	516619029	/nfs/dbraw/zinc/61/90/29/516619029.db2.gz	BWERGRRSOZEJBV-UHFFFAOYSA-N	-1	0	372.465	2.866	50	0		FFAARM
COc1cc(C(=O)N2CCC[C@@H]2C(=O)[O-])ccc1OCc1c(C)noc1C	ZINC000521368609	517707225	/nfs/dbraw/zinc/70/72/25/517707225.db2.gz	UPFLWXKBIVZVRF-OAHLLOKOSA-N	-1	0	374.393	2.568	50	0		FFAARM
COc1ccccc1/C=C(\C(=O)N1CCO[C@@H](C(=O)[O-])C1)c1ccccc1	ZINC000606441596	521068948	/nfs/dbraw/zinc/06/89/48/521068948.db2.gz	PTXWLLSDBYLQOC-BLMOFCDVSA-N	-1	0	367.401	2.548	50	0		FFAARM
Cc1nn(CCC(=O)[O-])c(C)c1NC(=O)[C@H]1C[C@]12CCc1ccccc12	ZINC000630330845	522795330	/nfs/dbraw/zinc/79/53/30/522795330.db2.gz	GLUQIABFRNQRGA-UZLBHIALSA-N	-1	0	353.422	2.817	50	0		FFAARM
O=C([O-])[C@@H]1CCN(C(=O)COc2ccccc2OCc2ccccc2)C1	ZINC000269215651	526278338	/nfs/dbraw/zinc/27/83/38/526278338.db2.gz	YBTXTGZFDUINDD-MRXNPFEDSA-N	-1	0	355.390	2.578	50	0		FFAARM
O=C([O-])[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)CCCc1ccc2c(c1)CC(=O)N2	ZINC000268958241	526291469	/nfs/dbraw/zinc/29/14/69/526291469.db2.gz	ZKQFHPKTPBHBIV-JLSDUUJJSA-N	-1	0	370.449	2.748	50	0		FFAARM
O=C([O-])[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1cc(=O)[nH]c2cc(F)ccc21	ZINC000262342569	526291527	/nfs/dbraw/zinc/29/15/27/526291527.db2.gz	GHMIKGPMGGVJMS-VFVAKGGASA-N	-1	0	358.369	2.937	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)C[C@H]1CCOC1)c1ccc(OC(F)(F)F)cc1	ZINC000299752977	527624817	/nfs/dbraw/zinc/62/48/17/527624817.db2.gz	WHAYBHGUFMSGMM-ZWNOBZJWSA-N	-1	0	361.316	2.644	50	0		FFAARM
O=C([O-])C[C@H]1CN(C(=O)c2cccc(OCc3cccs3)c2)CCO1	ZINC000262436947	527636148	/nfs/dbraw/zinc/63/61/48/527636148.db2.gz	LZQWHZBOHDTZCB-HNNXBMFYSA-N	-1	0	361.419	2.643	50	0		FFAARM
O=C([O-])c1ccccc1C(=O)c1ccc(Cl)c(N2C(=O)C=CC2=O)c1	ZINC000005945904	727783775	/nfs/dbraw/zinc/78/37/75/727783775.db2.gz	ODNLEFGIYPHVFG-UHFFFAOYSA-N	-1	0	355.733	2.699	50	0		FFAARM
Cc1nc(CNC(=O)c2ccc([C@@H]3CCCN3CC(=O)[O-])s2)cs1	ZINC000020512401	727832442	/nfs/dbraw/zinc/83/24/42/727832442.db2.gz	NAWQYPHVXVEQDN-LBPRGKRZSA-N	-1	0	365.480	2.665	50	0		FFAARM
Cc1ccc(C(=O)N/C(=C/c2ccc(Cl)cc2)C(=O)NCC(=O)[O-])cc1	ZINC000002912572	966852300	/nfs/dbraw/zinc/85/23/00/966852300.db2.gz	ZWOSRMPQWBJDOU-MHWRWJLKSA-N	-1	0	372.808	2.620	50	0		FFAARM
COc1ccc2oc(=O)c(-c3csc(NC(=O)/C=C\C(=O)[O-])n3)cc2c1	ZINC000106475381	976210151	/nfs/dbraw/zinc/21/01/51/976210151.db2.gz	SVAHFDRXKXHDER-PLNGDYQASA-N	-1	0	372.358	2.504	50	0		FFAARM
CCCc1c(NC(=O)N[C@@H]2CC[C@H](C(=O)[O-])C2)cnn1-c1cc(C)ccn1	ZINC000647700041	1023107533	/nfs/dbraw/zinc/10/75/33/1023107533.db2.gz	RHYOIVOMMRQVNU-UONOGXRCSA-N	-1	0	371.441	2.903	50	0		FFAARM
Cc1nn(C)c2ncc(C(=O)[O-])c(N3CCC[C@H]3c3nc(C(C)C)no3)c12	ZINC001529114693	1062169427	/nfs/dbraw/zinc/16/94/27/1062169427.db2.gz	SUDOPHMFUCNKME-LBPRGKRZSA-N	-1	0	370.413	2.823	50	0		FFAARM
CCc1ccc(S(=O)(=O)N(C)Cc2csc(C)n2)cc1C(=O)[O-]	ZINC000152964946	210247590	/nfs/dbraw/zinc/24/75/90/210247590.db2.gz	BTGRNMWVMBDGDY-UHFFFAOYSA-N	-1	0	354.453	2.533	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)c1cccc(N2CCCC2=O)c1)c1ccc(F)cc1	ZINC000013257808	210142143	/nfs/dbraw/zinc/14/21/43/210142143.db2.gz	IYEGCQDBIDHMLZ-KRWDZBQOSA-N	-1	0	370.380	2.898	50	0		FFAARM
COc1c(Br)c(C)sc1C(=O)N1CCC[C@H](C(=O)[O-])C1	ZINC000136114156	210090602	/nfs/dbraw/zinc/09/06/02/210090602.db2.gz	KFSIUOSWHXOQOV-QMMMGPOBSA-N	-1	0	362.245	2.764	50	0		FFAARM
Cc1c[nH]c(C(=O)N2C[C@@H]3C[C@@H](c4ccccc4)CC[C@]3(C(=O)[O-])C2)n1	ZINC000299779556	210023116	/nfs/dbraw/zinc/02/31/16/210023116.db2.gz	HWOVZNJXZJAEAV-FTRWYGJKSA-N	-1	0	353.422	2.829	50	0		FFAARM
COc1ccc(Br)cc1CC(=O)NC1CCC(C(=O)[O-])CC1	ZINC000237115288	222905342	/nfs/dbraw/zinc/90/53/42/222905342.db2.gz	SYBKSFZMWCZCPB-UHFFFAOYSA-N	-1	0	370.243	2.760	50	0		FFAARM
COc1cc(OC)c(NC(=O)C[C@@]2(C(=O)[O-])CCSC2)cc1Cl	ZINC000064610397	212040973	/nfs/dbraw/zinc/04/09/73/212040973.db2.gz	DDVXZIIBPVPLNW-HNNXBMFYSA-N	-1	0	359.831	2.894	50	0		FFAARM
CCNC(=O)c1ccc(NC(=O)c2ccc3c(c2)[n-]c(=S)[nH]c3=O)cc1	ZINC000063810639	212033833	/nfs/dbraw/zinc/03/38/33/212033833.db2.gz	VYUDNUSBAKBLDB-UHFFFAOYSA-N	-1	0	368.418	3.000	50	0		FFAARM
O=C(COC(=O)c1cc(F)c(F)c(F)c1F)[N-]OCc1ccccc1	ZINC000061352665	212024193	/nfs/dbraw/zinc/02/41/93/212024193.db2.gz	ZPCMTKNUANTUBA-UHFFFAOYSA-N	-1	0	357.259	2.648	50	0		FFAARM
COc1ccc2c(c1)CCN2S(=O)(=O)c1cc(C(=O)[O-])c(C)cc1C	ZINC000058494737	212011852	/nfs/dbraw/zinc/01/18/52/212011852.db2.gz	NEROGVAHZHYTMG-UHFFFAOYSA-N	-1	0	361.419	2.762	50	0		FFAARM
Cc1cc(S(=O)(=O)Nc2c(F)cccc2F)ccc1OCC(=O)[O-]	ZINC000058377279	212007997	/nfs/dbraw/zinc/00/79/97/212007997.db2.gz	VZQKNRLXDGAFEL-UHFFFAOYSA-N	-1	0	357.334	2.537	50	0		FFAARM
Cc1cc(F)ccc1NS(=O)(=O)c1ccc(OCC(=O)[O-])c(C)c1	ZINC000058377360	212007643	/nfs/dbraw/zinc/00/76/43/212007643.db2.gz	WCBUJCGZEJLGFZ-UHFFFAOYSA-N	-1	0	353.371	2.707	50	0		FFAARM
O=C([O-])[C@H]1CC=CC[C@H]1C(=O)Nc1ccc(C(=O)NC2CC2)c(Cl)c1	ZINC000055150039	211938810	/nfs/dbraw/zinc/93/88/10/211938810.db2.gz	UNOATPDTPZJHQB-OLZOCXBDSA-N	-1	0	362.813	2.838	50	0		FFAARM
COc1ccc(CNC(=O)C2(c3ccccc3)CCOCC2)cc1C(=O)[O-]	ZINC000299742112	211823061	/nfs/dbraw/zinc/82/30/61/211823061.db2.gz	GYOKPECNKGGIKO-UHFFFAOYSA-N	-1	0	369.417	2.758	50	0		FFAARM
C[C@H](CC(=O)N1CCO[C@@H](CC(=O)[O-])C1)c1ccccc1Br	ZINC000299742340	211822802	/nfs/dbraw/zinc/82/28/02/211822802.db2.gz	BFRRLAPYLVLXCX-NEPJUHHUSA-N	-1	0	370.243	2.645	50	0		FFAARM
COc1cccc(-n2[nH][n-]c3c(=O)n(-c4ccc(C)c(F)c4)c(=O)c2=3)c1	ZINC000023125728	211378623	/nfs/dbraw/zinc/37/86/23/211378623.db2.gz	LMNCCYMUKZPAQS-JKSUJKDBSA-N	-1	0	354.341	2.641	50	0		FFAARM
O=C([O-])c1ccccc1NC(=O)CCCc1nc(-c2cccnc2)no1	ZINC000020894478	211299785	/nfs/dbraw/zinc/29/97/85/211299785.db2.gz	ZSEIHNJOLMYPQK-UHFFFAOYSA-N	-1	0	352.350	2.791	50	0		FFAARM
COc1cc([C@H](CC(=O)[O-])N2Cc3ccccc3C2=O)cc(OC)c1OC	ZINC000020213853	211273808	/nfs/dbraw/zinc/27/38/08/211273808.db2.gz	OJRNNKQXPNPTSI-HNNXBMFYSA-N	-1	0	371.389	2.884	50	0		FFAARM
CC[C@@H](NC(=O)/C(=C\c1ccccc1)NC(=O)c1ccc(C)cc1)C(=O)[O-]	ZINC000020035190	211265672	/nfs/dbraw/zinc/26/56/72/211265672.db2.gz	DSXAAJBATHCENR-CLEQQJOVSA-N	-1	0	366.417	2.745	50	0		FFAARM
O=C([O-])c1ccc(-n2nnnc2S[C@@H]2CCc3ccccc3C2=O)cc1	ZINC000019854052	211259444	/nfs/dbraw/zinc/25/94/44/211259444.db2.gz	JQIKWMYIJCMFGO-OAHLLOKOSA-N	-1	0	366.402	2.650	50	0		FFAARM
Cc1nccn1Cc1c(C(=O)[O-])c2cc(O)c(Br)cc2n1C	ZINC000019830898	211256367	/nfs/dbraw/zinc/25/63/67/211256367.db2.gz	SCTCGJPQZLQMSB-UHFFFAOYSA-N	-1	0	364.199	2.898	50	0		FFAARM
COc1ccc(CCNC(=O)[C@]2(C)CC[C@@H](C(=O)[O-])C2(C)C)cc1OC	ZINC000018191968	211193860	/nfs/dbraw/zinc/19/38/60/211193860.db2.gz	SFNLISZDERIUTH-XOBRGWDASA-N	-1	0	363.454	2.890	50	0		FFAARM
CCOC(=O)c1ccc(NC(=O)COc2ccccc2/C=C/C(=O)[O-])cc1	ZINC000013747808	211056756	/nfs/dbraw/zinc/05/67/56/211056756.db2.gz	CWOIBXCZRKFOOT-FMIVXFBMSA-N	-1	0	369.373	2.979	50	0		FFAARM
Cc1cccc(NC(=O)c2ccc3nc([N-]S(C)(=O)=O)sc3c2)n1	ZINC000013736002	211055505	/nfs/dbraw/zinc/05/55/05/211055505.db2.gz	AUBCRGUSZWACIM-UHFFFAOYSA-N	-1	0	362.436	2.624	50	0		FFAARM
Cc1ccc(S(C)(=O)=O)cc1NC(=O)C[C@H](C(=O)[O-])c1ccccc1	ZINC000013468204	211034327	/nfs/dbraw/zinc/03/43/27/211034327.db2.gz	UFPBHUBMKYEURH-HNNXBMFYSA-N	-1	0	361.419	2.596	50	0		FFAARM
O=C([O-])Cc1csc(NC(=O)[C@H]2COc3ccc(Cl)cc3C2)n1	ZINC000013407249	211033181	/nfs/dbraw/zinc/03/31/81/211033181.db2.gz	SBUZHPBFRBZIRA-SECBINFHSA-N	-1	0	352.799	2.613	50	0		FFAARM
CCCn1c(=O)cc([O-])nc1S[C@@H](C)C(=O)Nc1ccccc1F	ZINC000013018582	211021081	/nfs/dbraw/zinc/02/10/81/211021081.db2.gz	OLTOUVDVLZOEGM-JTQLQIEISA-N	-1	0	351.403	2.617	50	0		FFAARM
COc1ccccc1OCCNC(=O)CSc1ccccc1C(=O)[O-]	ZINC000012916966	211007694	/nfs/dbraw/zinc/00/76/94/211007694.db2.gz	LVWIAJRHMWWWIC-UHFFFAOYSA-N	-1	0	361.419	2.681	50	0		FFAARM
Cc1ccc([C@@H]2NC(=O)N[C@](O)(C(F)(F)F)C2=C([O-])c2cccs2)o1	ZINC000012377553	210947417	/nfs/dbraw/zinc/94/74/17/210947417.db2.gz	NICRJXXZPLAFMD-COPLHBTASA-N	-1	0	374.340	2.753	50	0		FFAARM
O=C(Cn1[n-]c(=O)ccc1=O)Nc1ccc(-c2cc3ccccc3o2)cc1	ZINC000008135517	210772268	/nfs/dbraw/zinc/77/22/68/210772268.db2.gz	AUAHHRFEHOXIAY-UHFFFAOYSA-N	-1	0	361.357	2.589	50	0		FFAARM
O=C([O-])COc1cc(N2C(=O)C3=C(CCCC3)C2=O)c(F)cc1Cl	ZINC000006091129	210656841	/nfs/dbraw/zinc/65/68/41/210656841.db2.gz	GQQIAHNFBAFBCS-UHFFFAOYSA-N	-1	0	353.733	2.686	50	0		FFAARM
Nc1nc([N-]S(=O)(=O)c2ccc(F)cc2)cc(-c2ccc(F)cc2)n1	ZINC000001026538	210303311	/nfs/dbraw/zinc/30/33/11/210303311.db2.gz	REVFKSOKSTWRHZ-UHFFFAOYSA-N	-1	0	362.361	2.805	50	0		FFAARM
CC1=C(C)C[C@@H](C(=O)N2CCN(Cc3ccccc3)CC2)[C@H](C(=O)[O-])C1	ZINC000000894857	210287696	/nfs/dbraw/zinc/28/76/96/210287696.db2.gz	HQKSZMPYLDTIRF-RTBURBONSA-N	-1	0	356.466	2.778	50	0		FFAARM
O=C(Nc1ccc(S(=O)(=O)[N-]c2ccccn2)cc1)c1cccnc1	ZINC000000790888	210270420	/nfs/dbraw/zinc/27/04/20/210270420.db2.gz	PWQFXFWMBGGPHR-UHFFFAOYSA-N	-1	0	354.391	2.530	50	0		FFAARM
COc1ccc(NS(=O)(=O)c2cc(C(=O)[O-])cc(F)c2C)cc1OC	ZINC000060800330	221132896	/nfs/dbraw/zinc/13/28/96/221132896.db2.gz	FYTWXKLSFDWVQE-UHFFFAOYSA-N	-1	0	369.370	2.650	50	0		FFAARM
COc1ccc(NC(=O)Cn2[n-]c(-c3ccc(C)cc3)cc2=O)cc1OC	ZINC000065133017	221171125	/nfs/dbraw/zinc/17/11/25/221171125.db2.gz	UCMYWFPGQFCKPQ-UHFFFAOYSA-N	-1	0	367.405	2.808	50	0		FFAARM
COc1ccc(OC)c([C@H](C)NC(=O)c2ccccc2NCC(=O)[O-])c1	ZINC000065373002	221205620	/nfs/dbraw/zinc/20/56/20/221205620.db2.gz	YMTKBUMSKIDVOT-LBPRGKRZSA-N	-1	0	358.394	2.691	50	0		FFAARM
COc1ccc(C)cc1-n1c(SCC(=O)[O-])nnc1-c1cccnc1	ZINC000067843043	221292919	/nfs/dbraw/zinc/29/29/19/221292919.db2.gz	OTNPWVQDOOAWII-UHFFFAOYSA-N	-1	0	356.407	2.823	50	0		FFAARM
CC1(C)[C@H](C(=O)[O-])[C@@H]1C(=O)Nc1ccc(C(=O)NC2CC2)c(Cl)c1	ZINC000071284841	221339210	/nfs/dbraw/zinc/33/92/10/221339210.db2.gz	YHKFJQXZXOEINQ-OLZOCXBDSA-N	-1	0	350.802	2.528	50	0		FFAARM
CCc1cccc(-c2cc(C(=O)[O-])cc(S(=O)(=O)NCCOC)c2)c1	ZINC000071575778	221352402	/nfs/dbraw/zinc/35/24/02/221352402.db2.gz	MUHMTYFJAVLFFO-UHFFFAOYSA-N	-1	0	363.435	2.539	50	0		FFAARM
CN(c1ccc(F)c(F)c1)S(=O)(=O)c1ccc(CCC(=O)[O-])cc1	ZINC000071823907	221381013	/nfs/dbraw/zinc/38/10/13/221381013.db2.gz	WYXMGHLPZSJJIF-UHFFFAOYSA-N	-1	0	355.362	2.807	50	0		FFAARM
O=C(c1cc(=O)n(-c2ccccc2)[n-]1)N1CCO[C@@H](c2ccc(F)cc2)C1	ZINC000071775570	221374724	/nfs/dbraw/zinc/37/47/24/221374724.db2.gz	CYIFRPABBDKSOW-GOSISDBHSA-N	-1	0	367.380	2.518	50	0		FFAARM
Cc1c(C(=O)N2CCCC[C@H]2c2n[nH]c(=O)[n-]2)cnn1-c1ccccc1F	ZINC000329186400	258131746	/nfs/dbraw/zinc/13/17/46/258131746.db2.gz	PVPXYLOSMIVZRR-HNNXBMFYSA-N	-1	0	370.388	2.511	50	0		FFAARM
CC(NCCc1ccccc1)=C1C(=O)[N-]C(=O)N(c2ccc(C)cc2)C1=O	ZINC000101088488	533417110	/nfs/dbraw/zinc/41/71/10/533417110.db2.gz	JBQSCCXIFWCRQT-SDXDJHTJSA-N	-1	0	363.417	2.684	50	0		FFAARM
O=C([O-])c1ccc(N2CCC[C@@H](c3nccn3Cc3ccncc3)C2)nc1	ZINC000091877192	132204535	/nfs/dbraw/zinc/20/45/35/132204535.db2.gz	MQVCMDZZVUSEFR-QGZVFWFLSA-N	-1	0	363.421	2.804	50	0		FFAARM
O=C([O-])c1cccc(N2CCC[C@H](c3nccn3Cc3ccccn3)C2)n1	ZINC000095353234	132206903	/nfs/dbraw/zinc/20/69/03/132206903.db2.gz	KGXADGWFFKHRMO-HNNXBMFYSA-N	-1	0	363.421	2.804	50	0		FFAARM
O=C([O-])/C=C/C(=O)Nc1ccc(N2CCN(c3ccc(F)cc3)CC2)cc1	ZINC000002184656	132253366	/nfs/dbraw/zinc/25/33/66/132253366.db2.gz	IJZURFAHRIKADK-MDZDMXLPSA-N	-1	0	369.396	2.732	50	0		FFAARM
CCOc1ccccc1N1CCN(C(=O)[C@H]2CCCC[C@H]2C(=O)[O-])CC1	ZINC000002739286	132384096	/nfs/dbraw/zinc/38/40/96/132384096.db2.gz	JOYNFTZYFAUFHS-JKSUJKDBSA-N	-1	0	360.454	2.625	50	0		FFAARM
CCOc1ccccc1N1CCN(C(=O)[C@H]2CCCC[C@@H]2C(=O)[O-])CC1	ZINC000002739288	132384111	/nfs/dbraw/zinc/38/41/11/132384111.db2.gz	JOYNFTZYFAUFHS-HOTGVXAUSA-N	-1	0	360.454	2.625	50	0		FFAARM
COc1cc(/C=C/C(=O)[O-])ccc1S(=O)(=O)N1CCCc2ccccc21	ZINC000005744008	132830207	/nfs/dbraw/zinc/83/02/07/132830207.db2.gz	JRFLUPINOSVZMS-PKNBQFBNSA-N	-1	0	373.430	2.935	50	0		FFAARM
Cc1ccc(Cl)cc1N1CCN(C(=O)[C@@H]2CC=CC[C@H]2C(=O)[O-])CC1	ZINC000017074678	132884012	/nfs/dbraw/zinc/88/40/12/132884012.db2.gz	QCRHNPNJUYZFQQ-HZPDHXFCSA-N	-1	0	362.857	2.964	50	0		FFAARM
C[C@](CC(=O)Nc1cccc(N2CCOCC2)c1)(C(=O)[O-])c1ccccc1	ZINC000055151367	136126071	/nfs/dbraw/zinc/12/60/71/136126071.db2.gz	QXLVUPKPLFEPPY-OAQYLSRUSA-N	-1	0	368.433	2.894	50	0		FFAARM
Cc1cc(-c2cc(NCC(=O)[O-])nc3[nH]ccc32)nc(N2CCCCC2)n1	ZINC000072421829	136146081	/nfs/dbraw/zinc/14/60/81/136146081.db2.gz	ITXDFVKNTZNWHK-UHFFFAOYSA-N	-1	0	366.425	2.815	50	0		FFAARM
Cc1cccc(N2CCC(Oc3ccc4c(c3)OCO4)(C(=O)[O-])CC2)n1	ZINC000072473019	136149053	/nfs/dbraw/zinc/14/90/53/136149053.db2.gz	GSHJQHOEOUAJPJ-UHFFFAOYSA-N	-1	0	356.378	2.621	50	0		FFAARM
Cc1nc([C@@H]2CCCN(c3ccc(C(=O)[O-])cn3)C2)cc(N2CCCC2)n1	ZINC000072475865	136149116	/nfs/dbraw/zinc/14/91/16/136149116.db2.gz	QVCFGGGWIBYAOB-MRXNPFEDSA-N	-1	0	367.453	2.862	50	0		FFAARM
Cc1cc(-n2cccn2)ccc1-c1cn([C@@H](Cc2ccncc2)C(=O)[O-])nn1	ZINC000095354666	221854713	/nfs/dbraw/zinc/85/47/13/221854713.db2.gz	HMOJYMNOPWNHMK-IBGZPJMESA-N	-1	0	374.404	2.703	50	0		FFAARM
O=C([O-])CCN(Cc1cccnc1)C(=O)c1cc(-c2ccccc2F)n[nH]1	ZINC000095524554	221949870	/nfs/dbraw/zinc/94/98/70/221949870.db2.gz	NFCPJEBLYIZBLF-UHFFFAOYSA-N	-1	0	368.368	2.728	50	0		FFAARM
COC(=O)C[C@@H](c1ccc(Cl)cc1)c1c([O-])nc2ccccn2c1=O	ZINC000096117238	222032588	/nfs/dbraw/zinc/03/25/88/222032588.db2.gz	MVDHFQLMBVLTNQ-ZDUSSCGKSA-N	-1	0	358.781	2.749	50	0		FFAARM
O=C([O-])[C@@H]1Cc2[nH]cnc2CN1C(=O)C(c1ccccc1)c1ccccc1	ZINC000096152696	222054455	/nfs/dbraw/zinc/05/44/55/222054455.db2.gz	VCOUIWCGBRSEGQ-SFHVURJKSA-N	-1	0	361.401	2.580	50	0		FFAARM
COc1ccc2c(c1)[C@H](c1nc(C3CCCC3)nn1CC(=O)[O-])CC(=O)N2	ZINC000097099366	222160437	/nfs/dbraw/zinc/16/04/37/222160437.db2.gz	WQSDKXKDRIGYRG-CQSZACIVSA-N	-1	0	370.409	2.503	50	0		FFAARM
CCOC(=O)Cc1cc(=O)n2[n-]c(C(F)(F)F)c(-c3ccccc3)c2n1	ZINC000101277009	222268021	/nfs/dbraw/zinc/26/80/21/222268021.db2.gz	FESMLXCXXBBNNS-UHFFFAOYSA-N	-1	0	365.311	2.814	50	0		FFAARM
Cc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccccc4F)c=3c2=O)cc1C	ZINC000101418485	222274314	/nfs/dbraw/zinc/27/43/14/222274314.db2.gz	NHOKGYZPFLDVRX-IRXDYDNUSA-N	-1	0	352.369	2.936	50	0		FFAARM
COc1cccc(-n2c(=O)c3[n-][nH]n(-c4cccc(Cl)c4)c=3c2=O)c1	ZINC000102818218	222308994	/nfs/dbraw/zinc/30/89/94/222308994.db2.gz	WSKUWHKKNDAKHO-GJZGRUSLSA-N	-1	0	356.769	2.846	50	0		FFAARM
CCOc1ccc(-n2[nH][n-]c3c(=O)n(-c4ccc(C)cc4)c(=O)c2=3)cc1	ZINC000102820443	222309053	/nfs/dbraw/zinc/30/90/53/222309053.db2.gz	RNPJXVASVLJZKQ-IRXDYDNUSA-N	-1	0	350.378	2.892	50	0		FFAARM
Cc1ncn(C)c1C(=O)N1C[C@@H]2C[C@@H](c3ccccc3)CC[C@]2(C(=O)[O-])C1	ZINC000426726909	263664277	/nfs/dbraw/zinc/66/42/77/263664277.db2.gz	PVDJKXGWBYCPMM-FIKGOQFSSA-N	-1	0	367.449	2.839	50	0		FFAARM
O=C([O-])[C@H]1CC=CC[C@@H]1C(=O)Nc1ccccc1C(=O)NCc1ccco1	ZINC000001019556	506244295	/nfs/dbraw/zinc/24/42/95/506244295.db2.gz	STQFQNBZRUSIST-GJZGRUSLSA-N	-1	0	368.389	2.815	50	0		FFAARM
COc1ccc(OC)c(S(=O)(=O)[N-]c2ccc(OC)c(OC)c2)c1	ZINC000001142042	506249561	/nfs/dbraw/zinc/24/95/61/506249561.db2.gz	QRABJNADDXODPT-UHFFFAOYSA-N	-1	0	353.396	2.522	50	0		FFAARM
Cc1oc2cc3oc(=O)c(CC(=O)NCCCC(=O)[O-])c(C)c3cc2c1C	ZINC000002102892	506272323	/nfs/dbraw/zinc/27/23/23/506272323.db2.gz	DGQVRWOKOAQWEV-UHFFFAOYSA-N	-1	0	371.389	2.988	50	0	biogenic	FFAARM
O=c1c2[n-][nH]n(-c3ccc(F)cc3)c=2c(=O)n1-c1ccc2c(c1)CCC2	ZINC000033114684	506337336	/nfs/dbraw/zinc/33/73/36/506337336.db2.gz	AOJNWZILBPWJHN-IAGOWNOFSA-N	-1	0	350.353	2.812	50	0		FFAARM
CCCc1cc(=O)oc2c(C)c(OCC(=O)N3CCC[C@@H]3C(=O)[O-])ccc12	ZINC000004064128	506357690	/nfs/dbraw/zinc/35/76/90/506357690.db2.gz	VGBKUEYXIHVZRQ-OAHLLOKOSA-N	-1	0	373.405	2.508	50	0	biogenic	FFAARM
COc1ccc(-c2cc(=O)oc3c(C)c(OCc4nnn[n-]4)ccc23)cc1	ZINC000004282553	506367522	/nfs/dbraw/zinc/36/75/22/506367522.db2.gz	QVPAYRZMRGDEFZ-UHFFFAOYSA-N	-1	0	364.361	2.869	50	0	biogenic	FFAARM
O=C(CCc1nnc(-c2cccc(OCC3CCC3)c2)[n-]c1=O)NC1CC1	ZINC000034765739	506370662	/nfs/dbraw/zinc/37/06/62/506370662.db2.gz	UYSDSDXHRNHMEX-UHFFFAOYSA-N	-1	0	368.437	2.634	50	0		FFAARM
O=C([O-])c1cccc(C(=O)c2ccc3c(c2)C(=O)N(c2cccnc2)C3=O)c1	ZINC000004713490	506390237	/nfs/dbraw/zinc/39/02/37/506390237.db2.gz	BGXPIDORFNMBCC-UHFFFAOYSA-N	-1	0	372.336	2.811	50	0		FFAARM
CSCC[C@H](NC(=O)c1cccc2c1-c1ccccc1C2=O)C(=O)[O-]	ZINC000005244892	506430544	/nfs/dbraw/zinc/43/05/44/506430544.db2.gz	CJWYROVOQJELMT-HNNXBMFYSA-N	-1	0	355.415	2.834	50	0		FFAARM
O=C1N(Cc2ccc(F)cc2)C(c2ccccc2)=N[C@]1([O-])C(F)(F)F	ZINC000005307658	506434443	/nfs/dbraw/zinc/43/44/43/506434443.db2.gz	QCRLSCHZXUNJDR-MRXNPFEDSA-N	-1	0	352.287	2.866	50	0		FFAARM
COc1ccc(C[C@H](C(=O)Nc2ccc(C)cc2C)c2nnn[n-]2)cc1	ZINC000005489118	506446555	/nfs/dbraw/zinc/44/65/55/506446555.db2.gz	CNDUFYMDOLIOKC-INIZCTEOSA-N	-1	0	351.410	2.790	50	0		FFAARM
O=C(NCCCOC1CCCCC1)c1ccc2c(c1)[n-]c(=S)[nH]c2=O	ZINC000040088301	506464694	/nfs/dbraw/zinc/46/46/94/506464694.db2.gz	MINUWQOSCJHAKD-UHFFFAOYSA-N	-1	0	361.467	2.681	50	0		FFAARM
O=C([O-])[C@H]1C2CCC(CC2)[C@@H]1C(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000006715352	506501215	/nfs/dbraw/zinc/50/12/15/506501215.db2.gz	NPRFPORHLJRTSB-GNNGFNCTSA-N	-1	0	360.429	2.611	50	0		FFAARM
O=C([O-])[C@@H]1CC=CC[C@H]1C(=O)Nc1sccc1C(=O)N1CCCCC1	ZINC000006741068	506502163	/nfs/dbraw/zinc/50/21/63/506502163.db2.gz	JCPCOLWZLFRBDB-CHWSQXEVSA-N	-1	0	362.451	2.980	50	0		FFAARM
Cc1csc2nc(C)c(S(=O)(=O)[N-]c3cccc(C)c3C)c(=O)n12	ZINC000006784745	506507767	/nfs/dbraw/zinc/50/77/67/506507767.db2.gz	BOHOEDADQDLDRN-UHFFFAOYSA-N	-1	0	363.464	2.790	50	0		FFAARM
CS(=O)(=O)Cc1ccc(C(=O)Nc2cc(Cl)ccc2C(=O)[O-])cc1	ZINC000008429621	506650545	/nfs/dbraw/zinc/65/05/45/506650545.db2.gz	OSTPZIFUHCVRAX-UHFFFAOYSA-N	-1	0	367.810	2.835	50	0		FFAARM
CN1CCOc2ccc([N-]S(=O)(=O)c3ccccc3Cl)cc2C1=O	ZINC000008961539	506676283	/nfs/dbraw/zinc/67/62/83/506676283.db2.gz	DWQOMOLWSFHGPI-UHFFFAOYSA-N	-1	0	366.826	2.605	50	0		FFAARM
CCC1C(=O)N=C(S[C@H](C)C(=O)Nc2ccc(Cl)cc2)N=C1[O-]	ZINC000010059410	506724294	/nfs/dbraw/zinc/72/42/94/506724294.db2.gz	PJQUSERPDJDJRU-MRVPVSSYSA-N	-1	0	353.831	2.811	50	0		FFAARM
C[C@@H](C(=O)Nc1ccc(F)cc1F)n1nc(C(=O)[O-])c2ccccc2c1=O	ZINC000010484281	506744263	/nfs/dbraw/zinc/74/42/63/506744263.db2.gz	HYQRSFOVWIBLCB-VIFPVBQESA-N	-1	0	373.315	2.573	50	0		FFAARM
COCc1ccccc1NS(=O)(=O)c1cc(C(=O)[O-])cc2c1CCC2	ZINC000055595143	506791906	/nfs/dbraw/zinc/79/19/06/506791906.db2.gz	NJHVGGVOKHIWFY-UHFFFAOYSA-N	-1	0	361.419	2.821	50	0		FFAARM
CC(=O)N1CCc2cc([N-]S(=O)(=O)c3cc(F)ccc3F)ccc21	ZINC000012068278	506811856	/nfs/dbraw/zinc/81/18/56/506811856.db2.gz	XWTYYFMZHPPNRS-UHFFFAOYSA-N	-1	0	352.362	2.675	50	0		FFAARM
O=S(=O)([N-]c1ccccc1Cn1cncn1)c1ccc(F)cc1Cl	ZINC000055686622	506826261	/nfs/dbraw/zinc/82/62/61/506826261.db2.gz	JXYFUHFTIXIACG-UHFFFAOYSA-N	-1	0	366.805	2.920	50	0		FFAARM
CC(=O)Nc1ccc(F)c(NS(=O)(=O)c2ccc(C)c(C(=O)[O-])c2)c1	ZINC000044260039	506826742	/nfs/dbraw/zinc/82/67/42/506826742.db2.gz	SAYAUHBRLPDRQT-UHFFFAOYSA-N	-1	0	366.370	2.592	50	0		FFAARM
CCOc1ccc(NC(=O)c2ccccc2[N-]S(C)(=O)=O)cc1OC	ZINC000012541693	506874284	/nfs/dbraw/zinc/87/42/84/506874284.db2.gz	TVAPBPIYWPAAQV-UHFFFAOYSA-N	-1	0	364.423	2.718	50	0		FFAARM
Cc1cc(C)c2c(-c3ccccc3)nc(S[C@H](CCO)C(=O)[O-])n2n1	ZINC000012558623	506878255	/nfs/dbraw/zinc/87/82/55/506878255.db2.gz	OQJCEMVVHRTBKO-CQSZACIVSA-N	-1	0	357.435	2.941	50	0		FFAARM
O=C([O-])c1sccc1S(=O)(=O)N1CCc2[nH]c3ccccc3c2C1	ZINC000012916290	506916722	/nfs/dbraw/zinc/91/67/22/506916722.db2.gz	GULHUEXJSLXQBC-UHFFFAOYSA-N	-1	0	362.432	2.675	50	0		FFAARM
CC(C)C(=O)Nc1cccc([N-]S(=O)(=O)c2c[nH]c3ncccc23)c1	ZINC000057117432	507174360	/nfs/dbraw/zinc/17/43/60/507174360.db2.gz	AWYUDRMAKJYLPQ-UHFFFAOYSA-N	-1	0	358.423	2.958	50	0		FFAARM
CCn1c(SCC(=O)[O-])nnc1[C@@H](C)NC(=O)c1ccc(Cl)cc1	ZINC000072328104	507776223	/nfs/dbraw/zinc/77/62/23/507776223.db2.gz	PMFCQSXMWLKCCF-SECBINFHSA-N	-1	0	368.846	2.619	50	0		FFAARM
O=C([O-])c1ccc(C[C@H]2CCN(C(=O)CCn3cc(Cl)cn3)C2)cc1	ZINC000072428064	507789370	/nfs/dbraw/zinc/78/93/70/507789370.db2.gz	GLRTUOCLEDUYAC-CQSZACIVSA-N	-1	0	361.829	2.716	50	0		FFAARM
O=C(CCc1cc(=O)[n-]o1)N1CCCC[C@H]1c1nc2cc(F)ccc2[nH]1	ZINC000072430886	507789767	/nfs/dbraw/zinc/78/97/67/507789767.db2.gz	CDIBICJEKZJDTG-HNNXBMFYSA-N	-1	0	358.373	2.670	50	0		FFAARM
O=C(CCc1cc(=O)[n-]o1)N1CCCC[C@@H]1c1nc2cc(F)ccc2[nH]1	ZINC000072430887	507790013	/nfs/dbraw/zinc/79/00/13/507790013.db2.gz	CDIBICJEKZJDTG-OAHLLOKOSA-N	-1	0	358.373	2.670	50	0		FFAARM
O=C([O-])c1ccnc(-c2ccnc(NCc3noc(-c4ccccc4)n3)n2)c1	ZINC000072454138	507793235	/nfs/dbraw/zinc/79/32/35/507793235.db2.gz	AHEDIFUHFDWWGE-UHFFFAOYSA-N	-1	0	374.360	2.899	50	0		FFAARM
O=C(Cn1cc(C(F)(F)F)cc(Cl)c1=O)[N-]OCc1ccccc1	ZINC000031616150	507820795	/nfs/dbraw/zinc/82/07/95/507820795.db2.gz	HLJGYZYHPZKZQD-UHFFFAOYSA-N	-1	0	360.719	2.769	50	0		FFAARM
CC(C)(C)OC(=O)N1CC[C@H](CS(=O)(=O)c2nc3ccccc3[n-]2)C1	ZINC000078791031	507907459	/nfs/dbraw/zinc/90/74/59/507907459.db2.gz	CTEHCCZGHASYDM-LBPRGKRZSA-N	-1	0	365.455	2.594	50	0		FFAARM
O=C([O-])CCc1cc2n(n1)CCCN(C(=O)c1ccc(Cl)s1)C2	ZINC000091460592	507988073	/nfs/dbraw/zinc/98/80/73/507988073.db2.gz	YAUZVYQJBXLYRF-UHFFFAOYSA-N	-1	0	353.831	2.661	50	0		FFAARM
CC(C)c1ccc(C(=O)N2C[C@@H](c3cccc(F)c3)[C@H](C(=O)[O-])C2)c(=O)[nH]1	ZINC000091664720	508000160	/nfs/dbraw/zinc/00/01/60/508000160.db2.gz	DASXYPZWZFJGJU-JKSUJKDBSA-N	-1	0	372.396	2.578	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)c2ccc(SCCO)cc2)C[C@H]1c1ccccc1	ZINC000091931481	508025709	/nfs/dbraw/zinc/02/57/09/508025709.db2.gz	MNQHCRAJUDSBMS-ZWKOTPCHSA-N	-1	0	371.458	2.711	50	0		FFAARM
CCC[C@@]1(C(=O)[O-])CCCN(C(=O)c2ccc(SCCO)cc2)C1	ZINC000091986921	508030142	/nfs/dbraw/zinc/03/01/42/508030142.db2.gz	HXKXXXQEZURMPC-GOSISDBHSA-N	-1	0	351.468	2.878	50	0		FFAARM
CCCc1cc(N2C[C@@H]3c4ccccc4OC[C@]3(C(=O)[O-])C2)nc(C)n1	ZINC000095381956	508181430	/nfs/dbraw/zinc/18/14/30/508181430.db2.gz	HQVNAKXAAWGZPC-OXQOHEQNSA-N	-1	0	353.422	2.805	50	0		FFAARM
Cc1nn(C)c(C)c1[C@@H](C)C(=O)N(Cc1ccccc1)C[C@H](C)C(=O)[O-]	ZINC000095424406	508184937	/nfs/dbraw/zinc/18/49/37/508184937.db2.gz	MQWKLUHZLZPLDS-UONOGXRCSA-N	-1	0	357.454	2.890	50	0		FFAARM
COc1ccc(Cn2[nH][n-]c3c(=O)n(-c4ccccc4Cl)c(=O)c2=3)cc1	ZINC000095481473	508188831	/nfs/dbraw/zinc/18/88/31/508188831.db2.gz	SKYKQGPQVIMSDX-JKSUJKDBSA-N	-1	0	370.796	2.842	50	0		FFAARM
CCc1nn(C)c(CC)c1S(=O)(=O)[N-]c1cc(C)nc(C(C)C)n1	ZINC000095944106	508198698	/nfs/dbraw/zinc/19/86/98/508198698.db2.gz	BXSPIQLCDLBJGU-UHFFFAOYSA-N	-1	0	351.476	2.568	50	0		FFAARM
C[C@@H](C(F)(F)F)S(=O)(=O)[N-]c1ccc(OCC(F)(F)F)nc1	ZINC000096003484	508202397	/nfs/dbraw/zinc/20/23/97/508202397.db2.gz	QRQCJAQIQVSJBM-LURJTMIESA-N	-1	0	352.256	2.715	50	0		FFAARM
C[C@@](O)(CNC(=O)OCC1c2ccccc2-c2ccccc21)CC(=O)[O-]	ZINC000084999884	508300273	/nfs/dbraw/zinc/30/02/73/508300273.db2.gz	JUZAKNZIIRTEEQ-FQEVSTJZSA-N	-1	0	355.390	2.751	50	0		FFAARM
Cc1nn(CCCNc2nccc(-c3cc(C(=O)[O-])ccn3)n2)c(C)c1C	ZINC000077407466	508312557	/nfs/dbraw/zinc/31/25/57/508312557.db2.gz	RTNGYACRRQEVFB-UHFFFAOYSA-N	-1	0	366.425	2.861	50	0		FFAARM
Cc1cc(S(=O)(=O)[N-]c2ccc(N3CCCC3=O)cn2)c(C)s1	ZINC000153490852	508588632	/nfs/dbraw/zinc/58/86/32/508588632.db2.gz	KRHLALSWXVQRII-UHFFFAOYSA-N	-1	0	351.453	2.688	50	0		FFAARM
CN(C(=O)c1ccc2[n-]c(=S)oc2c1)[C@H]1CCCC[C@@H]1S(C)(=O)=O	ZINC000129824336	508770250	/nfs/dbraw/zinc/77/02/50/508770250.db2.gz	QSLZAEORGQCJSO-JSGCOSHPSA-N	-1	0	368.480	2.544	50	0		FFAARM
COC1CCC(CC(=O)[N-]S(=O)(=O)c2cccc3cnccc32)CC1	ZINC000124092533	508781850	/nfs/dbraw/zinc/78/18/50/508781850.db2.gz	OAIOKRQEHDVXBE-UHFFFAOYSA-N	-1	0	362.451	2.635	50	0		FFAARM
Cc1nc([N-]S(=O)(=O)c2ccc(C(F)(F)F)nc2)nc2c1CCCC2	ZINC000185727275	509326709	/nfs/dbraw/zinc/32/67/09/509326709.db2.gz	ODEYDWZDKTVWHL-UHFFFAOYSA-N	-1	0	372.372	2.878	50	0		FFAARM
CN(Cc1ccccc1Cl)C(=O)CC[C@]1(CCC(=O)[O-])CCC(=O)N1	ZINC000223095995	509329867	/nfs/dbraw/zinc/32/98/67/509329867.db2.gz	FRAOCRBCDOCDBI-SFHVURJKSA-N	-1	0	366.845	2.592	50	0		FFAARM
Cc1ccc(OCC(=O)NC(=S)Nc2cccc(/C=C/C(=O)[O-])c2)cc1	ZINC000226323267	509398504	/nfs/dbraw/zinc/39/85/04/509398504.db2.gz	XOIYLAGYFGQYCN-JXMROGBWSA-N	-1	0	370.430	2.985	50	0		FFAARM
CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)NC1(C(=O)[O-])CCCCC1	ZINC000236823679	509510973	/nfs/dbraw/zinc/51/09/73/509510973.db2.gz	OSZKOPCOVUYBAE-KRWDZBQOSA-N	-1	0	356.422	2.854	50	0		FFAARM
CN(c1ccccc1)c1ccccc1C(=O)N1CCO[C@@H](CC(=O)[O-])C1	ZINC000237064331	509561660	/nfs/dbraw/zinc/56/16/60/509561660.db2.gz	NKHLRHMDDMQMEJ-INIZCTEOSA-N	-1	0	354.406	2.770	50	0		FFAARM
Cc1ncc(CN2CCN(C(=O)c3cc(F)c(F)c([O-])c3F)CC2)s1	ZINC000186279990	509620771	/nfs/dbraw/zinc/62/07/71/509620771.db2.gz	GAZSDEDXXYNVCN-UHFFFAOYSA-N	-1	0	371.384	2.532	50	0		FFAARM
C[C@@H](Oc1cccc(Br)c1)C(=O)N1CC[C@](C)(C(=O)[O-])C1	ZINC000237498437	509662145	/nfs/dbraw/zinc/66/21/45/509662145.db2.gz	QEQGPSIJJJPDES-BMIGLBTASA-N	-1	0	356.216	2.540	50	0		FFAARM
C[C@H](CC(=O)N1CCO[C@@H](CC(=O)[O-])C1)c1ccccc1C(F)(F)F	ZINC000237538579	509673169	/nfs/dbraw/zinc/67/31/69/509673169.db2.gz	YTXHGXRYPXMVLD-NEPJUHHUSA-N	-1	0	359.344	2.901	50	0		FFAARM
COc1ccc([C@@H](C)NC(=O)c2c([O-])c3cccc4c3n(c2=O)CC4)cc1	ZINC000170624803	509684611	/nfs/dbraw/zinc/68/46/11/509684611.db2.gz	YGJMEMYZCKENSQ-GFCCVEGCSA-N	-1	0	364.401	2.763	50	0		FFAARM
Cc1noc(C)c1COc1ccccc1C(=O)N1CC[C@@](C)(C(=O)[O-])C1	ZINC000237630494	509696240	/nfs/dbraw/zinc/69/62/40/509696240.db2.gz	HLSNRYXVVJQENQ-LJQANCHMSA-N	-1	0	358.394	2.807	50	0		FFAARM
Cc1nc(-c2cccc(C(=O)N3Cc4ccccc4C[C@@H]3C(=O)[O-])c2)no1	ZINC000237697735	509713988	/nfs/dbraw/zinc/71/39/88/509713988.db2.gz	UBSOBFQOBHSSMU-QGZVFWFLSA-N	-1	0	363.373	2.697	50	0		FFAARM
Cc1ccc(CCC2CCN(C(=O)CN3CCC[C@@H]3C(=O)[O-])CC2)cc1	ZINC000237703032	509715512	/nfs/dbraw/zinc/71/55/12/509715512.db2.gz	CEWXGAUKRHOLHH-LJQANCHMSA-N	-1	0	358.482	2.715	50	0		FFAARM
Cc1nn(C)c2nc(-c3ccccc3)cc(C(=O)N3CCC[C@@H]3C(=O)[O-])c12	ZINC000237878187	509760740	/nfs/dbraw/zinc/76/07/40/509760740.db2.gz	SXKMPBYRIQXYAH-MRXNPFEDSA-N	-1	0	364.405	2.633	50	0		FFAARM
O=C([O-])C1(CC(=O)N[C@H]2CCN(c3ncccc3F)C2)CCCCCC1	ZINC000237914806	509773451	/nfs/dbraw/zinc/77/34/51/509773451.db2.gz	SHOAPUFNTIAQPG-AWEZNQCLSA-N	-1	0	363.433	2.731	50	0		FFAARM
O=C([O-])CC[C@@H]1CCCCN1C(=O)c1ccc(CN2CCCC2=O)cc1	ZINC000237939597	509780691	/nfs/dbraw/zinc/78/06/91/509780691.db2.gz	BUHQPNKIRUVLSF-KRWDZBQOSA-N	-1	0	358.438	2.669	50	0		FFAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)Cc2ccn(-c3ccc(F)cc3)n2)C1	ZINC000237959739	509785933	/nfs/dbraw/zinc/78/59/33/509785933.db2.gz	XQDFXQOHZYEZFP-AWEZNQCLSA-N	-1	0	359.401	2.657	50	0		FFAARM
O=C([O-])c1ccc(C(=O)N2CC[C@@H](OCCCc3ccccc3)C2)cn1	ZINC000238000732	509795382	/nfs/dbraw/zinc/79/53/82/509795382.db2.gz	CYZCOJHCHJBMBO-QGZVFWFLSA-N	-1	0	354.406	2.644	50	0		FFAARM
O=C([O-])c1ccc(C(=O)NCC2(c3ccccc3Cl)CCOCC2)cn1	ZINC000238011907	509798777	/nfs/dbraw/zinc/79/87/77/509798777.db2.gz	DLDMUFBJZWDAFU-UHFFFAOYSA-N	-1	0	374.824	2.911	50	0		FFAARM
O=C([O-])[C@H]1Cc2ccccc2CN1C(=O)C[C@@H]1CCOc2ccccc21	ZINC000238029909	509804005	/nfs/dbraw/zinc/80/40/05/509804005.db2.gz	MAAPOKSEWXCILR-MAUKXSAKSA-N	-1	0	351.402	2.981	50	0		FFAARM
O=C([O-])[C@H]1CCCCN1C(=O)CCc1nc(-c2ccc(Cl)cc2)no1	ZINC000238041691	509807871	/nfs/dbraw/zinc/80/78/71/509807871.db2.gz	ITSDPERIAIGARK-CYBMUJFWSA-N	-1	0	363.801	2.788	50	0		FFAARM
O=C([O-])CCN(C[C@@H]1CCCO1)C(=O)Cc1c[nH]c2cc(Cl)ccc12	ZINC000238086313	509817817	/nfs/dbraw/zinc/81/78/17/509817817.db2.gz	YYMXPLXZETYQGM-AWEZNQCLSA-N	-1	0	364.829	2.846	50	0		FFAARM
CC(C)c1nc(C(=O)N2CCC(c3cc(CC(=O)[O-])n[nH]3)CC2)cs1	ZINC000244811469	509871793	/nfs/dbraw/zinc/87/17/93/509871793.db2.gz	SDJGYWWNBNMKET-UHFFFAOYSA-N	-1	0	362.455	2.637	50	0		FFAARM
Cc1ccc(C2(O)CCN(Cc3nc(=O)c4sccc4[n-]3)CC2)nc1	ZINC000253536943	509888365	/nfs/dbraw/zinc/88/83/65/509888365.db2.gz	RBYBLSHQOCSVDC-UHFFFAOYSA-N	-1	0	356.451	2.584	50	0		FFAARM
O=S(=O)([O-])c1ccc(NN=Cc2c(Cl)nc3ccccn23)cc1	ZINC000254311811	509905583	/nfs/dbraw/zinc/90/55/83/509905583.db2.gz	MPHUDPHFQXNDCZ-UHFFFAOYSA-N	-1	0	350.787	2.680	50	0		FFAARM
O=C([O-])c1ccc(C=Nn2cnc3sc4c(c3c2=O)CCCC4)cc1	ZINC000254409506	509905726	/nfs/dbraw/zinc/90/57/26/509905726.db2.gz	YQGCPCAJGMKDEY-UHFFFAOYSA-N	-1	0	353.403	2.917	50	0		FFAARM
CCOc1cc(C(=O)N2CCc3ccccc3C2)ccc1OCC(=O)[O-]	ZINC000268875374	510112734	/nfs/dbraw/zinc/11/27/34/510112734.db2.gz	BEKXMDLNPXMYQM-UHFFFAOYSA-N	-1	0	355.390	2.747	50	0		FFAARM
Cc1cc(C(=O)N[C@@H](CC(F)F)C(=O)[O-])c(C)cc1Br	ZINC000262926856	510480571	/nfs/dbraw/zinc/48/05/71/510480571.db2.gz	GQCGYYGVVRZZFX-JTQLQIEISA-N	-1	0	350.159	2.904	50	0		FFAARM
CN(C(=O)c1cc2c([nH]c1=O)CCCCC2)c1ccc(OCC(=O)[O-])cc1	ZINC000263165896	510592964	/nfs/dbraw/zinc/59/29/64/510592964.db2.gz	VUEICSGESRIGBE-UHFFFAOYSA-N	-1	0	370.405	2.796	50	0		FFAARM
COc1cccc([C@H]2CN(C(=O)CCc3ccccc3C(=O)[O-])CCO2)c1	ZINC000263540756	510743155	/nfs/dbraw/zinc/74/31/55/510743155.db2.gz	QSBPCEXDIHSVCO-LJQANCHMSA-N	-1	0	369.417	2.926	50	0		FFAARM
CC(=O)c1ccc(NC(=O)N2CCC[C@@H](c3ccn(CC(=O)[O-])n3)C2)cc1	ZINC000426415232	513934988	/nfs/dbraw/zinc/93/49/88/513934988.db2.gz	BBZZRIMHOMVTJI-OAHLLOKOSA-N	-1	0	370.409	2.582	50	0		FFAARM
O=C([O-])Cn1ccc([C@@H]2CCCN(C(=O)c3cnc4ccccc4c3)C2)n1	ZINC000426503086	513961866	/nfs/dbraw/zinc/96/18/66/513961866.db2.gz	SJELIGZIXJZHDJ-OAHLLOKOSA-N	-1	0	364.405	2.536	50	0		FFAARM
Cc1cccc2c1[nH]c(C)c(CC[C@H](C)NCc1n[n-]c(=N)s1)c2=O	ZINC000534664703	517990469	/nfs/dbraw/zinc/99/04/69/517990469.db2.gz	IWBLXXTUGMMGTH-NSHDSACASA-N	-1	0	357.483	2.690	50	0		FFAARM
O=C([N-]S(=O)(=O)CC1CCC1)c1cncc(-c2ccc3c(c2)CCO3)c1	ZINC000165000007	518200337	/nfs/dbraw/zinc/20/03/37/518200337.db2.gz	VFAXYGOKKWAQSP-UHFFFAOYSA-N	-1	0	372.446	2.543	50	0		FFAARM
O=C([O-])[C@@H](NC(=O)c1cnn(C2CC2)c1)c1ccccc1Br	ZINC000630208265	522699014	/nfs/dbraw/zinc/69/90/14/522699014.db2.gz	RWTSGJQLWMEUCS-ZDUSSCGKSA-N	-1	0	364.199	2.536	50	0		FFAARM
O=C([O-])[C@H]1CC[C@@H](c2ccccc2)N1C(=O)c1cnc(C(F)(F)F)nc1	ZINC000621589238	522952843	/nfs/dbraw/zinc/95/28/43/522952843.db2.gz	RDKCGTKSJGEPIG-QWHCGFSZSA-N	-1	0	365.311	2.926	50	0		FFAARM
COc1cccc(-c2nc(CC(=O)N3CCC(C(=O)[O-])CC3)cs2)c1	ZINC000020735727	525722937	/nfs/dbraw/zinc/72/29/37/525722937.db2.gz	RNSQBBUXOZXWSG-UHFFFAOYSA-N	-1	0	360.435	2.684	50	0		FFAARM
Cc1ccc(C(=O)c2ccccc2C(=O)N2CCO[C@H](CC(=O)[O-])C2)cc1	ZINC000262830676	526241960	/nfs/dbraw/zinc/24/19/60/526241960.db2.gz	SAEGNXLQXMVVFA-MRXNPFEDSA-N	-1	0	367.401	2.542	50	0		FFAARM
O=C([O-])[C@@H]1CCCC[C@H]1C(=O)N1CCN(c2cccc(Cl)c2)CC1	ZINC000000178896	526270466	/nfs/dbraw/zinc/27/04/66/526270466.db2.gz	NNVAEGDGLIJWFI-HZPDHXFCSA-N	-1	0	350.846	2.880	50	0		FFAARM
O=C([O-])[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)CCCc1ccc2c(c1)CC(=O)N2	ZINC000268958279	526290783	/nfs/dbraw/zinc/29/07/83/526290783.db2.gz	ZKQFHPKTPBHBIV-QGTPRVQTSA-N	-1	0	370.449	2.748	50	0		FFAARM
O=C([O-])C[C@@H]1CN(C(=O)c2cccc(COc3cccc(F)c3)c2)CCO1	ZINC000262466608	527632126	/nfs/dbraw/zinc/63/21/26/527632126.db2.gz	YENKPSFUHCCIQU-GOSISDBHSA-N	-1	0	373.380	2.720	50	0		FFAARM
Cc1ccnc([N-]S(=O)(=O)c2cc(C)c(C)cc2Br)c1	ZINC000096305733	571133464	/nfs/dbraw/zinc/13/34/64/571133464.db2.gz	PQUNTPUAWGOWFB-UHFFFAOYSA-N	-1	0	355.257	3.570	50	0		FFAARM
CCc1n[nH]c(=S)n1CCNC(=O)[C@@H]1CCCC[C@H]1C(F)(F)F	ZINC000073997826	571139144	/nfs/dbraw/zinc/13/91/44/571139144.db2.gz	JBKQPBQXCPWDAS-NXEZZACHSA-N	-1	0	350.410	2.988	50	0		FFAARM
CCc1nc(S(=O)(=O)[N-]c2cccc3c2CN(C)C3)cn1CC1CC1	ZINC000585098549	571320474	/nfs/dbraw/zinc/32/04/74/571320474.db2.gz	XLVDURVBUJBHML-UHFFFAOYSA-N	-1	0	360.483	2.602	50	0		FFAARM
Cc1ccc(-n2nc(C(=O)N[C@@H](C(=O)[O-])C(C)C)c3c2CCC3)c(F)c1	ZINC000236726996	600150126	/nfs/dbraw/zinc/15/01/26/600150126.db2.gz	FCNPAOFDPMOCKO-MRXNPFEDSA-N	-1	0	359.401	2.648	50	0		FFAARM
Cc1cc2ncc(C(=O)N3CCCC[C@H]3c3ccc(F)cc3)c(=O)n2[n-]1	ZINC000102759305	968974551	/nfs/dbraw/zinc/97/45/51/968974551.db2.gz	QTZYBKLVCVEMPV-INIZCTEOSA-N	-1	0	354.385	2.838	50	0		FFAARM
COc1ccc(/C=C/C(=O)N2Cc3ccccc3C[C@H]2C(=O)[O-])cc1OC	ZINC000583650549	994937569	/nfs/dbraw/zinc/93/75/69/994937569.db2.gz	HPTHGFNMTDIXDO-VMSUTVGLSA-N	-1	0	367.401	2.755	50	0		FFAARM
CCn1c2ccccc2c([O-])c(C(=O)Nc2ccc(C(=O)OC)cc2)c1=O	ZINC000005909327	1012874376	/nfs/dbraw/zinc/87/43/76/1012874376.db2.gz	ZDVCTJCPCNOYJR-UHFFFAOYSA-N	-1	0	366.373	2.766	50	0		FFAARM
O=C([O-])c1cccc(CN2CCC[C@@H](S(=O)(=O)Nc3ccccc3)C2)c1	ZINC000666576135	1027132221	/nfs/dbraw/zinc/13/22/21/1027132221.db2.gz	SULYLFCVHABENB-GOSISDBHSA-N	-1	0	374.462	2.791	50	0		FFAARM
O=S(=O)([N-]S(=O)(=O)c1ccc(Cl)cc1)c1ccc(Cl)cc1	ZINC000000640091	210254389	/nfs/dbraw/zinc/25/43/89/210254389.db2.gz	ISLGMFCNZJGDTA-UHFFFAOYSA-N	-1	0	366.247	2.661	50	0		FFAARM
COc1ccc(/C=C2/CCn3c2nc2cc(C(=O)[O-])ccc2c3=O)cc1O	ZINC000035152952	210245488	/nfs/dbraw/zinc/24/54/88/210245488.db2.gz	OFMUHKLHZNFNIL-WQLSENKSSA-N	-1	0	364.357	2.753	50	0		FFAARM
O=C([O-])[C@H]1Cc2ccccc2CN1C(=O)c1coc(Br)c1	ZINC000299745978	210225249	/nfs/dbraw/zinc/22/52/49/210225249.db2.gz	UKWJTGLEUOATAO-GFCCVEGCSA-N	-1	0	350.168	2.694	50	0		FFAARM
COc1cccc([C@@H]2N[C@@H](C(=O)[O-])Cc3c4ccccc4[nH]c32)c1OC	ZINC000000771867	210225504	/nfs/dbraw/zinc/22/55/04/210225504.db2.gz	ZKLBZOHWBKUYBF-WBVHZDCISA-N	-1	0	352.390	2.873	50	0	biogenic	FFAARM
Cc1cc(C(=O)N2CCC[C@H](c3cc(=O)[nH]cn3)C2)ccc1-n1cccc1	ZINC000023505542	210159912	/nfs/dbraw/zinc/15/99/12/210159912.db2.gz	JOSOIDDVQOARRY-KRWDZBQOSA-N	-1	0	362.433	2.889	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)c1cccc(N2CCCC2=O)c1)c1ccc(F)cc1	ZINC000013257807	210141675	/nfs/dbraw/zinc/14/16/75/210141675.db2.gz	IYEGCQDBIDHMLZ-QGZVFWFLSA-N	-1	0	370.380	2.898	50	0		FFAARM
O=C([O-])[C@H]1CCCN(C(=O)c2nc(C3CC3)n(-c3ccccc3Cl)n2)C1	ZINC000136155689	210089303	/nfs/dbraw/zinc/08/93/03/210089303.db2.gz	MWZKSTHKWCRTJO-LBPRGKRZSA-N	-1	0	374.828	2.735	50	0		FFAARM
Cc1noc(C)c1COc1ccc(CC(=O)N2CCC[C@H](C(=O)[O-])C2)cc1	ZINC000181482451	210073241	/nfs/dbraw/zinc/07/32/41/210073241.db2.gz	QJTLFDXOASCVOR-INIZCTEOSA-N	-1	0	372.421	2.736	50	0		FFAARM
O=C([O-])Cn1ccc(NC(=O)[C@H]2C[C@H]2c2ccccc2OC(F)(F)F)n1	ZINC000122720242	210059454	/nfs/dbraw/zinc/05/94/54/210059454.db2.gz	KWMVQTQGRNTUOG-QWRGUYRKSA-N	-1	0	369.299	2.609	50	0		FFAARM
Cc1[nH]c(C(=O)[O-])c(C)c1C(=O)N[C@H]1CCCN(Cc2ccccc2F)C1	ZINC000299786399	210028456	/nfs/dbraw/zinc/02/84/56/210028456.db2.gz	XCRQLAAHEGGEQV-HNNXBMFYSA-N	-1	0	373.428	2.863	50	0		FFAARM
O=C([O-])[C@H]1CC=CC[C@@H]1C(=O)Nc1ccc(C(=O)Nc2ccccn2)cc1	ZINC000000794590	219321593	/nfs/dbraw/zinc/32/15/93/219321593.db2.gz	YWBYNQIDGROGDX-HOTGVXAUSA-N	-1	0	365.389	2.939	50	0		FFAARM
O=C([O-])[C@H](NS(=O)(=O)c1ccccc1)c1ccc(Br)cc1	ZINC000000971929	219348744	/nfs/dbraw/zinc/34/87/44/219348744.db2.gz	YIGVMRNPMFZMSX-CYBMUJFWSA-N	-1	0	370.224	2.553	50	0		FFAARM
O=C([O-])[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1cc(=O)[nH]c2cc(F)ccc21	ZINC000237979255	222911837	/nfs/dbraw/zinc/91/18/37/222911837.db2.gz	GHMIKGPMGGVJMS-HNHYXYPQSA-N	-1	0	358.369	2.525	50	0		FFAARM
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(F)c(Cl)c2)c(C)n1C	ZINC000064923093	212048539	/nfs/dbraw/zinc/04/85/39/212048539.db2.gz	GAAJWKJLIMCZBI-UHFFFAOYSA-N	-1	0	360.794	2.713	50	0		FFAARM
CCOc1cc(-c2ccccc2)sc1C(=O)N1CCO[C@@H](C(=O)[O-])C1	ZINC000299747152	211825999	/nfs/dbraw/zinc/82/59/99/211825999.db2.gz	CDJVCIRWLPQQBS-CQSZACIVSA-N	-1	0	361.419	2.739	50	0		FFAARM
O=C([O-])[C@@H]1CCCN(C(=O)[C@H]2C[C@@H]2c2cccc(Br)c2)C1	ZINC000299743121	211821698	/nfs/dbraw/zinc/82/16/98/211821698.db2.gz	LYDLREABJYIISG-BNOWGMLFSA-N	-1	0	352.228	2.876	50	0		FFAARM
CCOC(=O)c1[nH]c(C)c(S(=O)(=O)[N-]c2cccc(C(C)=O)c2)c1C	ZINC000075348028	211693526	/nfs/dbraw/zinc/69/35/26/211693526.db2.gz	BDNVVMAULYMBJP-UHFFFAOYSA-N	-1	0	364.423	2.812	50	0		FFAARM
O=C(NC1CCCC1)c1cncc([N-]S(=O)(=O)c2ccc(F)cc2)c1	ZINC000021036338	211306111	/nfs/dbraw/zinc/30/61/11/211306111.db2.gz	ZNJUHEIONCSOOU-UHFFFAOYSA-N	-1	0	363.414	2.694	50	0		FFAARM
Cn1cc(C(=O)[O-])c(C(=O)Nc2nc(-c3ccc(F)cc3F)cs2)n1	ZINC000020614428	211290135	/nfs/dbraw/zinc/29/01/35/211290135.db2.gz	ZCOBTQDEOFDRLQ-UHFFFAOYSA-N	-1	0	364.333	2.772	50	0		FFAARM
Cc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(-c2ccc(=O)[nH]n2)o1	ZINC000015728259	211139499	/nfs/dbraw/zinc/13/94/99/211139499.db2.gz	VMXOBWNOQZTNQQ-UHFFFAOYSA-N	-1	0	365.798	2.793	50	0		FFAARM
O=C(NC1CC1)c1ccc2nc([N-]S(=O)(=O)c3ccccc3)sc2c1	ZINC000013689685	211050687	/nfs/dbraw/zinc/05/06/87/211050687.db2.gz	OSNLZCACMSFTJQ-UHFFFAOYSA-N	-1	0	373.459	2.989	50	0		FFAARM
COc1ccc([C@@H](CC(=O)[O-])NC(=O)c2cccc(OC)c2OC)cc1	ZINC000013187450	211028487	/nfs/dbraw/zinc/02/84/87/211028487.db2.gz	NXJPAWLNPAHLSF-OAHLLOKOSA-N	-1	0	359.378	2.658	50	0		FFAARM
O=C([O-])c1cccc(OCc2nnnn2-c2cccc(C(F)(F)F)c2)c1	ZINC000009306726	210827044	/nfs/dbraw/zinc/82/70/44/210827044.db2.gz	WJXHVKBFMOKTEQ-UHFFFAOYSA-N	-1	0	364.283	2.958	50	0		FFAARM
Cc1ccc(C(=O)[O-])cc1NC(=O)[C@H]1CCCN1C(=O)c1cccs1	ZINC000008708136	210797175	/nfs/dbraw/zinc/79/71/75/210797175.db2.gz	UTBHURUZFFQTEE-CQSZACIVSA-N	-1	0	358.419	2.998	50	0		FFAARM
O=C([O-])c1cc2n(n1)[C@@H](C(F)(F)F)C[C@@H](c1ccc3c(c1)OCO3)N2	ZINC000004812137	210565635	/nfs/dbraw/zinc/56/56/35/210565635.db2.gz	XLRYNLAQFRRTLC-QPUJVOFHSA-N	-1	0	355.272	2.970	50	0		FFAARM
O=C([O-])c1ccc(Cl)cc1NC(=O)CCN1C(=O)c2ccccc2C1=O	ZINC000004845845	210570421	/nfs/dbraw/zinc/57/04/21/210570421.db2.gz	VCDGKZQDNVKERD-UHFFFAOYSA-N	-1	0	372.764	2.663	50	0		FFAARM
NC(=O)Nn1c(CCC(=O)[O-])ccc1-c1ccc(Br)cc1	ZINC000004258106	210520679	/nfs/dbraw/zinc/52/06/79/210520679.db2.gz	HEUKQBGVJXQIIT-UHFFFAOYSA-N	-1	0	352.188	2.557	50	0		FFAARM
NC(=O)c1c(NC(=O)[C@H]2CC=CC[C@@H]2C(=O)[O-])sc2c1CCCCC2	ZINC000004019127	210503880	/nfs/dbraw/zinc/50/38/80/210503880.db2.gz	MAVGXAKPWNROPG-QWRGUYRKSA-N	-1	0	362.451	2.721	50	0		FFAARM
CC1(C(=O)Nc2ccc(S(=O)(=O)[N-]c3ncccn3)cc2)CCCC1	ZINC000003218730	210456038	/nfs/dbraw/zinc/45/60/38/210456038.db2.gz	QDKRMSUNQGJHQR-UHFFFAOYSA-N	-1	0	360.439	2.796	50	0		FFAARM
CCn1ncc(C(=O)[N-]n2c(C)nc3sc4c(c3c2=O)CCCC4)c1C	ZINC000002780491	210421459	/nfs/dbraw/zinc/42/14/59/210421459.db2.gz	VHQRKFDDTCRKQO-UHFFFAOYSA-N	-1	0	371.466	2.554	50	0		FFAARM
CN(C(=O)OCc1ccccc1)[C@@H](CCC(=O)OC(C)(C)C)C(=O)[O-]	ZINC000002560786	210404434	/nfs/dbraw/zinc/40/44/34/210404434.db2.gz	XPZXECGLTZKQDX-AWEZNQCLSA-N	-1	0	351.399	2.830	50	0		FFAARM
O=C([O-])c1ccc(NS(=O)(=O)c2ccc3c4c(cccc42)C(=O)N3)cc1	ZINC000002055806	210378842	/nfs/dbraw/zinc/37/88/42/210378842.db2.gz	XAMGGPPEHSNNII-UHFFFAOYSA-N	-1	0	368.370	2.905	50	0		FFAARM
CC[C@@H](NC(=O)Cc1c(C)c2cc3c(C)coc3c(C)c2oc1=O)C(=O)[O-]	ZINC000002156397	210381672	/nfs/dbraw/zinc/38/16/72/210381672.db2.gz	PDXSMFZCPSLJRO-OAHLLOKOSA-N	-1	0	371.389	2.986	50	0	biogenic	FFAARM
O=C([O-])[C@@H](CCC(=O)OCc1ccccc1)NC(=O)OCc1ccccc1	ZINC000001813280	210371701	/nfs/dbraw/zinc/37/17/01/210371701.db2.gz	TWIVXHQQTRSWGO-QGZVFWFLSA-N	-1	0	371.389	2.890	50	0		FFAARM
O=C(NCc1cccc(F)c1)c1c([O-])c2cccc3c2n(c1=O)CCC3	ZINC000001296718	210341308	/nfs/dbraw/zinc/34/13/08/210341308.db2.gz	XIGVBFUXRWGSKI-UHFFFAOYSA-N	-1	0	352.365	2.722	50	0		FFAARM
Cc1c([O-])nc(SCC(=O)NC2CCCCC2)n(-c2ccccc2)c1=O	ZINC000001101509	210316312	/nfs/dbraw/zinc/31/63/12/210316312.db2.gz	GEDNNGFUGRFOBU-UHFFFAOYSA-N	-1	0	373.478	2.788	50	0		FFAARM
Cc1ccc(CNC(=O)CSCc2nc(=O)c3sccc3[n-]2)cc1	ZINC000009603702	210299999	/nfs/dbraw/zinc/29/99/99/210299999.db2.gz	TXQCVESPZWQPFK-UHFFFAOYSA-N	-1	0	359.476	2.843	50	0		FFAARM
O=C([O-])CCC(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1	ZINC000000984518	210298812	/nfs/dbraw/zinc/29/88/12/210298812.db2.gz	YJRWCBSDWHJGSR-UHFFFAOYSA-N	-1	0	352.434	2.785	50	0		FFAARM
CS(=O)(=O)c1ccc2nc([N-]S(=O)(=O)c3ccccc3)sc2c1	ZINC000000892669	210286773	/nfs/dbraw/zinc/28/67/73/210286773.db2.gz	HCLBSUJJDQDISR-UHFFFAOYSA-N	-1	0	368.461	2.501	50	0		FFAARM
CCOC(=O)c1c(C)[nH]nc1S(=O)(=O)[N-]c1ccc(C)c(Cl)c1	ZINC000047417659	220994221	/nfs/dbraw/zinc/99/42/21/220994221.db2.gz	PEMQXSLKNCWNNV-UHFFFAOYSA-N	-1	0	357.819	2.657	50	0		FFAARM
Cc1ccc(C)c([N-]S(=O)(=O)c2cc(-c3ccc(=O)[nH]n3)cs2)c1	ZINC000065119334	221170708	/nfs/dbraw/zinc/17/07/08/221170708.db2.gz	XFTXISVNSUIUPK-UHFFFAOYSA-N	-1	0	361.448	2.916	50	0		FFAARM
COc1ccc(S(=O)(=O)[N-]c2cc(-c3ccoc3)no2)cc1OC	ZINC000065153465	221173232	/nfs/dbraw/zinc/17/32/32/221173232.db2.gz	YYFNVGDXBVPNTK-UHFFFAOYSA-N	-1	0	350.352	2.753	50	0		FFAARM
O=C([O-])[C@H]1C[C@@H](O)CCN1C(=O)CC(c1ccccc1)c1ccccc1	ZINC000065455559	221220454	/nfs/dbraw/zinc/22/04/54/221220454.db2.gz	HHWIZJGDRAIFQO-PKOBYXMFSA-N	-1	0	353.418	2.645	50	0		FFAARM
COc1ccccc1N(C)S(=O)(=O)c1cc(C(=O)[O-])cc(F)c1C	ZINC000065667762	221235954	/nfs/dbraw/zinc/23/59/54/221235954.db2.gz	ZWPMJYKSKKXFBY-UHFFFAOYSA-N	-1	0	353.371	2.666	50	0		FFAARM
Cc1nn(CC(=O)[O-])c2c1[C@H](c1c[nH]nc1C1CCCCC1)CC(=O)N2	ZINC000067642781	221265437	/nfs/dbraw/zinc/26/54/37/221265437.db2.gz	WCLZZFZQHAYLEA-LBPRGKRZSA-N	-1	0	357.414	2.521	50	0		FFAARM
Cc1nn(CC(=O)[O-])c2c1[C@@H](c1[nH]c3c(cccc3C)c1C)CC(=O)N2	ZINC000067805081	221288336	/nfs/dbraw/zinc/28/83/36/221288336.db2.gz	WOAKJKHZNYNUNJ-ZDUSSCGKSA-N	-1	0	352.394	2.848	50	0		FFAARM
O=C([O-])[C@@]1(Cc2ccccc2)CCCN(c2nnnn2-c2ccccc2)C1	ZINC000071747585	221359374	/nfs/dbraw/zinc/35/93/74/221359374.db2.gz	DQBNFYDIHHWMJB-HXUWFJFHSA-N	-1	0	363.421	2.576	50	0		FFAARM
Cc1cnn(C2(C(=O)[O-])CCN(C(=O)c3ccc(Cl)s3)CC2)c1	ZINC000072411068	221502845	/nfs/dbraw/zinc/50/28/45/221502845.db2.gz	UXZVDHNPPFKLOM-UHFFFAOYSA-N	-1	0	353.831	2.623	50	0		FFAARM
O=C([O-])c1cccc(N2CCC(c3nccn3Cc3cccnc3)CC2)n1	ZINC000091908051	132204740	/nfs/dbraw/zinc/20/47/40/132204740.db2.gz	RJDFXSCFTGMGHR-UHFFFAOYSA-N	-1	0	363.421	2.804	50	0		FFAARM
CC[C@](NC(=O)Cn1ccc(=O)c2ccccc21)(C(=O)[O-])c1ccccc1	ZINC000095424612	221901377	/nfs/dbraw/zinc/90/13/77/221901377.db2.gz	VFHYWZIUMFUSMG-OAQYLSRUSA-N	-1	0	364.401	2.508	50	0		FFAARM
CCOC(=O)c1cn(C)nc1[N-]S(=O)(=O)c1ccccc1C(C)(C)C	ZINC000095466279	221912869	/nfs/dbraw/zinc/91/28/69/221912869.db2.gz	JNSKIGDPNYMAKL-UHFFFAOYSA-N	-1	0	365.455	2.695	50	0		FFAARM
Cc1noc(C)c1[C@H](C(=O)[O-])N(C)Cc1cnn(-c2ccc(F)cc2)c1	ZINC000095530159	221956159	/nfs/dbraw/zinc/95/61/59/221956159.db2.gz	RGMGNIKWLKXMOF-QGZVFWFLSA-N	-1	0	358.373	2.874	50	0		FFAARM
COc1ccc(C(=O)N2CCS[C@@H]3CCCC[C@H]32)cc1OCC(=O)[O-]	ZINC000095989970	221986618	/nfs/dbraw/zinc/98/66/18/221986618.db2.gz	SPPXFQRKUYDBCN-CZUORRHYSA-N	-1	0	365.451	2.659	50	0		FFAARM
COc1ccc(/C=C\C(=O)[O-])cc1S(=O)(=O)N1c2ccccc2C[C@H]1C	ZINC000096297660	222112289	/nfs/dbraw/zinc/11/22/89/222112289.db2.gz	BYEISBXPTKAUKC-CHOZFAJLSA-N	-1	0	373.430	2.933	50	0		FFAARM
CC(C)(C)OC(=O)N1CCCN(c2nc3ccccc3nc2C(=O)[O-])CC1	ZINC000097463419	222181220	/nfs/dbraw/zinc/18/12/20/222181220.db2.gz	WQGSWMJKUOUSOA-UHFFFAOYSA-N	-1	0	372.425	2.775	50	0		FFAARM
COc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccccc4)c=3c2=O)cc1Cl	ZINC000101168558	222264575	/nfs/dbraw/zinc/26/45/75/222264575.db2.gz	TVLMVWSDOOYSDP-CVEARBPZSA-N	-1	0	370.796	2.842	50	0		FFAARM
CC(C)C(=O)c1c2ccccc2n(C(=O)NC(=O)c2ccccc2)c1[O-]	ZINC000101173042	222265292	/nfs/dbraw/zinc/26/52/92/222265292.db2.gz	DLODQFZMFNLOGX-INIZCTEOSA-N	-1	0	350.374	2.892	50	0		FFAARM
COc1ccc([C@H](c2sc3ncnn3c2[O-])N2C[C@@H](C)O[C@H](C)C2)cc1	ZINC000102874161	222311554	/nfs/dbraw/zinc/31/15/54/222311554.db2.gz	UHVPBRKGMCUSBA-LALPHHSUSA-N	-1	0	374.466	2.704	50	0		FFAARM
COc1cc(F)ccc1NC(=O)c1ccc2c(c1)[n-]c(=S)n(C)c2=O	ZINC000103071705	222320435	/nfs/dbraw/zinc/32/04/35/222320435.db2.gz	FJVZRRMXRZLWSI-UHFFFAOYSA-N	-1	0	359.382	2.622	50	0		FFAARM
CSc1ncc2c([O-])c(C(=O)Nc3ccc(Cl)cn3)sc2n1	ZINC000103098272	222321684	/nfs/dbraw/zinc/32/16/84/222321684.db2.gz	GOBJYFDMUAGFQL-SNVBAGLBSA-N	-1	0	352.828	2.543	50	0		FFAARM
O=C([O-])CC[C@H](NC(=O)[C@H]1CC(=O)Nc2cc(F)ccc21)c1ccccc1	ZINC000139244861	222546402	/nfs/dbraw/zinc/54/64/02/222546402.db2.gz	FTAHKNJFWRCLTG-HOTGVXAUSA-N	-1	0	370.380	2.974	50	0		FFAARM
O=C([O-])[C@@]12CN(C(=O)c3ccc[nH]c3=O)C[C@@H]1C[C@@H](c1ccccc1)CC2	ZINC000426728315	263664921	/nfs/dbraw/zinc/66/49/21/263664921.db2.gz	SRPCZWKFACYAPT-QYWGDWMGSA-N	-1	0	366.417	2.898	50	0		FFAARM
CC[C@@H](NC(=O)Cc1c(C)c2cc3c(C)c(C)oc3cc2oc1=O)C(=O)[O-]	ZINC000002104684	506272660	/nfs/dbraw/zinc/27/26/60/506272660.db2.gz	SONBMQRJGQMLFS-OAHLLOKOSA-N	-1	0	371.389	2.986	50	0	biogenic	FFAARM
Cc1oc2c(cc3c(C)c(CC(=O)NCC(=O)[O-])c(=O)oc3c2C)c1C	ZINC000002100420	506272685	/nfs/dbraw/zinc/27/26/85/506272685.db2.gz	QYJARQFKOQRXED-UHFFFAOYSA-N	-1	0	357.362	2.516	50	0	biogenic	FFAARM
CCN1CCCn2cc(S(=O)(=O)[N-]c3ccc(F)c(C)c3)cc2C1=O	ZINC000065258806	506277806	/nfs/dbraw/zinc/27/78/06/506277806.db2.gz	MWQKVPIVCHZUJK-UHFFFAOYSA-N	-1	0	365.430	2.602	50	0		FFAARM
Cc1nn(CCO)c2ncc(C(=O)c3cc(Cl)cc(Cl)c3[O-])cc12	ZINC000002616092	506283437	/nfs/dbraw/zinc/28/34/37/506283437.db2.gz	DPSACVDEQNTMCI-UHFFFAOYSA-N	-1	0	366.204	2.975	50	0		FFAARM
O=C([O-])[C@@H]1CCCC[C@H]1C(=O)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000002808337	506295317	/nfs/dbraw/zinc/29/53/17/506295317.db2.gz	JZTMKWZSWJLPMC-IAGOWNOFSA-N	-1	0	364.873	2.875	50	0		FFAARM
CCOC(CCn1c(=O)c2cc(OC)c(OC)cc2[n-]c1=S)OCC	ZINC000002975460	506305278	/nfs/dbraw/zinc/30/52/78/506305278.db2.gz	PPCFGIKIFADHED-UHFFFAOYSA-N	-1	0	368.455	2.865	50	0		FFAARM
CC(C)OCCCn1c(=O)c2cc(N3CCOCC3)ccc2[n-]c1=S	ZINC000002976014	506305810	/nfs/dbraw/zinc/30/58/10/506305810.db2.gz	UZMLFTYLHXDZGU-UHFFFAOYSA-N	-1	0	363.483	2.711	50	0		FFAARM
COc1ccc(CNC(=O)CCn2c(=O)c3ccccc3[n-]c2=S)cc1	ZINC000003043524	506307236	/nfs/dbraw/zinc/30/72/36/506307236.db2.gz	WBNUGQWRDLPYCM-UHFFFAOYSA-N	-1	0	369.446	2.774	50	0		FFAARM
O=C([O-])CCc1nc2sc3c(c2c(=O)n1C[C@@H]1CCCO1)CCCC3	ZINC000003298752	506320083	/nfs/dbraw/zinc/32/00/83/506320083.db2.gz	FBCSJIXZJOBCJM-NSHDSACASA-N	-1	0	362.451	2.533	50	0		FFAARM
COc1ccc(OC)c(NC(=O)C[C@H](Cc2ccccc2OC)C(=O)[O-])c1	ZINC000004099582	506358814	/nfs/dbraw/zinc/35/88/14/506358814.db2.gz	TVYNRPAAXFWNCS-AWEZNQCLSA-N	-1	0	373.405	2.985	50	0		FFAARM
CC[C@H](Sc1ccc2nnc(-c3ccc(OC)c(OC)c3)n2n1)C(=O)[O-]	ZINC000004142176	506362575	/nfs/dbraw/zinc/36/25/75/506362575.db2.gz	NJBMKKDRESGPFS-ZDUSSCGKSA-N	-1	0	374.422	2.764	50	0		FFAARM
NC(=O)c1c(NC(=O)[C@H]2CCCC[C@@H]2C(=O)[O-])sc2c1CCCCC2	ZINC000004150411	506363241	/nfs/dbraw/zinc/36/32/41/506363241.db2.gz	JTUBJJWMUUKQGL-QWRGUYRKSA-N	-1	0	364.467	2.945	50	0		FFAARM
COc1ccccc1[N-]S(=O)(=O)c1cc2c3c(c1)CCC(=O)N3CCC2	ZINC000004270506	506368321	/nfs/dbraw/zinc/36/83/21/506368321.db2.gz	KOTCRAGMWKGHRF-UHFFFAOYSA-N	-1	0	372.446	2.721	50	0		FFAARM
O=c1c2[n-][nH]n(Cc3cccc(Cl)c3)c=2c(=O)n1-c1ccc(F)cc1	ZINC000004483416	506377917	/nfs/dbraw/zinc/37/79/17/506377917.db2.gz	MRIWLHKSNCGDJN-CABCVRRESA-N	-1	0	358.760	2.973	50	0		FFAARM
CCOc1ccc(NC(=O)[C@H](Cc2ccc(OC)cc2)c2nnn[n-]2)cc1	ZINC000004671853	506386830	/nfs/dbraw/zinc/38/68/30/506386830.db2.gz	JDLBAKTYKPWAIQ-QGZVFWFLSA-N	-1	0	367.409	2.572	50	0		FFAARM
O=C(NCc1ccccn1)c1ccccc1[N-]S(=O)(=O)c1ccccc1	ZINC000004742486	506391746	/nfs/dbraw/zinc/39/17/46/506391746.db2.gz	LMFFGEVBSGMGHG-UHFFFAOYSA-N	-1	0	367.430	2.812	50	0		FFAARM
NC(=O)c1c(SCc2c(F)cccc2F)sc2c1[nH]c(=O)cc2[O-]	ZINC000036356993	506401667	/nfs/dbraw/zinc/40/16/67/506401667.db2.gz	VMVQHAPFTAXUHQ-UHFFFAOYSA-N	-1	0	368.386	2.965	50	0		FFAARM
Cc1ccc(NC(=O)c2sc3[nH]c(=O)c(C(=O)[O-])cc3c2N)c(C)c1	ZINC000004909594	506404775	/nfs/dbraw/zinc/40/47/75/506404775.db2.gz	XKLCURUGNRYOEB-UHFFFAOYSA-N	-1	0	357.391	2.739	50	0		FFAARM
COc1ccc([N-]S(=O)(=O)c2ccccc2F)cc1N1CCCC1=O	ZINC000005329656	506437437	/nfs/dbraw/zinc/43/74/37/506437437.db2.gz	XQDZRYMZRHCYEF-UHFFFAOYSA-N	-1	0	364.398	2.762	50	0		FFAARM
CCc1ccccc1NC(=O)[C@@H](Cc1ccc(OC)cc1)c1nnn[n-]1	ZINC000005445030	506443210	/nfs/dbraw/zinc/44/32/10/506443210.db2.gz	SUBSPKNIVZERNA-INIZCTEOSA-N	-1	0	351.410	2.736	50	0		FFAARM
CCC(NCCc1ccccc1)=C1C(=O)[N-]C(=O)N(C2CCCCC2)C1=O	ZINC000005625189	506451330	/nfs/dbraw/zinc/45/13/30/506451330.db2.gz	PVEFISQFZKRVSF-ISLYRVAYSA-N	-1	0	369.465	2.894	50	0		FFAARM
CC1=C(C(=O)OCc2ccccc2)[C@H](c2ccc(C(=O)[O-])cc2)NC(=O)N1	ZINC000006395196	506481124	/nfs/dbraw/zinc/48/11/24/506481124.db2.gz	YSAQVCCFVBYDAF-KRWDZBQOSA-N	-1	0	366.373	2.756	50	0		FFAARM
O=C([O-])c1ccccc1NC(=O)N1CCc2[nH]cnc2[C@@H]1c1cccnc1	ZINC000040309823	506481664	/nfs/dbraw/zinc/48/16/64/506481664.db2.gz	QVMVXSYMQSGJHO-KRWDZBQOSA-N	-1	0	363.377	2.683	50	0	biogenic	FFAARM
Cc1nn2c(ncc3c(=O)n(CC(=O)[O-])ccc32)c1-c1ccc(Cl)cc1	ZINC000040397643	506482056	/nfs/dbraw/zinc/48/20/56/506482056.db2.gz	OTRYYWNNUMAKHB-UHFFFAOYSA-N	-1	0	368.780	2.758	50	0		FFAARM
O=C([O-])[C@H]1CC=CC[C@@H]1C(=O)Nc1sccc1C(=O)N1CCCCC1	ZINC000006741067	506502112	/nfs/dbraw/zinc/50/21/12/506502112.db2.gz	JCPCOLWZLFRBDB-STQMWFEESA-N	-1	0	362.451	2.980	50	0		FFAARM
CCOc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccc(C)cc4)c=3c2=O)cc1	ZINC000006770419	506505537	/nfs/dbraw/zinc/50/55/37/506505537.db2.gz	VKSHFEONZXWLGA-QZTJIDSGSA-N	-1	0	364.405	2.887	50	0		FFAARM
CSc1cccc([N-]S(=O)(=O)c2ccc(-c3ccc(=O)[nH]n3)o2)c1	ZINC000006887550	506513358	/nfs/dbraw/zinc/51/33/58/506513358.db2.gz	VWNZREPMNJTGSL-UHFFFAOYSA-N	-1	0	363.420	2.553	50	0		FFAARM
O=C(NC1CC1)c1ccccc1[N-]S(=O)(=O)c1ccc2c(c1)CCC2	ZINC000007054391	506529074	/nfs/dbraw/zinc/52/90/74/506529074.db2.gz	MJDVPUGHVJZMAR-UHFFFAOYSA-N	-1	0	356.447	2.868	50	0		FFAARM
O=C([O-])CCCC(=O)Nc1ccn(Cc2ccc(Br)cc2)n1	ZINC000008782474	506669456	/nfs/dbraw/zinc/66/94/56/506669456.db2.gz	RDEQKRDLBRBYNM-UHFFFAOYSA-N	-1	0	366.215	2.887	50	0		FFAARM
CC(=O)N1CCc2ccc([N-]S(=O)(=O)c3ccc(C)s3)cc2C1	ZINC000008976898	506676211	/nfs/dbraw/zinc/67/62/11/506676211.db2.gz	BJRYXJYPUZXSGL-UHFFFAOYSA-N	-1	0	350.465	2.762	50	0		FFAARM
CC(Nc1cccc(N(C)C)c1)=C1C(=O)[N-]C(=O)N(c2ccccc2)C1=O	ZINC000008995359	506678143	/nfs/dbraw/zinc/67/81/43/506678143.db2.gz	BOKJFTWCROYZLS-GHRIWEEISA-N	-1	0	364.405	2.722	50	0		FFAARM
CCCCC1C(=O)N=C(SCC(=O)Nc2ccc(OC)cc2)N=C1[O-]	ZINC000009310640	506688979	/nfs/dbraw/zinc/68/89/79/506688979.db2.gz	AQTXZFVBTCACTQ-UHFFFAOYSA-N	-1	0	363.439	2.558	50	0		FFAARM
CC[C@@H](C)[C@H](NC(=O)N1CCC(c2nc3ccccc3[nH]2)CC1)C(=O)[O-]	ZINC000009421258	506695516	/nfs/dbraw/zinc/69/55/16/506695516.db2.gz	XSBUSYJZIAGEDP-WBMJQRKESA-N	-1	0	358.442	2.951	50	0		FFAARM
Cc1[nH]c(C)c(S(=O)(=O)[N-]c2cccc(C)c2)c1C(=O)N1CCCC1	ZINC000009684317	506708390	/nfs/dbraw/zinc/70/83/90/506708390.db2.gz	INVSAJQQADYIBX-UHFFFAOYSA-N	-1	0	361.467	2.977	50	0		FFAARM
C[C@H](C(=O)Nc1ccc(F)cc1F)n1nc(C(=O)[O-])c2ccccc2c1=O	ZINC000010484283	506743951	/nfs/dbraw/zinc/74/39/51/506743951.db2.gz	HYQRSFOVWIBLCB-SECBINFHSA-N	-1	0	373.315	2.573	50	0		FFAARM
CCn1cc(-c2cc(C(F)(F)F)c3c(C)nn(CC(=O)[O-])c3n2)cn1	ZINC000012395244	506859547	/nfs/dbraw/zinc/85/95/47/506859547.db2.gz	XMXMMJOZFVOQPF-UHFFFAOYSA-N	-1	0	353.304	2.727	50	0		FFAARM
Cc1cccc(NS(=O)(=O)c2cc3c(c(C(=O)[O-])c2)OCCO3)c1C	ZINC000057115545	507174760	/nfs/dbraw/zinc/17/47/60/507174760.db2.gz	ZGLFTCHWVLSGBQ-UHFFFAOYSA-N	-1	0	363.391	2.574	50	0		FFAARM
COc1ccc([N-]S(=O)(=O)c2ccc(Br)cc2F)cn1	ZINC000068741076	507312256	/nfs/dbraw/zinc/31/22/56/507312256.db2.gz	HOTCKRFOOPLARB-UHFFFAOYSA-N	-1	0	361.192	2.793	50	0		FFAARM
CC(=O)NCCc1ccc(S(=O)(=O)[N-]c2cccc(C)c2C)s1	ZINC000058165917	507376300	/nfs/dbraw/zinc/37/63/00/507376300.db2.gz	BRLIOGYGKAYFRC-UHFFFAOYSA-N	-1	0	352.481	2.844	50	0		FFAARM
Cc1nc(C2([N-]S(=O)(=O)c3c(C)noc3C)CCCCCC2)no1	ZINC000024689339	507431123	/nfs/dbraw/zinc/43/11/23/507431123.db2.gz	VHPITHVYTLSVMC-UHFFFAOYSA-N	-1	0	354.432	2.511	50	0		FFAARM
O=C([O-])Cc1ccc(N[C@H]2CC(=O)N(c3ccccc3Cl)C2=O)cc1	ZINC000025685820	507522370	/nfs/dbraw/zinc/52/23/70/507522370.db2.gz	CDWPREYWJLLLDA-AWEZNQCLSA-N	-1	0	358.781	2.711	50	0		FFAARM
COc1cc(C)c(S(=O)(=O)Nc2cc(C(=O)[O-])ccc2F)cc1OC	ZINC000026538982	507595245	/nfs/dbraw/zinc/59/52/45/507595245.db2.gz	JGBVUYKOOJZBMQ-UHFFFAOYSA-N	-1	0	369.370	2.650	50	0		FFAARM
Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)[C@@H]1CC=CC[C@H]1C(=O)[O-]	ZINC000051186000	507748884	/nfs/dbraw/zinc/74/88/84/507748884.db2.gz	CHMPNBBRLRVAKS-HZPDHXFCSA-N	-1	0	358.438	2.986	50	0		FFAARM
O=C([O-])C[C@H]1COCCN1C(=O)c1cc(C(F)(F)F)ccc1Cl	ZINC000072151936	507761542	/nfs/dbraw/zinc/76/15/42/507761542.db2.gz	XDLRPUUZZQRCIR-VIFPVBQESA-N	-1	0	351.708	2.675	50	0		FFAARM
O=C([O-])CCC(=O)N1N=C(c2ccc[nH]2)C[C@@H]1c1cccc2nccnc21	ZINC000072314644	507776318	/nfs/dbraw/zinc/77/63/18/507776318.db2.gz	KVYIMHUCJQDULF-MRXNPFEDSA-N	-1	0	363.377	2.500	50	0		FFAARM
Cc1ccc(F)c(OC2(C(=O)[O-])CCN(C(=O)c3ccncc3)CC2)c1	ZINC000072476493	507796452	/nfs/dbraw/zinc/79/64/52/507796452.db2.gz	CPJZKKRDKZEXIY-UHFFFAOYSA-N	-1	0	358.369	2.668	50	0		FFAARM
CC(C)Oc1cccc([C@H](C(=O)[O-])N2CCN(Cc3ccccn3)CC2)c1	ZINC000095371824	508179075	/nfs/dbraw/zinc/17/90/75/508179075.db2.gz	VHXJAUFBYCXIBE-HXUWFJFHSA-N	-1	0	369.465	2.812	50	0		FFAARM
CCc1cc(C(=O)N2CCC[C@H](c3ccc(C(=O)[O-])cc3)C2)cc(=O)[nH]1	ZINC000095372093	508179240	/nfs/dbraw/zinc/17/92/40/508179240.db2.gz	YCPRFZBLXWBOEX-HNNXBMFYSA-N	-1	0	354.406	2.655	50	0		FFAARM
Cc1ccc(Cl)c(CN2CCC3(CC2)[C@@H](C(=O)[O-])CC(=O)N3C)c1F	ZINC000095391115	508183704	/nfs/dbraw/zinc/18/37/04/508183704.db2.gz	BXZXNVHBVWMARS-CYBMUJFWSA-N	-1	0	368.836	2.685	50	0		FFAARM
Cc1nn(CC(C)C)c(C)c1CC(=O)NC[C@@H](C(=O)[O-])c1ccccc1	ZINC000095425553	508184881	/nfs/dbraw/zinc/18/48/81/508184881.db2.gz	NZGLSBBPHSGYEV-GOSISDBHSA-N	-1	0	357.454	2.683	50	0		FFAARM
Cc1nn(C)c(C)c1[C@H](C)C(=O)N(Cc1ccccc1)C[C@H](C)C(=O)[O-]	ZINC000095424407	508185339	/nfs/dbraw/zinc/18/53/39/508185339.db2.gz	MQWKLUHZLZPLDS-KBPBESRZSA-N	-1	0	357.454	2.890	50	0		FFAARM
Cc1nn(C)c(C)c1C[C@H](C)C(=O)N[C@H](C(=O)[O-])c1ccccc1Cl	ZINC000095464029	508187356	/nfs/dbraw/zinc/18/73/56/508187356.db2.gz	LMNPMQZBKUOUCZ-QFYYESIMSA-N	-1	0	363.845	2.811	50	0		FFAARM
COCCn1ccc2ccc(C(=O)N=c3[n-]c(C(=O)OC)c(C)s3)cc21	ZINC000095480490	508188866	/nfs/dbraw/zinc/18/88/66/508188866.db2.gz	BYKRDMVKEUCASK-UHFFFAOYSA-N	-1	0	373.434	3.092	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)c1cc(=O)[nH]c2ccccc21)c1ccc(F)cc1	ZINC000095498403	508189671	/nfs/dbraw/zinc/18/96/71/508189671.db2.gz	PJTXOYZKKOWICI-MRXNPFEDSA-N	-1	0	354.337	2.613	50	0		FFAARM
O=S(=O)([N-]c1cnn([C@H]2CCOC2)c1)c1cccc(C(F)(F)F)c1	ZINC000096123273	508207640	/nfs/dbraw/zinc/20/76/40/508207640.db2.gz	MOZXBGPCYXWCDZ-LBPRGKRZSA-N	-1	0	361.345	2.664	50	0		FFAARM
O=C(CCc1cc(=O)[n-]o1)N1CCC[C@@H]1c1nc(-c2ccccc2)no1	ZINC000077419679	508314427	/nfs/dbraw/zinc/31/44/27/508314427.db2.gz	FPZISDUBHFFUIT-CQSZACIVSA-N	-1	0	354.366	2.727	50	0		FFAARM
C[C@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)N1CCCC[C@@H]1C(=O)[O-]	ZINC000136520237	508698901	/nfs/dbraw/zinc/69/89/01/508698901.db2.gz	MHSZUFBELCOXRZ-JOYOIKCWSA-N	-1	0	373.236	2.577	50	0		FFAARM
C[C@H]1CCCN(S(=O)(=O)Nc2ccc(C(=O)[O-])c(C(F)(F)F)c2)C1	ZINC000120316158	508971124	/nfs/dbraw/zinc/97/11/24/508971124.db2.gz	BKTSBTMHYFYLQR-VIFPVBQESA-N	-1	0	366.361	2.792	50	0		FFAARM
CCO[C@H]1CCCN(C(=O)c2ccc(-n3ncc(C(=O)[O-])c3C)cc2)C1	ZINC000236990083	509547454	/nfs/dbraw/zinc/54/74/54/509547454.db2.gz	YBECWSANUCHOFL-INIZCTEOSA-N	-1	0	357.410	2.520	50	0		FFAARM
Cc1cc(C(=O)N2CCC[C@H]2C(=O)[O-])cc(C)c1OCc1cccnc1	ZINC000237696284	509713509	/nfs/dbraw/zinc/71/35/09/509713509.db2.gz	WXPJZCPIGAOYNQ-KRWDZBQOSA-N	-1	0	354.406	2.967	50	0		FFAARM
CC(=O)Nc1cc(C(=O)NC[C@@](C)(C(=O)[O-])c2ccccc2)ccc1C	ZINC000193091447	509774938	/nfs/dbraw/zinc/77/49/38/509774938.db2.gz	ROVCOWJZPZEFLO-HXUWFJFHSA-N	-1	0	354.406	2.726	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)[C@H]1CC(=O)Nc2cc(F)ccc21)c1ccc(F)cc1	ZINC000237963019	509785209	/nfs/dbraw/zinc/78/52/09/509785209.db2.gz	VYDRSUBYBXGVTK-GJZGRUSLSA-N	-1	0	374.343	2.723	50	0		FFAARM
O=C([O-])[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)CCCc1ccc2c(c1)CC(=O)N2	ZINC000237966807	509788175	/nfs/dbraw/zinc/78/81/75/509788175.db2.gz	ZKQFHPKTPBHBIV-WBAXXEDZSA-N	-1	0	370.449	2.748	50	0		FFAARM
O=C([O-])c1cc(C(=O)N[C@H]2CCOc3ccccc32)n(-c2ccccc2)n1	ZINC000237990655	509792715	/nfs/dbraw/zinc/79/27/15/509792715.db2.gz	XXVCQAHKLYKYJT-HNNXBMFYSA-N	-1	0	363.373	2.824	50	0		FFAARM
O=C([O-])COc1cccc(CNC(=O)[C@@H]2C[C@@H]2c2ccc(F)cc2F)c1	ZINC000238019082	509801844	/nfs/dbraw/zinc/80/18/44/509801844.db2.gz	UNCIWMATWHYULM-HZPDHXFCSA-N	-1	0	361.344	2.848	50	0		FFAARM
O=C([O-])[C@H]1Cc2ccccc2CN1C(=O)c1ccc(Cn2cccn2)cc1	ZINC000238043491	509808508	/nfs/dbraw/zinc/80/85/08/509808508.db2.gz	ORDWIUHVFKGECK-LJQANCHMSA-N	-1	0	361.401	2.583	50	0		FFAARM
O=C([O-])CCN(C(=O)[C@H]1C[C@@H]1c1ccc(F)cc1F)C1CCOCC1	ZINC000238069622	509814361	/nfs/dbraw/zinc/81/43/61/509814361.db2.gz	PEMYCTQANMGCPC-CABCVRRESA-N	-1	0	353.365	2.551	50	0		FFAARM
O=C([O-])CN(C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)C1CCOCC1	ZINC000238104365	509822012	/nfs/dbraw/zinc/82/20/12/509822012.db2.gz	OUAFEDIYTWENKY-UONOGXRCSA-N	-1	0	371.355	2.901	50	0		FFAARM
O=C([O-])[C@H]1CN(C(=O)c2ccc(-c3cc(F)c(F)c(F)c3)cc2)CCO1	ZINC000238129655	509825519	/nfs/dbraw/zinc/82/55/19/509825519.db2.gz	QBFLVEPTQMVLKW-OAHLLOKOSA-N	-1	0	365.307	2.697	50	0		FFAARM
O=C([O-])c1sccc1NC(=O)CCN1CC(Oc2ccccc2F)C1	ZINC000244678633	509863482	/nfs/dbraw/zinc/86/34/82/509863482.db2.gz	IHFHIMRWCNYMOU-UHFFFAOYSA-N	-1	0	364.398	2.677	50	0		FFAARM
C/C(=C\C(=O)N1CCO[C@@H](CC(=O)[O-])C1)c1ccccc1C(F)(F)F	ZINC000271918434	511370268	/nfs/dbraw/zinc/37/02/68/511370268.db2.gz	SXSNEJGJITZUHH-OBIHZWKSSA-N	-1	0	357.328	2.811	50	0		FFAARM
O=C([O-])CCN(C[C@@H]1CCCO1)C(=O)[C@@H]1C[C@H]1c1c(F)cccc1F	ZINC000299747144	511668080	/nfs/dbraw/zinc/66/80/80/511668080.db2.gz	CCHKOIYYXZQFDD-YNEHKIRRSA-N	-1	0	353.365	2.551	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)C[C@@H]1CCOC1)c1cccc(Br)c1	ZINC000299753899	511668523	/nfs/dbraw/zinc/66/85/23/511668523.db2.gz	ZSJITYGKWVAYCY-GWCFXTLKSA-N	-1	0	356.216	2.508	50	0		FFAARM
CCOc1ccc2cc(C(=O)N(CCC(=O)[O-])C3CCOCC3)[nH]c2c1	ZINC000299750792	511669167	/nfs/dbraw/zinc/66/91/67/511669167.db2.gz	OKQWVPGESCJWBV-UHFFFAOYSA-N	-1	0	360.410	2.663	50	0		FFAARM
C[C@H](NC(=O)N1CCC(Oc2cccc(C(F)(F)F)c2)CC1)C(=O)[O-]	ZINC000426489455	513956722	/nfs/dbraw/zinc/95/67/22/513956722.db2.gz	ZQLQKYLQBUTQAZ-JTQLQIEISA-N	-1	0	360.332	2.731	50	0		FFAARM
O=C([O-])Cn1ccc([C@H]2CCCN(C(=O)Nc3cc(F)ccc3F)C2)n1	ZINC000426513772	513964951	/nfs/dbraw/zinc/96/49/51/513964951.db2.gz	WBIWMFCIRHRZPI-NSHDSACASA-N	-1	0	364.352	2.657	50	0		FFAARM
C[C@@H]1Sc2ccc(C(=O)NCc3cccc(C(=O)[O-])c3)cc2NC1=O	ZINC000521364869	517706442	/nfs/dbraw/zinc/70/64/42/517706442.db2.gz	ABALJVMFIITEIM-JTQLQIEISA-N	-1	0	356.403	2.748	50	0		FFAARM
O=C([O-])CN(C(=O)/C=C\c1cc(Br)cs1)C1CCOCC1	ZINC000606441973	521069327	/nfs/dbraw/zinc/06/93/27/521069327.db2.gz	SZFADJXTIBIDEY-UPHRSURJSA-N	-1	0	374.256	2.616	50	0		FFAARM
CN(CC(=O)N1C[C@@H](c2ccc(F)cc2)[C@H](C(=O)[O-])C1)c1ccccc1	ZINC000091656215	522448948	/nfs/dbraw/zinc/44/89/48/522448948.db2.gz	HRFGIHJJGSONAZ-ZWKOTPCHSA-N	-1	0	356.397	2.589	50	0		FFAARM
C[C@H](Cc1ccccc1C(F)(F)F)N(C)C(=O)c1cnc(C(=O)[O-])cn1	ZINC000630300098	522776774	/nfs/dbraw/zinc/77/67/74/522776774.db2.gz	PDSSFOTZNBZSON-SNVBAGLBSA-N	-1	0	367.327	2.897	50	0		FFAARM
COc1ccc(CCC(=O)N2Cc3ccccc3C[C@@H]2C(=O)[O-])cc1F	ZINC000268935673	523920683	/nfs/dbraw/zinc/92/06/83/523920683.db2.gz	GDTXCQKSULLEAG-QGZVFWFLSA-N	-1	0	357.381	2.805	50	0		FFAARM
COc1ccc(CCC(=O)NC2(C(=O)[O-])CCC2)cc1Br	ZINC000164817096	523922226	/nfs/dbraw/zinc/92/22/26/523922226.db2.gz	UZHYZMWAJONCJQ-UHFFFAOYSA-N	-1	0	356.216	2.514	50	0		FFAARM
COc1ccc([C@H](CC(=O)[O-])NC(=O)[C@H]2COc3ccccc32)cc1OC	ZINC000268941096	525345762	/nfs/dbraw/zinc/34/57/62/525345762.db2.gz	LQAZKYSMDPYLAM-GJZGRUSLSA-N	-1	0	371.389	2.512	50	0		FFAARM
Cc1cc(C(=O)N2CCOC[C@H]2C(=O)[O-])c(C)n1[C@H](C)c1ccccc1	ZINC000262560621	526255743	/nfs/dbraw/zinc/25/57/43/526255743.db2.gz	YHYBMNGDIOMSJZ-KDOFPFPSSA-N	-1	0	356.422	2.640	50	0		FFAARM
O=C([O-])[C@@H]1CCCN1CC(=O)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000262613515	526276162	/nfs/dbraw/zinc/27/61/62/526276162.db2.gz	CGYIKPPFNADDOF-MOPGFXCFSA-N	-1	0	352.434	2.636	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)c2cc(-c3ccccc3)nc3ccccc32)CCO1	ZINC000178280870	526286891	/nfs/dbraw/zinc/28/68/91/526286891.db2.gz	LQRWIHVELUZYMC-IBGZPJMESA-N	-1	0	362.385	2.827	50	0		FFAARM
O=C([O-])[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)CCc1nc(-c2ccoc2)no1	ZINC000268938422	526291796	/nfs/dbraw/zinc/29/17/96/526291796.db2.gz	JDCPTIKURAPWJV-XBFCOCLRSA-N	-1	0	359.382	2.507	50	0		FFAARM
O=C([O-])c1ccc(CCNC(=O)[C@H]2C[C@H]2c2ccc3c(c2)OCCO3)cc1	ZINC000299748763	526364917	/nfs/dbraw/zinc/36/49/17/526364917.db2.gz	ICEBUTZXBQDAQE-IRXDYDNUSA-N	-1	0	367.401	2.618	50	0		FFAARM
O=C([O-])c1ccc(Br)c(N2C(=O)[C@@H]3CCCC[C@@H]3C2=O)c1	ZINC000110075921	570569633	/nfs/dbraw/zinc/56/96/33/570569633.db2.gz	DZJIVAZJTPUGRZ-AOOOYVTPSA-N	-1	0	352.184	2.827	50	0		FFAARM
O=C(Nc1cnn(C[C@H]2CCCO2)c1)c1ccc(Br)cc1[O-]	ZINC000084340754	571082877	/nfs/dbraw/zinc/08/28/77/571082877.db2.gz	NIMMHIFCAXUCIO-GFCCVEGCSA-N	-1	0	366.215	2.783	50	0		FFAARM
O=C([O-])CN(Cc1ccc(Cl)s1)C(=O)NCCc1cscn1	ZINC000888093311	734010983	/nfs/dbraw/zinc/01/09/83/734010983.db2.gz	BMCJRPQDRFAAIA-UHFFFAOYSA-N	-1	0	359.860	2.697	50	0		FFAARM
CO[C@@H]1C[C@H](CC(=O)[O-])N(C(=O)[C@@H]2C[C@H]2c2cccc(C(F)(F)F)c2)C1	ZINC000263205104	980557128	/nfs/dbraw/zinc/55/71/28/980557128.db2.gz	ZAWKBQIDLVBQEO-APIJFGDWSA-N	-1	0	371.355	2.900	50	0		FFAARM
Cc1cc2ncc(C(=O)N3CC[C@H](C(=O)[O-])c4ccccc43)c(C)n2n1	ZINC000669436528	984588976	/nfs/dbraw/zinc/58/89/76/984588976.db2.gz	VDECMTVVAFHOLF-AWEZNQCLSA-N	-1	0	350.378	2.565	50	0		FFAARM
COc1ccc2c(c1)[C@H](C(=O)N[C@@H](c1nnn[n-]1)c1ccccc1)CCC2	ZINC000655391591	1025208350	/nfs/dbraw/zinc/20/83/50/1025208350.db2.gz	XJQSOWDIHHFYCQ-SJLPKXTDSA-N	-1	0	363.421	2.534	50	0		FFAARM
Cc1nn(C)c2ncc(C(=O)[O-])c(N3CC(Oc4cccc(C)c4)C3)c12	ZINC001529180713	1062204204	/nfs/dbraw/zinc/20/42/04/1062204204.db2.gz	JHYQMKPEIDGYLF-UHFFFAOYSA-N	-1	0	352.394	2.551	50	0		FFAARM
CCCC1(C(=O)[O-])CCN(C(=O)c2ccc(SCCO)cc2)CC1	ZINC000217660030	222673421	/nfs/dbraw/zinc/67/34/21/222673421.db2.gz	NZJBJIFTUOTLAZ-UHFFFAOYSA-N	-1	0	351.468	2.878	50	0		FFAARM
CC(=O)N1CCc2cc(C(=O)N[C@@H](CC(=O)[O-])c3ccc(F)cc3)ccc21	ZINC000013257899	210141186	/nfs/dbraw/zinc/14/11/86/210141186.db2.gz	OOPHOHFILVNEIH-KRWDZBQOSA-N	-1	0	370.380	2.681	50	0		FFAARM
O=C([O-])[C@H]1CC=CC[C@@H]1C(=O)Nc1ccc(C(=O)N2CCCCC2)cc1	ZINC000000794632	219321547	/nfs/dbraw/zinc/32/15/47/219321547.db2.gz	XLQUTUSBPFBIPN-IRXDYDNUSA-N	-1	0	356.422	2.918	50	0		FFAARM
O=C([O-])[C@@H](Cc1ccccc1)NS(=O)(=O)c1ccccc1C(F)(F)F	ZINC000000953447	219346614	/nfs/dbraw/zinc/34/66/14/219346614.db2.gz	OBPSPXVWEQDGSQ-CYBMUJFWSA-N	-1	0	373.352	2.680	50	0		FFAARM
Cc1coc2c1cc1c(C)c(CC(=O)N(C)CC(=O)[O-])c(=O)oc1c2C	ZINC000002152406	219429327	/nfs/dbraw/zinc/42/93/27/219429327.db2.gz	GTKGPARLZOTDTP-UHFFFAOYSA-N	-1	0	357.362	2.550	50	0	biogenic	FFAARM
CCOc1ncccc1C(=O)N1CCC(C(=O)[O-])(c2ccccc2)CC1	ZINC000237006673	222904487	/nfs/dbraw/zinc/90/44/87/222904487.db2.gz	PMBKWHRBWQTECO-UHFFFAOYSA-N	-1	0	354.406	2.739	50	0		FFAARM
CC(C)Oc1cc(Br)ccc1C(=O)N1CC[C@@H](C(=O)[O-])C1	ZINC000236612369	222904641	/nfs/dbraw/zinc/90/46/41/222904641.db2.gz	XHKHLZGYCKHDEY-SNVBAGLBSA-N	-1	0	356.216	2.783	50	0		FFAARM
CCc1cc(=O)oc2c(C)c(O[C@@H](C)C(=O)N3CCC[C@@H]3C(=O)[O-])ccc12	ZINC000004064431	219537701	/nfs/dbraw/zinc/53/77/01/219537701.db2.gz	HIQXOQJXNWRHBJ-SWLSCSKDSA-N	-1	0	373.405	2.507	50	0	biogenic	FFAARM
Cc1sc(NC(=O)CSc2nc([O-])cc(=O)[nH]2)nc1-c1ccccc1	ZINC000012730883	220022460	/nfs/dbraw/zinc/02/24/60/220022460.db2.gz	JZOMNGVGOXQEAB-UHFFFAOYSA-N	-1	0	374.447	2.638	50	0		FFAARM
Cc1ccc(Cl)c(O[C@@H](C)C(=O)N(CC(=O)[O-])C2CCOCC2)c1	ZINC000299752685	211834800	/nfs/dbraw/zinc/83/48/00/211834800.db2.gz	VATKGQRQTIBATM-LBPRGKRZSA-N	-1	0	355.818	2.508	50	0		FFAARM
O=C([O-])[C@@H]1COCCN1C(=O)c1ccc(Oc2ccc(F)cc2F)cc1	ZINC000299749774	211832121	/nfs/dbraw/zinc/83/21/21/211832121.db2.gz	LLSFFPFTUUQAQP-HNNXBMFYSA-N	-1	0	363.316	2.683	50	0		FFAARM
O=C([O-])[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)C1	ZINC000299742454	211824858	/nfs/dbraw/zinc/82/48/58/211824858.db2.gz	JGMSNNHVUQHNLC-KWCYVHTRSA-N	-1	0	352.228	2.876	50	0		FFAARM
O=C([O-])[C@@H]1CCCN(C(=O)[C@@H]2C[C@@H]2c2ccc(Br)cc2)C1	ZINC000299742455	211823841	/nfs/dbraw/zinc/82/38/41/211823841.db2.gz	JGMSNNHVUQHNLC-MRVWCRGKSA-N	-1	0	352.228	2.876	50	0		FFAARM
CC(=O)Nc1ccc(S(=O)(=O)[N-]c2cnn(Cc3ccccc3)c2)cc1	ZINC000014227486	220118864	/nfs/dbraw/zinc/11/88/64/220118864.db2.gz	SLTZEZDLZUHISR-UHFFFAOYSA-N	-1	0	370.434	2.691	50	0		FFAARM
O=C([O-])[C@@H]1CCCN(C(=O)CCCc2nc(-c3ccc(F)cc3)no2)C1	ZINC000299745322	211826213	/nfs/dbraw/zinc/82/62/13/211826213.db2.gz	XXPLZHUBNSJJDT-CYBMUJFWSA-N	-1	0	361.373	2.522	50	0		FFAARM
NC(=O)c1c(SCc2ccc(Cl)nc2)sc2c1[nH]c(=O)cc2[O-]	ZINC000036365799	211663768	/nfs/dbraw/zinc/66/37/68/211663768.db2.gz	NHXCHIQNMULNRT-UHFFFAOYSA-N	-1	0	367.839	2.735	50	0		FFAARM
COc1cccc(-c2nc(CC(=O)N3CCC[C@@H](C(=O)[O-])C3)cs2)c1	ZINC000032092540	211543177	/nfs/dbraw/zinc/54/31/77/211543177.db2.gz	VBFTWHICXCNMMP-CYBMUJFWSA-N	-1	0	360.435	2.684	50	0		FFAARM
COc1cccc(NC(=O)Cc2c(C)[n-]n(-c3nc(C)cs3)c2=O)c1	ZINC000021801985	211326004	/nfs/dbraw/zinc/32/60/04/211326004.db2.gz	KQOGINSSNKHCBJ-UHFFFAOYSA-N	-1	0	358.423	2.841	50	0		FFAARM
COc1cccc(N2C(=O)C[C@@H](Sc3ccccc3C(=O)[O-])C2=O)c1	ZINC000019863004	211259004	/nfs/dbraw/zinc/25/90/04/211259004.db2.gz	BIOMZRBOOIMBTP-OAHLLOKOSA-N	-1	0	357.387	2.818	50	0		FFAARM
O=C([O-])[C@H]1C2CCC(CC2)[C@H]1C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000017075900	211179795	/nfs/dbraw/zinc/17/97/95/211179795.db2.gz	QJYMVHPWVBCBQO-PCHAPFSGSA-N	-1	0	370.449	2.998	50	0		FFAARM
CC[C@@H]1CCc2c(sc(NC(=O)C[C@@H](C)CC(=O)[O-])c2C(N)=O)C1	ZINC000017073061	211177286	/nfs/dbraw/zinc/17/72/86/211177286.db2.gz	MGXNAIHDNDGLSA-NXEZZACHSA-N	-1	0	352.456	2.801	50	0		FFAARM
O=C([O-])CCNC(=O)CSc1nc2ccccc2nc1-c1ccccc1	ZINC000016492062	211162705	/nfs/dbraw/zinc/16/27/05/211162705.db2.gz	SXKZZDOIEKKNRZ-UHFFFAOYSA-N	-1	0	367.430	2.980	50	0		FFAARM
O=C(CCC1=Nc2ccccc2S(=O)(=O)[N-]1)NCCCc1ccccc1	ZINC000015726019	211140164	/nfs/dbraw/zinc/14/01/64/211140164.db2.gz	ZWPQFVIHEVYHSY-UHFFFAOYSA-N	-1	0	371.462	2.538	50	0		FFAARM
COc1ccc(-c2ccc(S(=O)(=O)N[C@H](C(=O)[O-])C(C)C)cc2)cc1	ZINC000013534671	211037734	/nfs/dbraw/zinc/03/77/34/211037734.db2.gz	MDWFJTBWOFNAQX-KRWDZBQOSA-N	-1	0	363.435	2.750	50	0		FFAARM
CC(=O)N1CCc2cc(NC(=O)C[C@@](C)(C(=O)[O-])c3ccccc3)ccc21	ZINC000013468095	211034685	/nfs/dbraw/zinc/03/46/85/211034685.db2.gz	ZMSPXTDQBCEKQM-OAQYLSRUSA-N	-1	0	366.417	2.967	50	0		FFAARM
Cc1noc(C)c1S(=O)(=O)[N-]c1ccc(N2CCCC2=O)c(Cl)c1	ZINC000012910431	211007114	/nfs/dbraw/zinc/00/71/14/211007114.db2.gz	VZXLXDAECLREQS-UHFFFAOYSA-N	-1	0	369.830	2.872	50	0		FFAARM
O=C([O-])c1ccccc1SCC(=O)NCCc1ccc2c(c1)OCCO2	ZINC000012975884	211014077	/nfs/dbraw/zinc/01/40/77/211014077.db2.gz	LDJGDQRGRRSLRV-UHFFFAOYSA-N	-1	0	373.430	2.607	50	0		FFAARM
Cc1noc(C)c1S(=O)(=O)[N-]c1ccc(Nc2ccc(C)nn2)cc1	ZINC000035597962	210783903	/nfs/dbraw/zinc/78/39/03/210783903.db2.gz	AKSNLSPFDDOCJJ-UHFFFAOYSA-N	-1	0	359.411	2.934	50	0		FFAARM
CCCN1C(=O)S/C(=C/c2ccc(O[C@@H](C)C(=O)[O-])c(OC)c2)C1=O	ZINC000004694881	210553823	/nfs/dbraw/zinc/55/38/23/210553823.db2.gz	NDRFJICXDODMNS-RSYJBZMQSA-N	-1	0	365.407	2.993	50	0		FFAARM
CC(C)[C@H](NC(=O)/C(=C\c1cccs1)NC(=O)c1ccccc1)C(=O)[O-]	ZINC000004698227	210553178	/nfs/dbraw/zinc/55/31/78/210553178.db2.gz	JQSRGQIYYVCSDD-SFKKXYGYSA-N	-1	0	372.446	2.744	50	0		FFAARM
COc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccccc4)c=3c2=O)cc1Cl	ZINC000004483886	210532127	/nfs/dbraw/zinc/53/21/27/210532127.db2.gz	TVLMVWSDOOYSDP-HZPDHXFCSA-N	-1	0	370.796	2.842	50	0		FFAARM
CCCCCn1c2ccccc2c([O-])c(C(=O)Nc2cnccn2)c1=O	ZINC000002320442	210389807	/nfs/dbraw/zinc/38/98/07/210389807.db2.gz	HXHOKUVARVGURM-UHFFFAOYSA-N	-1	0	352.394	2.940	50	0		FFAARM
CCCC[C@H](NC(=O)COc1ccc2c(C)c(C)c(=O)oc2c1)C(=O)[O-]	ZINC000002150425	210382138	/nfs/dbraw/zinc/38/21/38/210382138.db2.gz	HTMHASZKGCVGFE-HNNXBMFYSA-N	-1	0	361.394	2.548	50	0	biogenic	FFAARM
COc1ccc([N-]S(=O)(=O)c2cc(OC)ccc2OC)c(OC)c1	ZINC000001144267	210323906	/nfs/dbraw/zinc/32/39/06/210323906.db2.gz	GLKUBARUPAFLSX-UHFFFAOYSA-N	-1	0	353.396	2.522	50	0		FFAARM
CC(=O)[N-]S(=O)(=O)c1ccc(NC(=O)/C(C)=C\c2ccccc2)cc1	ZINC000001128415	210320557	/nfs/dbraw/zinc/32/05/57/210320557.db2.gz	GSHFFUIOCLWODO-SEYXRHQNSA-N	-1	0	358.419	2.553	50	0		FFAARM
CC(=O)[N-]S(=O)(=O)c1ccc(NC(=O)CCC2CCCCC2)cc1	ZINC000000997285	210300516	/nfs/dbraw/zinc/30/05/16/210300516.db2.gz	ALIYBAPVXUJNBV-UHFFFAOYSA-N	-1	0	352.456	2.810	50	0		FFAARM
CCN1CCN([C@H](c2sc3nc(C)nn3c2[O-])c2ccccc2)CC1	ZINC000022458749	220386929	/nfs/dbraw/zinc/38/69/29/220386929.db2.gz	NDIDXLQYNPLUHV-HNNXBMFYSA-N	-1	0	357.483	2.532	50	0		FFAARM
Cc1nc2sc([C@@H](c3cccc(Cl)c3)N3CCOCC3)c([O-])n2n1	ZINC000023157757	220417266	/nfs/dbraw/zinc/41/72/66/220417266.db2.gz	JAELKPWETXHFKH-CYBMUJFWSA-N	-1	0	364.858	2.880	50	0		FFAARM
CC1(C)c2sc(=O)[nH]c2S[C@H](C(=O)[O-])[C@@H]1C(=O)c1ccc(F)cc1	ZINC000032594634	220665295	/nfs/dbraw/zinc/66/52/95/220665295.db2.gz	UWUHFWYLCGSROY-ONGXEEELSA-N	-1	0	367.423	2.911	50	0		FFAARM
COC(=O)C1=C(C)N(CC(C)C)C(=S)N[C@H]1c1ccc(C(=O)[O-])cc1	ZINC000058202160	221106056	/nfs/dbraw/zinc/10/60/56/221106056.db2.gz	DNXCQSGADNVQEC-HNNXBMFYSA-N	-1	0	362.451	2.719	50	0		FFAARM
CCOC(=O)c1ccc(NC(=O)c2c(=O)[nH]c3ccsc3c2[O-])cc1	ZINC000065215121	221181177	/nfs/dbraw/zinc/18/11/77/221181177.db2.gz	YFRUZZWDZMXYRV-UHFFFAOYSA-N	-1	0	358.375	2.724	50	0		FFAARM
Cc1ccc([N-]S(=O)(=O)c2cc(-c3ccc(=O)[nH]n3)cs2)c(F)c1	ZINC000065129075	221170716	/nfs/dbraw/zinc/17/07/16/221170716.db2.gz	STTIWVXNKDCRKF-UHFFFAOYSA-N	-1	0	365.411	2.747	50	0		FFAARM
COc1ccc(C)cc1-n1c(SCC(=O)[O-])nnc1C1CCOCC1	ZINC000065452477	221220309	/nfs/dbraw/zinc/22/03/09/221220309.db2.gz	RSNNGAMEFBTAHX-UHFFFAOYSA-N	-1	0	363.439	2.655	50	0		FFAARM
CC(C)(C)OC(=O)NC1CCN(C(=O)c2c([O-])cc(F)cc2F)CC1	ZINC000066046705	221237825	/nfs/dbraw/zinc/23/78/25/221237825.db2.gz	JMIQFSKYOCIKMH-UHFFFAOYSA-N	-1	0	356.369	2.800	50	0		FFAARM
CCCn1nc(C(=O)[O-])c2c1CC[C@H](N1CC(Oc3cccc(C)c3)C1)C2	ZINC000067966904	221310375	/nfs/dbraw/zinc/31/03/75/221310375.db2.gz	PNOHVFGTBYQBFE-HNNXBMFYSA-N	-1	0	369.465	2.920	50	0		FFAARM
COc1cc(NC(=O)[C@H]2[C@H](C(=O)[O-])C2(C)C)ccc1-c1ccc(CO)o1	ZINC000071281935	221337947	/nfs/dbraw/zinc/33/79/47/221337947.db2.gz	VRFQOPXZDFOKBE-HZPDHXFCSA-N	-1	0	359.378	2.743	50	0		FFAARM
CCOC(=O)Cn1nc(C)c2c1NC(=O)C[C@@H]2c1ccc(C(=O)[O-])cc1	ZINC000071281825	221338200	/nfs/dbraw/zinc/33/82/00/221338200.db2.gz	OZIXABBKLRBNJV-CYBMUJFWSA-N	-1	0	357.366	2.576	50	0		FFAARM
CC1(C)[C@H](C(=O)Nc2ccc(C(=O)NC3CC3)c(Cl)c2)[C@@H]1C(=O)[O-]	ZINC000071284838	221339011	/nfs/dbraw/zinc/33/90/11/221339011.db2.gz	YHKFJQXZXOEINQ-QWHCGFSZSA-N	-1	0	350.802	2.528	50	0		FFAARM
COc1ccc(C(=O)NC2CCCC2)cc1NC(=O)[C@H]1[C@@H](C(=O)[O-])C1(C)C	ZINC000071287539	221340612	/nfs/dbraw/zinc/34/06/12/221340612.db2.gz	AWUJXOXSTGRUNI-CVEARBPZSA-N	-1	0	374.437	2.663	50	0		FFAARM
COCCNS(=O)(=O)c1cc(C(=O)[O-])cc(-c2c(C)cccc2C)c1	ZINC000071403928	221344765	/nfs/dbraw/zinc/34/47/65/221344765.db2.gz	HKWDNEZOCSYNFE-UHFFFAOYSA-N	-1	0	363.435	2.593	50	0		FFAARM
CC(NCc1ccccc1)=C1C(=O)[N-]C(=O)N(c2cccc(Cl)c2)C1=O	ZINC000006360625	533416967	/nfs/dbraw/zinc/41/69/67/533416967.db2.gz	QHUCFJVOUBLPGI-FOWTUZBSSA-N	-1	0	369.808	2.987	50	0		FFAARM
Cc1ccc(F)c(OC2(C(=O)[O-])CCN(c3ncnc4[nH]ccc43)CC2)c1	ZINC000082106595	132195054	/nfs/dbraw/zinc/19/50/54/132195054.db2.gz	CZDNFYDTWCJGPM-UHFFFAOYSA-N	-1	0	370.384	2.908	50	0		FFAARM
O=C([O-])c1ccc(S(=O)(=O)N2CCCc3c(F)cc(F)cc32)cc1	ZINC000042006961	136121100	/nfs/dbraw/zinc/12/11/00/136121100.db2.gz	WJTZCEOLEOXNKA-UHFFFAOYSA-N	-1	0	353.346	2.805	50	0		FFAARM
Cc1ccc(CC(=O)Nc2ccc(N3CCOCC3)cc2C(=O)[O-])cc1	ZINC000064589212	136133477	/nfs/dbraw/zinc/13/34/77/136133477.db2.gz	QJAKAVYTCWUNLY-UHFFFAOYSA-N	-1	0	354.406	2.711	50	0		FFAARM
CCc1nc(CC(=O)Nc2ccc(-n3ccc(C(=O)[O-])n3)cc2)cs1	ZINC000095425270	221901215	/nfs/dbraw/zinc/90/12/15/221901215.db2.gz	PMYPPVIMWSKHAH-UHFFFAOYSA-N	-1	0	356.407	2.771	50	0		FFAARM
COc1ccc(C(=O)NCCc2ccccc2Cl)cc1OCC(=O)[O-]	ZINC000095424284	221901272	/nfs/dbraw/zinc/90/12/72/221901272.db2.gz	FZFOUSCLAJHMAQ-UHFFFAOYSA-N	-1	0	363.797	2.785	50	0		FFAARM
CC(=O)Nc1cccc(NS(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)c1	ZINC000096742784	222129479	/nfs/dbraw/zinc/12/94/79/222129479.db2.gz	WRGJWXXTYMVTMA-YFHOEESVSA-N	-1	0	360.391	2.544	50	0		FFAARM
CCc1ccc(Cn2[nH][n-]c3c(=O)n(-c4ccc(F)cc4)c(=O)c2=3)cc1	ZINC000101167258	222264815	/nfs/dbraw/zinc/26/48/15/222264815.db2.gz	UUMNYXAVKLUMKN-DLBZAZTESA-N	-1	0	352.369	2.882	50	0		FFAARM
COc1ccc(-n2c(=O)c3[n-][nH]n(Cc4cccc(Cl)c4)c=3c2=O)cc1	ZINC000101167293	222265701	/nfs/dbraw/zinc/26/57/01/222265701.db2.gz	ZISPBMLHLLCEMR-CVEARBPZSA-N	-1	0	370.796	2.842	50	0		FFAARM
CCn1c(=O)c2ccc(C(=O)NCc3ccc(OC)cc3)cc2[n-]c1=S	ZINC000102177243	222291280	/nfs/dbraw/zinc/29/12/80/222291280.db2.gz	UVOLQJZXEJKYIJ-UHFFFAOYSA-N	-1	0	369.446	2.644	50	0		FFAARM
COC(=O)c1ccc(Cl)c(S(=O)(=O)[N-]c2ccc3n[nH]cc3c2)c1	ZINC000032591535	506268128	/nfs/dbraw/zinc/26/81/28/506268128.db2.gz	ZJOYEDLWLWSDMV-UHFFFAOYSA-N	-1	0	365.798	2.804	50	0		FFAARM
O=C([O-])CCCCNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1	ZINC000001795943	506268677	/nfs/dbraw/zinc/26/86/77/506268677.db2.gz	WKQMBWYARCDXPR-UHFFFAOYSA-N	-1	0	359.753	2.892	50	0		FFAARM
Cc1ccnc([N-]S(=O)(=O)c2ccc(NC(=O)C3CCCC3)cc2)n1	ZINC000002761351	506289153	/nfs/dbraw/zinc/28/91/53/506289153.db2.gz	JSHCICFKALMLKH-UHFFFAOYSA-N	-1	0	360.439	2.715	50	0		FFAARM
Cc1nn(Cc2ccc(C)cc2)c(C)c1[N-]S(=O)(=O)c1cnn(C)c1C	ZINC000002792026	506293267	/nfs/dbraw/zinc/29/32/67/506293267.db2.gz	PAERARZZBUHQCZ-UHFFFAOYSA-N	-1	0	373.482	2.699	50	0		FFAARM
O=C([O-])C1CCN(C(=O)N2C[C@@H](c3ccccc3)Oc3cccnc32)CC1	ZINC000032918869	506312723	/nfs/dbraw/zinc/31/27/23/506312723.db2.gz	NPDZFXDZGFQORH-KRWDZBQOSA-N	-1	0	367.405	2.938	50	0		FFAARM
CN(C)c1ccc(NS(=O)(=O)c2ccccc2Cl)cc1C(=O)[O-]	ZINC000032962254	506318542	/nfs/dbraw/zinc/31/85/42/506318542.db2.gz	QLFUSHYFELPTEY-UHFFFAOYSA-N	-1	0	354.815	2.905	50	0		FFAARM
NC(=O)c1c(NC(=O)[C@H]2CCCC[C@H]2C(=O)[O-])sc2c1CCCCC2	ZINC000004150413	506363212	/nfs/dbraw/zinc/36/32/12/506363212.db2.gz	JTUBJJWMUUKQGL-WDEREUQCSA-N	-1	0	364.467	2.945	50	0		FFAARM
Cc1cccc(NC(=O)CSC2=Nc3ccccc3S(=O)(=O)[N-]2)c1	ZINC000004306482	506370403	/nfs/dbraw/zinc/37/04/03/506370403.db2.gz	MZEIQROGOFLDMF-UHFFFAOYSA-N	-1	0	361.448	2.837	50	0		FFAARM
O=c1c2[n-][nH]n(Cc3cccc(F)c3)c=2c(=O)n1-c1ccc(Cl)cc1	ZINC000004483671	506378269	/nfs/dbraw/zinc/37/82/69/506378269.db2.gz	BMFSPEGDPKKYKV-CABCVRRESA-N	-1	0	358.760	2.973	50	0		FFAARM
CC(=O)Nc1cc(S(=O)(=O)Nc2cccc(C(=O)[O-])c2)c(C)cc1C	ZINC000004660803	506385889	/nfs/dbraw/zinc/38/58/89/506385889.db2.gz	LGSOAMUMEWOSMT-UHFFFAOYSA-N	-1	0	362.407	2.761	50	0		FFAARM
CCOc1ccccc1[N-]S(=O)(=O)c1ccc(OC)c(NC(C)=O)c1	ZINC000004742187	506391946	/nfs/dbraw/zinc/39/19/46/506391946.db2.gz	YWISFKMFFTXJDP-UHFFFAOYSA-N	-1	0	364.423	2.853	50	0		FFAARM
Cc1ccc(S(=O)(=O)[N-]c2ccccc2C(=O)NC[C@@H]2CCCO2)cc1	ZINC000004756766	506393375	/nfs/dbraw/zinc/39/33/75/506393375.db2.gz	QDIJTPUGGCTKBI-HNNXBMFYSA-N	-1	0	374.462	2.705	50	0		FFAARM
COC(=O)N1CCCc2cc(NC(=O)[C@@H]3CC=CC[C@H]3C(=O)[O-])ccc21	ZINC000006668249	506495818	/nfs/dbraw/zinc/49/58/18/506495818.db2.gz	KPFUFQIEFZZIBO-HUUCEWRRSA-N	-1	0	358.394	2.811	50	0		FFAARM
Cc1ccccc1CN1CCN(C(=O)[C@H]2C3CCC(CC3)[C@H]2C(=O)[O-])CC1	ZINC000006742237	506502517	/nfs/dbraw/zinc/50/25/17/506502517.db2.gz	PMDQKGUKRVSLDM-ZYKFHVCXSA-N	-1	0	370.493	2.776	50	0		FFAARM
CCOC(=O)c1cc(S(=O)(=O)[N-]c2cccc(Cl)c2C)cn1C	ZINC000006800589	506506969	/nfs/dbraw/zinc/50/69/69/506506969.db2.gz	SOIBOIFUNWREDG-UHFFFAOYSA-N	-1	0	356.831	2.964	50	0		FFAARM
O=c1c2ccccc2cnn1Cc1n[n-]c(=S)n1-c1ccccc1F	ZINC000006923499	506517050	/nfs/dbraw/zinc/51/70/50/506517050.db2.gz	KCUSGQADKDQMIU-UHFFFAOYSA-N	-1	0	353.382	2.827	50	0		FFAARM
O=c1ccc(-c2ccc(S(=O)(=O)[N-]c3ccc(F)c(Cl)c3)o2)n[nH]1	ZINC000006974007	506522624	/nfs/dbraw/zinc/52/26/24/506522624.db2.gz	FQCMGPHOKHISRX-UHFFFAOYSA-N	-1	0	369.761	2.623	50	0		FFAARM
O=S(=O)([N-]CCCn1cnc2ccccc21)c1c(F)cccc1F	ZINC000007286635	506550066	/nfs/dbraw/zinc/55/00/66/506550066.db2.gz	MJMDZYPWBCFQKB-UHFFFAOYSA-N	-1	0	351.378	2.683	50	0		FFAARM
COc1ccc(OCC(=O)Nc2cc3c(cc2C(=O)[O-])OCCCO3)cc1	ZINC000007986627	506610794	/nfs/dbraw/zinc/61/07/94/506610794.db2.gz	SURNHCJMMQHAAF-UHFFFAOYSA-N	-1	0	373.361	2.572	50	0		FFAARM
CCc1cc(C(=O)[N-]S(=O)(=O)c2ccc3c(c2)OCCO3)sc1C	ZINC000042269060	506614391	/nfs/dbraw/zinc/61/43/91/506614391.db2.gz	VFOIQUSNHAQEOQ-UHFFFAOYSA-N	-1	0	367.448	2.509	50	0		FFAARM
COC(=O)[C@@]([N-]c1nc2ccc(C)cc2s1)(NC(C)=O)C(F)(F)F	ZINC000008997122	506677834	/nfs/dbraw/zinc/67/78/34/506677834.db2.gz	CMEKODSTGXFTTR-ZDUSSCGKSA-N	-1	0	361.345	2.584	50	0		FFAARM
CCn1c(SCC(=O)[O-])nnc1-c1cc(Br)ccc1O	ZINC000009235670	506687508	/nfs/dbraw/zinc/68/75/08/506687508.db2.gz	TVTPJJPXSKYLOE-UHFFFAOYSA-N	-1	0	358.217	2.610	50	0		FFAARM
Cc1cc(C)cc(NC(=O)c2sc3[nH]c(=O)c(C(=O)[O-])cc3c2N)c1	ZINC000009328736	506691871	/nfs/dbraw/zinc/69/18/71/506691871.db2.gz	SQCDUKLOIFHLOX-UHFFFAOYSA-N	-1	0	357.391	2.739	50	0		FFAARM
Cc1c(F)cc(C(N)=O)cc1[N-]S(=O)(=O)c1ccc(Cl)cc1F	ZINC000055615046	506798296	/nfs/dbraw/zinc/79/82/96/506798296.db2.gz	CGSXJOUIMCDYIJ-UHFFFAOYSA-N	-1	0	360.769	2.826	50	0		FFAARM
Cc1cccc(C)c1OCCOC(=O)c1ccccc1[N-]S(C)(=O)=O	ZINC000012743573	506893910	/nfs/dbraw/zinc/89/39/10/506893910.db2.gz	YWKLCZQDTJUDSR-UHFFFAOYSA-N	-1	0	363.435	2.911	50	0		FFAARM
O=C([O-])[C@@H]1C2CCC(CC2)[C@@H]1C(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000017073973	507115311	/nfs/dbraw/zinc/11/53/11/507115311.db2.gz	GKGMJZXJBUDAIZ-JOCCRWCTSA-N	-1	0	358.438	2.599	50	0		FFAARM
CCN1c2ccc([N-]S(=O)(=O)c3c(C)noc3C)cc2C(C)(C)C1=O	ZINC000057280419	507228170	/nfs/dbraw/zinc/22/81/70/507228170.db2.gz	AUSAXDYLEAVHLC-UHFFFAOYSA-N	-1	0	363.439	2.736	50	0		FFAARM
C[C@H](C(=O)N1CCCc2ccccc21)S(=O)(=O)c1nc2ccccc2[n-]1	ZINC000047939949	507420789	/nfs/dbraw/zinc/42/07/89/507420789.db2.gz	PGZPOTZPXBTKJJ-CYBMUJFWSA-N	-1	0	369.446	2.705	50	0		FFAARM
Cc1noc(C)c1S(=O)(=O)[N-]c1ccccc1-c1n[nH]c(C2CC2)n1	ZINC000027597844	507670151	/nfs/dbraw/zinc/67/01/51/507670151.db2.gz	UVWKRAAUBKDMFR-UHFFFAOYSA-N	-1	0	359.411	2.755	50	0		FFAARM
O=C(/C=C/c1ccc(N2CCCC2=O)cc1)NC1(C(=O)[O-])CCCCC1	ZINC000071802793	507716717	/nfs/dbraw/zinc/71/67/17/507716717.db2.gz	DNQSGCCJZVQADL-DHZHZOJOSA-N	-1	0	356.422	2.730	50	0		FFAARM
Cc1ccccc1OC1(C(=O)[O-])CCN(C(=O)[C@@H](C)n2cccc2)CC1	ZINC000072419846	507786761	/nfs/dbraw/zinc/78/67/61/507786761.db2.gz	WGEUQGLHJPIMDC-MRXNPFEDSA-N	-1	0	356.422	2.882	50	0		FFAARM
Cn1c2ccccc2c2cc(CC(=O)N3CCOC[C@H]3CC(=O)[O-])ccc21	ZINC000072426311	507788342	/nfs/dbraw/zinc/78/83/42/507788342.db2.gz	UWUFSMTXGNCGJA-OAHLLOKOSA-N	-1	0	366.417	2.576	50	0		FFAARM
O=C([O-])c1ccn(-c2ccccc2NS(=O)(=O)c2ccc(F)cc2)n1	ZINC000078824362	507911612	/nfs/dbraw/zinc/91/16/12/507911612.db2.gz	JRKDXLURZZCREL-UHFFFAOYSA-N	-1	0	361.354	2.510	50	0		FFAARM
Cc1cc([N-]S(=O)(=O)c2ccc(F)c(C)c2)n(-c2ccc(C)nn2)n1	ZINC000079063309	507929384	/nfs/dbraw/zinc/92/93/84/507929384.db2.gz	CAORKVOTMXSKFX-UHFFFAOYSA-N	-1	0	361.402	2.527	50	0		FFAARM
O=C([O-])C[C@H](CC(=O)N1CCC2(CC1)OCCS2)c1cccs1	ZINC000090607356	507930214	/nfs/dbraw/zinc/93/02/14/507930214.db2.gz	GBPSPWIJGGPUHR-LBPRGKRZSA-N	-1	0	355.481	2.779	50	0		FFAARM
Cc1ccc(C(=O)N2CCC[C@@H](C(=O)NC3(C(=O)[O-])CCCCC3)C2)cc1	ZINC000095349830	508174160	/nfs/dbraw/zinc/17/41/60/508174160.db2.gz	PDRAVFDDCQTKCZ-QGZVFWFLSA-N	-1	0	372.465	2.751	50	0		FFAARM
Cc1nn(C)c(C)c1CCC(=O)N1CC[C@@H](Cc2cccc(C(=O)[O-])c2)C1	ZINC000095389510	508183520	/nfs/dbraw/zinc/18/35/20/508183520.db2.gz	IRLSNHZPGZQIJV-KRWDZBQOSA-N	-1	0	369.465	2.759	50	0		FFAARM
CCCn1cc(C(=O)N[C@@H](C(=O)[O-])c2ccc(F)c(Cl)c2)c(C)n1	ZINC000095526676	508195579	/nfs/dbraw/zinc/19/55/79/508195579.db2.gz	BTDGMBMXKOGAIV-CQSZACIVSA-N	-1	0	353.781	2.950	50	0		FFAARM
Cc1cc(S(=O)(=O)[N-]c2nc3ccccn3n2)sc1Br	ZINC000095944095	508198604	/nfs/dbraw/zinc/19/86/04/508198604.db2.gz	RDSHXVWLHPNOGJ-UHFFFAOYSA-N	-1	0	373.257	2.663	50	0		FFAARM
O=C([O-])[C@H](Cc1c[nH]c2cc(F)ccc12)NC(=O)CC[C@@H]1CCCCO1	ZINC000095989862	508200717	/nfs/dbraw/zinc/20/07/17/508200717.db2.gz	FBDADPPUHSKQPJ-YOEHRIQHSA-N	-1	0	362.401	2.768	50	0		FFAARM
Cc1ccc([N-]S(C)(=O)=O)c(C(=O)N2CCO[C@@H](c3ccccc3)C2)c1	ZINC000084131283	508266579	/nfs/dbraw/zinc/26/65/79/508266579.db2.gz	HQVOTIMPDSFIKF-GOSISDBHSA-N	-1	0	374.462	2.580	50	0		FFAARM
O=C([O-])[C@@H]1CCCCN1C(=O)c1cccc(-n2ccc(C(F)(F)F)n2)c1	ZINC000128620267	508619390	/nfs/dbraw/zinc/61/93/90/508619390.db2.gz	LPSFJSFQQZJLSM-ZDUSSCGKSA-N	-1	0	367.327	2.970	50	0		FFAARM
O=C(N[C@H]1CCN(C2CCCCC2)C1=O)c1ccc2[n-]c(=S)oc2c1	ZINC000151200140	508976967	/nfs/dbraw/zinc/97/69/67/508976967.db2.gz	GGDXNPSMXBYIMR-AWEZNQCLSA-N	-1	0	359.451	2.780	50	0		FFAARM
CC(C)[C@@H](C)NC(=O)N1CCc2[nH]c(-c3ccc(C(=O)[O-])cc3)nc2C1	ZINC000219388121	509288129	/nfs/dbraw/zinc/28/81/29/509288129.db2.gz	XALZEIQGNQTITP-GFCCVEGCSA-N	-1	0	356.426	2.887	50	0		FFAARM
CC(C)(C)c1cc([N-]S(=O)(=O)c2cc3c(cc2F)NC(=O)CC3)on1	ZINC000267341848	509454657	/nfs/dbraw/zinc/45/46/57/509454657.db2.gz	KBXSNNIUSJMEPA-UHFFFAOYSA-N	-1	0	367.402	2.797	50	0		FFAARM
CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)N[C@H](C(=O)[O-])c1ccccc1	ZINC000236825994	509511825	/nfs/dbraw/zinc/51/18/25/509511825.db2.gz	UYKLCDQLPOXTSE-ICSRJNTNSA-N	-1	0	364.401	2.893	50	0		FFAARM
CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)N[C@@H](C(=O)[O-])c1ccccc1	ZINC000236825329	509511888	/nfs/dbraw/zinc/51/18/88/509511888.db2.gz	UYKLCDQLPOXTSE-AZUAARDMSA-N	-1	0	364.401	2.893	50	0		FFAARM
CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)NCc1ccc(C(=O)[O-])o1	ZINC000236829964	509512474	/nfs/dbraw/zinc/51/24/74/509512474.db2.gz	VRDSQEYBNQQJHJ-MRXNPFEDSA-N	-1	0	354.362	2.558	50	0		FFAARM
C[C@@]1(C(=O)[O-])CCN(C(=O)CCc2ccc(Br)cc2F)C1	ZINC000237524079	509669728	/nfs/dbraw/zinc/66/97/28/509669728.db2.gz	CFACHWHDQSMIBB-OAHLLOKOSA-N	-1	0	358.207	2.844	50	0		FFAARM
C[C@@H]1CN(Cc2ccc(C(=O)NC3CCC(C(=O)[O-])CC3)cc2)C[C@H](C)O1	ZINC000237627392	509693776	/nfs/dbraw/zinc/69/37/76/509693776.db2.gz	BGOMWBUOUBRHSJ-MYMYQCDVSA-N	-1	0	374.481	2.669	50	0		FFAARM
Cc1ccc(N2CC[C@@H](C(=O)N3CCC[C@@H](CCC(=O)[O-])C3)C2=O)cc1C	ZINC000237628934	509696620	/nfs/dbraw/zinc/69/66/20/509696620.db2.gz	XUDIVKFQVCOTQN-WMZOPIPTSA-N	-1	0	372.465	2.760	50	0		FFAARM
COc1ccc([C@@H](C)CC(=O)[N-]S(=O)(=O)c2sc(C)nc2C)cc1	ZINC000170654748	509700688	/nfs/dbraw/zinc/70/06/88/509700688.db2.gz	FOQROCCHRGTNEY-JTQLQIEISA-N	-1	0	368.480	2.767	50	0		FFAARM
Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)N1CC[C@@H](C(=O)[O-])C1	ZINC000237669516	509706474	/nfs/dbraw/zinc/70/64/74/509706474.db2.gz	NKXCACOJJKYVMU-CQSZACIVSA-N	-1	0	361.829	2.748	50	0		FFAARM
Cc1ccc(C(=O)N(CCC(=O)[O-])C2CCOCC2)cc1Br	ZINC000237842535	509750820	/nfs/dbraw/zinc/75/08/20/509750820.db2.gz	JSTILQLRLVRHEY-UHFFFAOYSA-N	-1	0	370.243	2.853	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CCO1	ZINC000237963417	509785417	/nfs/dbraw/zinc/78/54/17/509785417.db2.gz	CSQMKJGELXYALD-JTQLQIEISA-N	-1	0	371.233	2.650	50	0		FFAARM
O=C([O-])CC[C@H]1CCCN(C(=O)c2cc(N3CCCC3=O)ccc2F)C1	ZINC000238018038	509799058	/nfs/dbraw/zinc/79/90/58/509799058.db2.gz	FDCWASBMUGRLQI-CYBMUJFWSA-N	-1	0	362.401	2.670	50	0		FFAARM
O=C([O-])COc1cccc(CNC(=O)[C@@H]2C[C@@H]2c2c(F)cccc2F)c1	ZINC000238018657	509799973	/nfs/dbraw/zinc/79/99/73/509799973.db2.gz	XEMVCXOZFZHOPJ-UONOGXRCSA-N	-1	0	361.344	2.848	50	0		FFAARM
O=C([O-])CN(C(=O)[C@H]1C[C@@H]1c1ccccc1C(F)(F)F)C1CCOCC1	ZINC000238105168	509821414	/nfs/dbraw/zinc/82/14/14/509821414.db2.gz	OUAFEDIYTWENKY-KGLIPLIRSA-N	-1	0	371.355	2.901	50	0		FFAARM
O=C([O-])C[C@@H]1CN(C(=O)c2ccc(-c3nc4ccccc4s3)o2)CCO1	ZINC000238200684	509832190	/nfs/dbraw/zinc/83/21/90/509832190.db2.gz	WWKXOUDHVNMJCA-LLVKDONJSA-N	-1	0	372.402	2.872	50	0		FFAARM
CC[C@H](C)[C@H](NC(=O)CCc1nc(-c2cccc3[nH]ccc32)no1)C(=O)[O-]	ZINC000252552896	509852158	/nfs/dbraw/zinc/85/21/58/509852158.db2.gz	VEWGJRXPIOULQD-GTNSWQLSSA-N	-1	0	370.409	2.766	50	0		FFAARM
O=C([O-])[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc2c(c1)NC(=O)CS2	ZINC000261657951	510015636	/nfs/dbraw/zinc/01/56/36/510015636.db2.gz	KJPKIKPTJFKACH-GDLCADMTSA-N	-1	0	360.435	2.589	50	0		FFAARM
CC1(C)CCc2sc([N-]S(=O)(=O)c3cccc4c3OCCO4)nc21	ZINC000333816962	511365418	/nfs/dbraw/zinc/36/54/18/511365418.db2.gz	GTVBTURQZZENKX-UHFFFAOYSA-N	-1	0	366.464	2.939	50	0		FFAARM
CCOc1cc(C(=O)N2CCC[C@@H]2C(=O)[O-])ccc1OCc1ccncc1	ZINC000299743350	511668837	/nfs/dbraw/zinc/66/88/37/511668837.db2.gz	KLGMPOIUOKVIQH-MRXNPFEDSA-N	-1	0	370.405	2.749	50	0		FFAARM
O=C([O-])c1ccc([C@H]2CCCN2S(=O)(=O)N2CCCCCC2)s1	ZINC000372494178	512902337	/nfs/dbraw/zinc/90/23/37/512902337.db2.gz	BDYHTKPRYLVWRQ-GFCCVEGCSA-N	-1	0	358.485	2.704	50	0		FFAARM
O=C([O-])Cn1nccc1[C@H]1CCC[N@H+](Cc2cnn(-c3ccccc3)c2)C1	ZINC000426535917	513972101	/nfs/dbraw/zinc/97/21/01/513972101.db2.gz	QXZAAUXHJXSBOQ-KRWDZBQOSA-N	-1	0	365.437	2.533	50	0		FFAARM
CC(C)[C@@H](CC(=O)[O-])NC(=O)N(C)Cc1cnn(-c2ccc(F)cc2)c1	ZINC000426573162	513984794	/nfs/dbraw/zinc/98/47/94/513984794.db2.gz	NSEBKMJLGMHNGU-MRXNPFEDSA-N	-1	0	362.405	2.652	50	0		FFAARM
Cc1ccccc1C1(C(=O)N2CCC[C@@H](n3cc(C(=O)[O-])cn3)C2)CC1	ZINC000153163022	518190830	/nfs/dbraw/zinc/19/08/30/518190830.db2.gz	XGPCPNAHMXSYJA-MRXNPFEDSA-N	-1	0	353.422	2.785	50	0		FFAARM
O=C([O-])CN(C(=O)/C=C\c1ccc(Br)s1)C1CCOCC1	ZINC000606441433	521069444	/nfs/dbraw/zinc/06/94/44/521069444.db2.gz	VKXRXFWZVHUCAN-RQOWECAXSA-N	-1	0	374.256	2.616	50	0		FFAARM
CC[C@@H](C)[C@H](NC(=O)CCc1nc(-c2cccc3[nH]ccc32)no1)C(=O)[O-]	ZINC000218338786	522371640	/nfs/dbraw/zinc/37/16/40/522371640.db2.gz	VEWGJRXPIOULQD-DIFFPNOSSA-N	-1	0	370.409	2.766	50	0		FFAARM
O=C(N=c1[n-]nc(Cc2ccc(F)cc2)s1)NCC[C@@H]1CC1(F)F	ZINC000621423349	522836442	/nfs/dbraw/zinc/83/64/42/522836442.db2.gz	RHJGCADZDHJGLW-SNVBAGLBSA-N	-1	0	356.373	2.857	50	0		FFAARM
O=C([O-])[C@@H]1C[C@H]1c1ccc(NS(=O)(=O)CCc2cccs2)cc1	ZINC000630424045	522838226	/nfs/dbraw/zinc/83/82/26/522838226.db2.gz	IFMLQLNOUOMFIR-LSDHHAIUSA-N	-1	0	351.449	2.921	50	0		FFAARM
C[C@]1(C(=O)[O-])CCN(C(=O)c2nc(C3CC3)n(-c3ccccc3Cl)n2)C1	ZINC000262104314	525232316	/nfs/dbraw/zinc/23/23/16/525232316.db2.gz	CZNZOATXNFKFSO-SFHVURJKSA-N	-1	0	374.828	2.735	50	0		FFAARM
Cc1ccc(C(=O)c2ccccc2C(=O)N2CCO[C@@H](CC(=O)[O-])C2)cc1	ZINC000262830675	526242111	/nfs/dbraw/zinc/24/21/11/526242111.db2.gz	SAEGNXLQXMVVFA-INIZCTEOSA-N	-1	0	367.401	2.542	50	0		FFAARM
O=C([O-])[C@@H]1CCCN1CC(=O)N1CCc2sccc2[C@@H]1c1ccccc1	ZINC000262607726	526274497	/nfs/dbraw/zinc/27/44/97/526274497.db2.gz	BBSNPOILQGCBTO-LPHOPBHVSA-N	-1	0	370.474	2.771	50	0		FFAARM
O=C([O-])c1ccc(CNC(=O)[C@H]2C[C@@H]2c2ccc3c(c2)OCCO3)cc1	ZINC000268943887	526367607	/nfs/dbraw/zinc/36/76/07/526367607.db2.gz	NOZSCKXCFJBBJB-CVEARBPZSA-N	-1	0	353.374	2.576	50	0		FFAARM
O=C([O-])c1cccnc1SCC(=O)c1cc2c(cc1Cl)NC(=O)C2	ZINC000020745972	526398681	/nfs/dbraw/zinc/39/86/81/526398681.db2.gz	ZJSBYQWZQLYXEX-UHFFFAOYSA-N	-1	0	362.794	2.903	50	0		FFAARM
O=C([O-])C[C@H]1CN(C(=O)c2ccc(COc3ccccc3)cc2)CCO1	ZINC000262828147	527636365	/nfs/dbraw/zinc/63/63/65/527636365.db2.gz	RTILCCQGDFPWCZ-SFHVURJKSA-N	-1	0	355.390	2.581	50	0		FFAARM
Cn1[n-]c(CCNC(=O)C2(c3cccc(C(F)(F)F)c3)CC2)cc1=O	ZINC000101806650	570824195	/nfs/dbraw/zinc/82/41/95/570824195.db2.gz	GUUSCEKUSSKLLT-UHFFFAOYSA-N	-1	0	353.344	2.535	50	0		FFAARM
O=C(/N=c1\[n-]nc2ccccn21)[C@H]1C[C@@H]1c1ccccc1Br	ZINC000084502245	571086882	/nfs/dbraw/zinc/08/68/82/571086882.db2.gz	ICTLYEVYGOEVPJ-NEPJUHHUSA-N	-1	0	357.211	2.656	50	0		FFAARM
CCN1c2ccc(S(=O)(=O)[N-]c3cc(C)ccn3)cc2C(C)(C)CC1=O	ZINC000096183028	571131938	/nfs/dbraw/zinc/13/19/38/571131938.db2.gz	KUVZOKVDRSIJTH-UHFFFAOYSA-N	-1	0	373.478	3.225	50	0		FFAARM
C[C@H](CCNC(=O)N1CCO[C@@H](C(=O)[O-])C1)c1cccc(C(F)(F)F)c1	ZINC000666534279	600997573	/nfs/dbraw/zinc/99/75/73/600997573.db2.gz	HRRCHMOAHIDFQO-BXUZGUMPSA-N	-1	0	374.359	2.694	50	0		FFAARM
CCOC(=O)NC([N-]c1nnc(C)s1)(C(F)(F)F)C(F)(F)F	ZINC000002937669	727774764	/nfs/dbraw/zinc/77/47/64/727774764.db2.gz	KSDYGSYPWCHQGP-UHFFFAOYSA-N	-1	0	352.260	2.825	50	0		FFAARM
O=C([O-])CNc1ccccc1C(=O)N1CCSC[C@@H]1c1cccnc1	ZINC000065460847	728156972	/nfs/dbraw/zinc/15/69/72/728156972.db2.gz	GVIRREXDXVANBW-MRXNPFEDSA-N	-1	0	357.435	2.508	50	0		FFAARM
O=C([O-])[C@H]1CCN(C(=O)NCCOCc2ccc(Cl)cc2Cl)C1	ZINC000263145017	729681021	/nfs/dbraw/zinc/68/10/21/729681021.db2.gz	AOMXHFQIOVSTEC-JTQLQIEISA-N	-1	0	361.225	2.626	50	0		FFAARM
Cc1nn(C)c(Cl)c1/C=C\C(=O)N1[C@H](C(=O)[O-])C[C@@H]2CCCC[C@@H]21	ZINC000323934439	729755792	/nfs/dbraw/zinc/75/57/92/729755792.db2.gz	AYEUTBUGBGOVDZ-DKBQRPRRSA-N	-1	0	351.834	2.639	50	0		FFAARM
CN(Cc1nccs1)[C@@H]1CC12CCN(c1ccnc(C(=O)[O-])c1)CC2	ZINC000650768324	731026372	/nfs/dbraw/zinc/02/63/72/731026372.db2.gz	UXZYGXJYRHMDNO-OAHLLOKOSA-N	-1	0	358.467	2.727	50	0		FFAARM
CC(C)CCOc1ccc(NC(=O)N2CCO[C@@H](C(=O)[O-])C2)c(F)c1	ZINC000653547365	731272348	/nfs/dbraw/zinc/27/23/48/731272348.db2.gz	ISWFEEPNQHGDAR-OAHLLOKOSA-N	-1	0	354.378	2.568	50	0		FFAARM
CC(C)(C)c1ncc(/C=C\C(=O)N(CC(=O)[O-])C2CCOCC2)s1	ZINC000584907999	845947469	/nfs/dbraw/zinc/94/74/69/845947469.db2.gz	IXKHTAXWUADMPZ-PLNGDYQASA-N	-1	0	352.456	2.546	50	0		FFAARM
O=C([O-])[C@@H]1CCN(C(=O)/C=C/c2ccc(OCc3cccnc3)cc2)C1	ZINC000178266149	969843366	/nfs/dbraw/zinc/84/33/66/969843366.db2.gz	VKWYOBJJOGBOIO-ZGRWHYIRSA-N	-1	0	352.390	2.607	50	0		FFAARM
CC1(C)CO[C@H](c2cccc(F)c2)CN1C(=O)c1ccnc(C(=O)[O-])c1	ZINC000659198559	975805241	/nfs/dbraw/zinc/80/52/41/975805241.db2.gz	GPLHCDWLDOXBTL-INIZCTEOSA-N	-1	0	358.369	2.911	50	0		FFAARM
COc1cc(C(=O)NN=Cc2ccccc2C(=O)[O-])ccc1OC(C)C	ZINC000254721487	984319301	/nfs/dbraw/zinc/31/93/01/984319301.db2.gz	OVBADHXZECCWOH-UHFFFAOYSA-N	-1	0	356.378	2.945	50	0		FFAARM
COc1cc(-c2nc(CN3CCC[C@H]3c3n[nH]c(=O)[n-]3)c(C)o2)ccc1F	ZINC000011949708	987792259	/nfs/dbraw/zinc/79/22/59/987792259.db2.gz	ADDWQDMXQLFVTB-AWEZNQCLSA-N	-1	0	373.388	2.546	50	0		FFAARM
O=C([O-])c1ccc(CN2CCC[C@@H](S(=O)(=O)Nc3ccccc3)C2)cc1	ZINC000666575967	1027132689	/nfs/dbraw/zinc/13/26/89/1027132689.db2.gz	CMQLRHCTSNUGJT-GOSISDBHSA-N	-1	0	374.462	2.791	50	0		FFAARM
Cc1[nH]c(C(=O)N(Cc2ccccn2)C[C@H]2CCCO2)c(C)c1C(=O)[O-]	ZINC001506423238	1059511073	/nfs/dbraw/zinc/51/10/73/1059511073.db2.gz	WZXGVQHRCPPZNG-OAHLLOKOSA-N	-1	0	357.410	2.546	50	0		FFAARM
C[C@H](Oc1ccccc1Br)C(=O)N1CCC[C@@H](C(=O)[O-])C1	ZINC000136165384	210089859	/nfs/dbraw/zinc/08/98/59/210089859.db2.gz	OWPOGKFKAKTOGA-WDEREUQCSA-N	-1	0	356.216	2.540	50	0		FFAARM
COc1ccc(CNC(=O)c2c([O-])c3cccc4c3n(c2=O)CCC4)cc1	ZINC000001321716	219394591	/nfs/dbraw/zinc/39/45/91/219394591.db2.gz	MUZLCYBOKYJJRK-UHFFFAOYSA-N	-1	0	364.401	2.592	50	0		FFAARM
O=C([O-])CC[C@@H]1CCCCN1C(=O)Cc1ccc(N2CCCC2=O)cc1	ZINC000237929330	222911016	/nfs/dbraw/zinc/91/10/16/222911016.db2.gz	LETGPIJCXPVMFK-INIZCTEOSA-N	-1	0	358.438	2.602	50	0		FFAARM
O=C([O-])CC[C@H]1CCCN(C(=O)[C@H]2COc3ccc(Cl)cc3C2)C1	ZINC000238015953	222912797	/nfs/dbraw/zinc/91/27/97/222912797.db2.gz	UYWQRDVXUKKWFN-TZMCWYRMSA-N	-1	0	351.830	2.995	50	0		FFAARM
O=C([O-])c1ccc(CCNC(=O)CC[C@H]2Cc3ccccc3NC2=O)cc1	ZINC000238081314	222913989	/nfs/dbraw/zinc/91/39/89/222913989.db2.gz	AAGBLUNQXAQUEN-KRWDZBQOSA-N	-1	0	366.417	2.635	50	0		FFAARM
C[C@@H](CC(=O)N1CCO[C@H](CC(=O)[O-])C1)c1cccc(C(F)(F)F)c1	ZINC000237335579	222907285	/nfs/dbraw/zinc/90/72/85/222907285.db2.gz	MACDDXVAEUBKRQ-SMDDNHRTSA-N	-1	0	359.344	2.901	50	0		FFAARM
CCN(c1ccccc1F)S(=O)(=O)[N-]C(=O)c1ccnc2ccccc21	ZINC000241465965	222919005	/nfs/dbraw/zinc/91/90/05/222919005.db2.gz	NTNLUOVYVBQAII-UHFFFAOYSA-N	-1	0	373.409	2.875	50	0		FFAARM
C[C@H](COCC(F)(F)F)NC(=O)c1ccc2c(c1)[n-]c(=S)[nH]c2=O	ZINC000058420772	212009231	/nfs/dbraw/zinc/00/92/31/212009231.db2.gz	JQVCLRKOVJSLMN-SSDOTTSWSA-N	-1	0	361.345	2.695	50	0		FFAARM
CC(C)n1ncc2cc(NC(=O)c3ccccc3[N-]S(C)(=O)=O)cnc21	ZINC000058349975	212006794	/nfs/dbraw/zinc/00/67/94/212006794.db2.gz	DOHWWALUAIRDPX-UHFFFAOYSA-N	-1	0	373.438	2.636	50	0		FFAARM
COc1ccc(NC(=O)c2c([O-])c3sccc3n(C)c2=O)cc1OC	ZINC000049409447	211887916	/nfs/dbraw/zinc/88/79/16/211887916.db2.gz	JRORJEULAVJXOG-UHFFFAOYSA-N	-1	0	360.391	2.575	50	0		FFAARM
COc1ccc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2C)cc1OC	ZINC000013027891	220055006	/nfs/dbraw/zinc/05/50/06/220055006.db2.gz	SIORSIQKPRFLMQ-UHFFFAOYSA-N	-1	0	351.380	2.511	50	0		FFAARM
CC(=O)Nc1cccc(NS(=O)(=O)c2ccc(/C=C/C(=O)[O-])cc2)c1	ZINC000013345506	220064365	/nfs/dbraw/zinc/06/43/65/220064365.db2.gz	WRGJWXXTYMVTMA-JXMROGBWSA-N	-1	0	360.391	2.544	50	0		FFAARM
COc1ccc2sc(C(=O)N(CC(=O)[O-])C3CCOCC3)c(C)c2c1	ZINC000299753749	211837854	/nfs/dbraw/zinc/83/78/54/211837854.db2.gz	ZFKDZOKUOZDMHT-UHFFFAOYSA-N	-1	0	363.435	2.924	50	0		FFAARM
O=C([O-])[C@H]1COCCN1C(=O)c1ccc(Oc2ccc(F)cc2F)cc1	ZINC000299749775	211831934	/nfs/dbraw/zinc/83/19/34/211831934.db2.gz	LLSFFPFTUUQAQP-OAHLLOKOSA-N	-1	0	363.316	2.683	50	0		FFAARM
COc1ccccc1-n1c2nc(C3CC3)cc(C(=O)[O-])c2c(=O)[nH]c1=S	ZINC000020615423	211291809	/nfs/dbraw/zinc/29/18/09/211291809.db2.gz	QVRAAFCZIWCBNH-UHFFFAOYSA-N	-1	0	369.402	2.654	50	0		FFAARM
Cc1cccc(-n2c(=S)[n-]c(=O)c3c2NCN(C[C@@H]2CCCO2)C3)c1C	ZINC000020567661	211287685	/nfs/dbraw/zinc/28/76/85/211287685.db2.gz	WRDQBEBLNVVIHB-AWEZNQCLSA-N	-1	0	372.494	2.876	50	0		FFAARM
Cc1ccc(CN2C(=O)C[C@H](Sc3ncccc3C(=O)[O-])C2=O)cc1	ZINC000019881897	211259671	/nfs/dbraw/zinc/25/96/71/211259671.db2.gz	AQGNNQZNPLCEQN-AWEZNQCLSA-N	-1	0	356.403	2.508	50	0		FFAARM
Cc1nc2[n-]c(C(=O)NCc3ccccc3)nn2c(=O)c1Cc1ccccc1	ZINC000018222000	211195641	/nfs/dbraw/zinc/19/56/41/211195641.db2.gz	CJKWWSXMKGCICN-UHFFFAOYSA-N	-1	0	373.416	2.659	50	0		FFAARM
CCn1c(=O)c2ccc(C(=O)NCCc3ccccc3C)cc2[n-]c1=S	ZINC000018104940	211192711	/nfs/dbraw/zinc/19/27/11/211192711.db2.gz	XINZQKBMSZITFR-UHFFFAOYSA-N	-1	0	367.474	2.986	50	0		FFAARM
CCCc1cc(C(N)=O)c(NC(=O)[C@H]2C3CCC(CC3)[C@H]2C(=O)[O-])s1	ZINC000017074936	211177459	/nfs/dbraw/zinc/17/74/59/211177459.db2.gz	FXFNZVXJGPCMNV-GSNUKPDKSA-N	-1	0	364.467	2.875	50	0		FFAARM
Cc1ccc([N-]S(=O)(=O)c2ccc3c(c2)NC(=O)[C@@H](C)CS3)nc1	ZINC000015730620	211138886	/nfs/dbraw/zinc/13/88/86/211138886.db2.gz	DYXQGWRUVRAMRC-NSHDSACASA-N	-1	0	363.464	2.871	50	0		FFAARM
COc1ccc(OC)c([C@@H](C)NC(=O)COc2ccc(CC(=O)[O-])cc2)c1	ZINC000013421426	211032019	/nfs/dbraw/zinc/03/20/19/211032019.db2.gz	GCULTVKZKGWTKY-CYBMUJFWSA-N	-1	0	373.405	2.587	50	0		FFAARM
COc1cccc(CCC(=O)N2CCc3cc(C(=O)[O-])ccc32)c1OC	ZINC000013449442	211034584	/nfs/dbraw/zinc/03/45/84/211034584.db2.gz	QKBCGPVBMXAVMX-UHFFFAOYSA-N	-1	0	355.390	2.924	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)c1ccc(N2CCCC2=O)cc1)c1cccs1	ZINC000013389756	211033202	/nfs/dbraw/zinc/03/32/02/211033202.db2.gz	BGAABSZUZYXPHK-CQSZACIVSA-N	-1	0	358.419	2.821	50	0		FFAARM
Cc1ccc(S(=O)(=O)Nc2cc3c(cc2C(=O)[O-])OCCO3)c(C)c1	ZINC000013090217	211023328	/nfs/dbraw/zinc/02/33/28/211023328.db2.gz	ILOTVBITJIFUIK-UHFFFAOYSA-N	-1	0	363.391	2.574	50	0		FFAARM
COC(=O)CN(C(=O)CSc1ccccc1C(=O)[O-])c1ccccc1	ZINC000012992740	211016622	/nfs/dbraw/zinc/01/66/22/211016622.db2.gz	AQBHAHDVMNYDMX-UHFFFAOYSA-N	-1	0	359.403	2.683	50	0		FFAARM
COC(=O)c1sccc1S(=O)(=O)[N-]c1cccc(NC(C)=O)c1C	ZINC000012520885	210962379	/nfs/dbraw/zinc/96/23/79/210962379.db2.gz	KYLGUJVDEVKDFV-UHFFFAOYSA-N	-1	0	368.436	2.602	50	0		FFAARM
COc1cc(C(=O)Nc2c([O-])c3ccccc3oc2=O)cc(OC)c1OC	ZINC000009607231	210842927	/nfs/dbraw/zinc/84/29/27/210842927.db2.gz	PCQMEEISGWDRLA-UHFFFAOYSA-N	-1	0	371.345	2.777	50	0		FFAARM
Cc1oc2cc3oc(=O)c(CCC(=O)N[C@H](C)C(=O)[O-])c(C)c3cc2c1C	ZINC000006167293	210659782	/nfs/dbraw/zinc/65/97/82/210659782.db2.gz	FNZRUUNIOKGVFU-LLVKDONJSA-N	-1	0	371.389	2.986	50	0		FFAARM
O=C([O-])[C@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)c1ccccc1	ZINC000003883140	210496906	/nfs/dbraw/zinc/49/69/06/210496906.db2.gz	XYHSYEXRCKCHNN-CYBMUJFWSA-N	-1	0	359.325	2.810	50	0		FFAARM
CCCc1cc2c(nc(C)n([N-]C(=O)c3cnn(CC)c3C)c2=O)s1	ZINC000002782465	210421542	/nfs/dbraw/zinc/42/15/42/210421542.db2.gz	OJTIUMYBWKDXBX-UHFFFAOYSA-N	-1	0	359.455	2.628	50	0		FFAARM
CCc1cccc(C)c1NC(=O)c1sc2[nH]c(=O)c(C(=O)[O-])cc2c1N	ZINC000002694768	210415662	/nfs/dbraw/zinc/41/56/62/210415662.db2.gz	KOUHAMISLWQLSV-UHFFFAOYSA-N	-1	0	371.418	2.993	50	0		FFAARM
O=C([O-])COc1ccc(S(=O)(=O)N2CCc3ccccc32)cc1Cl	ZINC000002879395	210433176	/nfs/dbraw/zinc/43/31/76/210433176.db2.gz	ULVCBZACPCXZHO-UHFFFAOYSA-N	-1	0	367.810	2.555	50	0		FFAARM
O=C([O-])[C@@H](Cc1c[nH]c2ccccc12)NC(=S)NCc1ccccc1	ZINC000002291743	210388145	/nfs/dbraw/zinc/38/81/45/210388145.db2.gz	MBHQACQXPLFDIS-QGZVFWFLSA-N	-1	0	353.447	2.828	50	0		FFAARM
COC(=O)c1nc[n-]c1C(=O)Nc1ccc(C)cc1C(=O)c1ccccc1	ZINC000001471190	210355858	/nfs/dbraw/zinc/35/58/58/210355858.db2.gz	POJSJDDPFDUHIT-UHFFFAOYSA-N	-1	0	363.373	2.988	50	0		FFAARM
O=C([O-])[C@@H]1CCCN1S(=O)(=O)c1cc(Cl)c(Cl)cc1Cl	ZINC000001393186	210348191	/nfs/dbraw/zinc/34/81/91/210348191.db2.gz	WAAHPRDFNUTCLD-VIFPVBQESA-N	-1	0	358.630	2.885	50	0		FFAARM
Cc1ccc(-n2ncc3c2ncn([N-]C(=O)c2cccs2)c3=O)cc1C	ZINC000010252168	210344518	/nfs/dbraw/zinc/34/45/18/210344518.db2.gz	YZJJNLVQMIEVAK-UHFFFAOYSA-N	-1	0	365.418	2.644	50	0		FFAARM
CCOc1ccccc1[N-]S(=O)(=O)c1cc(Br)cnc1N	ZINC000020467658	220327710	/nfs/dbraw/zinc/32/77/10/220327710.db2.gz	DHZZUMIKJWHWMR-UHFFFAOYSA-N	-1	0	372.244	2.626	50	0		FFAARM
CCOc1ccc([N-]S(=O)(=O)c2cc(Br)cnc2N)cc1	ZINC000020467592	220328418	/nfs/dbraw/zinc/32/84/18/220328418.db2.gz	MZNCHIKPXUNUIQ-UHFFFAOYSA-N	-1	0	372.244	2.626	50	0		FFAARM
CS(=O)(=O)c1ccc(F)c(NC(=O)CC2(CC(=O)[O-])CCCCC2)c1	ZINC000029010448	220591232	/nfs/dbraw/zinc/59/12/32/220591232.db2.gz	NASTZBYJBRHVSS-UHFFFAOYSA-N	-1	0	371.430	2.983	50	0		FFAARM
O=C([O-])[C@H]1CCN(S(=O)(=O)c2c(Cl)cc(Cl)cc2Cl)C1	ZINC000062132684	221138948	/nfs/dbraw/zinc/13/89/48/221138948.db2.gz	FFFLGSWXBBTUKY-LURJTMIESA-N	-1	0	358.630	2.742	50	0		FFAARM
CCc1nn2c(nc(C)c2S(=O)(=O)[N-]c2ccc(F)cc2C)s1	ZINC000065183778	221175512	/nfs/dbraw/zinc/17/55/12/221175512.db2.gz	VDTWMNNPYUNJSN-UHFFFAOYSA-N	-1	0	354.432	2.910	50	0		FFAARM
Cc1ccc([N-]S(=O)(=O)c2cc(-c3ccc(=O)[nH]n3)cs2)cc1F	ZINC000065119381	221170936	/nfs/dbraw/zinc/17/09/36/221170936.db2.gz	XEWAFWDJWDNEJO-UHFFFAOYSA-N	-1	0	365.411	2.747	50	0		FFAARM
O=C([O-])CSc1nnc(-c2cc[nH]n2)n1-c1ccccc1C(F)(F)F	ZINC000067713026	221275088	/nfs/dbraw/zinc/27/50/88/221275088.db2.gz	SBRRHRYNNUQZMY-UHFFFAOYSA-N	-1	0	369.328	2.853	50	0		FFAARM
O=C([O-])c1n[nH]cc1CN1CCc2nc[nH]c2[C@H]1c1ccnc2ccccc21	ZINC000067868040	221296850	/nfs/dbraw/zinc/29/68/50/221296850.db2.gz	IFSPNSGEQKHYAF-LJQANCHMSA-N	-1	0	374.404	2.527	50	0		FFAARM
COCc1c(C)onc1C(=O)N1CCC[C@@H](Cc2ccc(C(=O)[O-])cc2)C1	ZINC000072169568	221446283	/nfs/dbraw/zinc/44/62/83/221446283.db2.gz	PXZKKBAUGJEGBC-HNNXBMFYSA-N	-1	0	372.421	2.923	50	0		FFAARM
CC(NCc1cccc(C)c1)=C1C(=O)[N-]C(=O)N(c2ccc(C)cc2)C1=O	ZINC000005884648	533417914	/nfs/dbraw/zinc/41/79/14/533417914.db2.gz	LTETZTXSEOTLFE-OBGWFSINSA-N	-1	0	363.417	2.950	50	0		FFAARM
COCCC[C@H]1CCCN(c2nccc(-c3cc(C(=O)[O-])ccn3)n2)C1	ZINC000077380032	132182676	/nfs/dbraw/zinc/18/26/76/132182676.db2.gz	JHIRBRASBRXLEL-CQSZACIVSA-N	-1	0	356.426	2.880	50	0		FFAARM
O=C([O-])c1cccc(N2CCC[C@H](c3nccn3Cc3cccnc3)C2)n1	ZINC000091444864	132201888	/nfs/dbraw/zinc/20/18/88/132201888.db2.gz	JUMMFUHWWHWNAY-INIZCTEOSA-N	-1	0	363.421	2.804	50	0		FFAARM
O=C([O-])c1ccc(N2CCC[C@H](c3nccn3Cc3ccncc3)C2)nc1	ZINC000091877191	132204480	/nfs/dbraw/zinc/20/44/80/132204480.db2.gz	MQVCMDZZVUSEFR-KRWDZBQOSA-N	-1	0	363.421	2.804	50	0		FFAARM
CCN(CC)S(=O)(=O)c1ccc(N2CCC(C)CC2)c(C(=O)[O-])c1	ZINC000003888809	132385883	/nfs/dbraw/zinc/38/58/83/132385883.db2.gz	ONVBYGSYSFIRRP-UHFFFAOYSA-N	-1	0	354.472	2.652	50	0		FFAARM
Cc1cc(O)c(C(=O)[O-])cc1S(=O)(=O)N1CCCc2cccc(F)c21	ZINC000031668188	132923035	/nfs/dbraw/zinc/92/30/35/132923035.db2.gz	YDIHUDKUXNYRHF-UHFFFAOYSA-N	-1	0	365.382	2.679	50	0		FFAARM
Cc1ccc(OC2(C(=O)[O-])CCN(C(=O)c3cccc(F)c3)CC2)cn1	ZINC000072447152	221532649	/nfs/dbraw/zinc/53/26/49/221532649.db2.gz	NSGREQRPCNBJKC-UHFFFAOYSA-N	-1	0	358.369	2.668	50	0		FFAARM
O=C([O-])C1(n2ccc(-c3ccco3)n2)CCN(C(=O)c2ccccc2)CC1	ZINC000072454179	221536357	/nfs/dbraw/zinc/53/63/57/221536357.db2.gz	DYYOJQIDQDYOHO-UHFFFAOYSA-N	-1	0	365.389	2.859	50	0		FFAARM
CCn1nc(C)c(CCNc2nccc(-c3cc(C(=O)[O-])ccn3)n2)c1C	ZINC000077517770	221639721	/nfs/dbraw/zinc/63/97/21/221639721.db2.gz	CFXXXKGNURFABM-UHFFFAOYSA-N	-1	0	366.425	2.725	50	0		FFAARM
CC[C@@H]1COCCN1Cc1cc(-c2ccccn2)ccc1OCC(=O)[O-]	ZINC000097259205	222172150	/nfs/dbraw/zinc/17/21/50/222172150.db2.gz	HSWSXIPDETXXJF-QGZVFWFLSA-N	-1	0	356.422	2.823	50	0		FFAARM
COC(=O)Cc1[n-]n(-c2ccccc2)c(=O)c1[C@H]1OC(=O)c2ccccc21	ZINC000100430198	222244480	/nfs/dbraw/zinc/24/44/80/222244480.db2.gz	TYNGMHBUXNCNTA-SFHVURJKSA-N	-1	0	364.357	2.553	50	0		FFAARM
CCn1c(=O)c2ccc(C(=O)NCc3cccc(OC)c3)cc2[n-]c1=S	ZINC000102171023	222291460	/nfs/dbraw/zinc/29/14/60/222291460.db2.gz	JRFMHFVLLJKVNE-UHFFFAOYSA-N	-1	0	369.446	2.644	50	0		FFAARM
O=C([O-])c1cccc(N2C(=O)C[C@H](Nc3ccc4c(c3)CCC4)C2=O)c1	ZINC000102616075	222302590	/nfs/dbraw/zinc/30/25/90/222302590.db2.gz	BMLITWBJMJIBFP-KRWDZBQOSA-N	-1	0	350.374	2.618	50	0		FFAARM
O=C(c1ccc2[n-]c(=S)oc2c1)N1CCOC[C@@H]1C[C@@H](O)c1ccco1	ZINC000159015009	222553512	/nfs/dbraw/zinc/55/35/12/222553512.db2.gz	BQPDQORTTGIUFX-GXTWGEPZSA-N	-1	0	374.418	2.674	50	0		FFAARM
CSc1ccc(NC(=O)Nc2ccc(C(=O)NCC(=O)[O-])cc2)cc1	ZINC000000641146	506226541	/nfs/dbraw/zinc/22/65/41/506226541.db2.gz	WYKRUWRRBUBZQT-UHFFFAOYSA-N	-1	0	359.407	2.867	50	0		FFAARM
Cc1ccc2[nH]cc([C@@H](C(=O)[O-])N3CCN(C(=O)c4ccco4)CC3)c2c1	ZINC000032096938	506229957	/nfs/dbraw/zinc/22/99/57/506229957.db2.gz	XBYRDXWPYAAHQI-SFHVURJKSA-N	-1	0	367.405	2.653	50	0		FFAARM
COc1ccc([C@H](C)NC(=O)c2c(=O)[nH]c3ccsc3c2[O-])cc1OC	ZINC000065215589	506269419	/nfs/dbraw/zinc/26/94/19/506269419.db2.gz	AWMXKTDTNPCQGZ-VIFPVBQESA-N	-1	0	374.418	2.803	50	0		FFAARM
O=C([O-])c1csc(S(=O)(=O)N2CCCc3c(F)cc(F)cc32)c1	ZINC000032598188	506270187	/nfs/dbraw/zinc/27/01/87/506270187.db2.gz	CNZIHUDHNBFNIQ-UHFFFAOYSA-N	-1	0	359.375	2.866	50	0		FFAARM
CC[C@H](NC(=O)Cc1c(C)c2cc3c(C)c(C)oc3cc2oc1=O)C(=O)[O-]	ZINC000002104682	506272742	/nfs/dbraw/zinc/27/27/42/506272742.db2.gz	SONBMQRJGQMLFS-HNNXBMFYSA-N	-1	0	371.389	2.986	50	0	biogenic	FFAARM
Cc1ccc(C(=O)Nc2ccc(S(=O)(=O)[N-]c3ncccn3)cc2)cc1	ZINC000002748332	506289241	/nfs/dbraw/zinc/28/92/41/506289241.db2.gz	RPHYRTXSYICSIZ-UHFFFAOYSA-N	-1	0	368.418	2.838	50	0		FFAARM
COc1ccc(Br)cc1[C@H]1SC[C@H](C(=O)[O-])N1C(C)=O	ZINC000002763438	506290032	/nfs/dbraw/zinc/29/00/32/506290032.db2.gz	UZGPXPRWSYHLDM-ZYHUDNBSSA-N	-1	0	360.229	2.505	50	0		FFAARM
CCn1ncc([N-]S(=O)(=O)c2ccc3ccccc3c2)c1C(=O)N(C)C	ZINC000002804909	506294200	/nfs/dbraw/zinc/29/42/00/506294200.db2.gz	CHFOBGWTYYZSAL-UHFFFAOYSA-N	-1	0	372.450	2.559	50	0		FFAARM
O=C(c1ccc2c(c1)[n-]c(=S)n(Cc1ccccc1)c2=O)N1CCCC1	ZINC000003630001	506348298	/nfs/dbraw/zinc/34/82/98/506348298.db2.gz	FFFHGGYOXGSGFK-UHFFFAOYSA-N	-1	0	365.458	2.970	50	0		FFAARM
O=C([O-])[C@@H]1CCCC[C@H]1C(=O)NCCc1csc(-c2cccnc2)n1	ZINC000004167054	506364391	/nfs/dbraw/zinc/36/43/91/506364391.db2.gz	IFNJJJMFBFRHGX-HUUCEWRRSA-N	-1	0	359.451	2.755	50	0		FFAARM
COc1ccc(Cc2n[n-]c(Nc3ccc(C)cc3)nc2=O)cc1OC	ZINC000034215880	506366115	/nfs/dbraw/zinc/36/61/15/506366115.db2.gz	FKGBSCIXQNEDQQ-UHFFFAOYSA-N	-1	0	352.394	2.825	50	0		FFAARM
O=C(CCc1nnc(-c2cccs2)[n-]c1=O)NCCc1ccccc1	ZINC000034768076	506370715	/nfs/dbraw/zinc/37/07/15/506370715.db2.gz	UCFCSWRQDZIGLB-UHFFFAOYSA-N	-1	0	354.435	2.597	50	0		FFAARM
O=C(CSC1=Nc2ccc(F)cc2S(=O)(=O)[N-]1)c1ccccc1	ZINC000004853707	506398822	/nfs/dbraw/zinc/39/88/22/506398822.db2.gz	XFGRFLUIFDTRHW-UHFFFAOYSA-N	-1	0	350.396	2.912	50	0		FFAARM
O=C([O-])CCNC(=O)Cn1ccc2cc(OCc3ccccc3)ccc21	ZINC000036357685	506401589	/nfs/dbraw/zinc/40/15/89/506401589.db2.gz	WTJQKSYIGKJTHB-UHFFFAOYSA-N	-1	0	352.390	2.811	50	0		FFAARM
COc1ccc(-n2nnc(C(=O)Nc3ccc(C(=O)[O-])cc3)c2C)cc1	ZINC000004938501	506407570	/nfs/dbraw/zinc/40/75/70/506407570.db2.gz	HLQDUGJCIPYZJF-UHFFFAOYSA-N	-1	0	352.350	2.535	50	0		FFAARM
O=C(CSc1nnc(-c2ccccc2)c(=O)[n-]1)Nc1ccccc1F	ZINC000005626419	506451263	/nfs/dbraw/zinc/45/12/63/506451263.db2.gz	DXIUXZINFSOOSU-UHFFFAOYSA-N	-1	0	356.382	2.702	50	0		FFAARM
COc1ccc([C@H](CC(=O)N2CCCCC2)[N-]C(=O)C(F)(F)F)cc1	ZINC000005675940	506452423	/nfs/dbraw/zinc/45/24/23/506452423.db2.gz	HIEYOBWPKDNUNH-AWEZNQCLSA-N	-1	0	358.360	2.817	50	0		FFAARM
CC(C)[C@H](NC(=O)Cn1ccc2c1cccc2Br)C(=O)[O-]	ZINC000040309157	506481939	/nfs/dbraw/zinc/48/19/39/506481939.db2.gz	AQNNILJCLSBCEE-AWEZNQCLSA-N	-1	0	353.216	2.629	50	0	biogenic	FFAARM
CCCCNC(=O)Nc1ccc(S(=O)(=O)[N-]c2nccs2)cc1	ZINC000006623362	506492781	/nfs/dbraw/zinc/49/27/81/506492781.db2.gz	SAYTVOPWMGOKTJ-UHFFFAOYSA-N	-1	0	354.457	2.866	50	0		FFAARM
Cc1nc2sccn2c(=O)c1S(=O)(=O)[N-]c1cccc(Cl)c1C	ZINC000006822967	506510310	/nfs/dbraw/zinc/51/03/10/506510310.db2.gz	QPOYIVIGLQYMMH-UHFFFAOYSA-N	-1	0	369.855	2.827	50	0		FFAARM
COc1ccc(C)cc1S(=O)(=O)[N-]c1ccc2c(c1)NC(=O)[C@@H](C)O2	ZINC000007729420	506586430	/nfs/dbraw/zinc/58/64/30/506586430.db2.gz	CWFNTABHASKTEL-LLVKDONJSA-N	-1	0	362.407	2.524	50	0		FFAARM
O=C([O-])c1ccccc1SCC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000007813650	506593339	/nfs/dbraw/zinc/59/33/39/506593339.db2.gz	XANHSEUIUKQTDP-UHFFFAOYSA-N	-1	0	370.474	2.821	50	0		FFAARM
Cn1nc(C(=O)Nc2cc(C(=O)[O-])ccc2Cl)c2ccccc2c1=O	ZINC000008266984	506637503	/nfs/dbraw/zinc/63/75/03/506637503.db2.gz	IQASYUZTIVVRIP-UHFFFAOYSA-N	-1	0	357.753	2.537	50	0		FFAARM
CCC(=O)N[C@@]([N-]c1nc2ccccc2s1)(C(=O)OC)C(F)(F)F	ZINC000008974219	506676148	/nfs/dbraw/zinc/67/61/48/506676148.db2.gz	RQEZNZNSCMKVAD-CYBMUJFWSA-N	-1	0	361.345	2.666	50	0		FFAARM
O=c1nc(CSc2nncn2-c2ccccc2F)[n-]c2ccsc21	ZINC000009156208	506685989	/nfs/dbraw/zinc/68/59/89/506685989.db2.gz	RATRNQQYLCWFGK-UHFFFAOYSA-N	-1	0	359.411	2.997	50	0		FFAARM
CCc1c(C)sc2[nH]c(CC(=O)Nc3ccc(C(=O)[O-])cc3)nc(=O)c12	ZINC000055493358	506766156	/nfs/dbraw/zinc/76/61/56/506766156.db2.gz	BOFCVGCJIDOQHO-UHFFFAOYSA-N	-1	0	371.418	2.735	50	0		FFAARM
O=C([O-])[C@@H](Cc1ccccc1)NC=C1C(=O)CC(c2ccccc2)CC1=O	ZINC000022135416	507280501	/nfs/dbraw/zinc/28/05/01/507280501.db2.gz	XIEGZCYGJBLBSA-WHCXFUJUSA-N	-1	0	363.413	2.872	50	0		FFAARM
Cc1cnn(C2(C(=O)[O-])CCN(C(=O)c3coc4ccccc34)CC2)c1	ZINC000072421297	507787181	/nfs/dbraw/zinc/78/71/81/507787181.db2.gz	NRXNOEIKGDWKAO-UHFFFAOYSA-N	-1	0	353.378	2.654	50	0		FFAARM
O=C(Nc1ccc(CN2C(=O)CCC2=O)cc1)c1ccc([O-])c(Cl)c1	ZINC000031143404	507817617	/nfs/dbraw/zinc/81/76/17/507817617.db2.gz	VRJOAAKQRCOEAE-UHFFFAOYSA-N	-1	0	358.781	2.947	50	0		FFAARM
Nc1c(Br)cccc1-c1nc(=O)c(-c2ccc(F)cc2)n[n-]1	ZINC000089768001	507863788	/nfs/dbraw/zinc/86/37/88/507863788.db2.gz	JXNALFMGFSBMBZ-UHFFFAOYSA-N	-1	0	361.174	2.983	50	0		FFAARM
COc1cccc([C@@H]2CN(C(=O)c3cc(F)ccc3F)C[C@H]2C(=O)[O-])c1	ZINC000091474989	507988303	/nfs/dbraw/zinc/98/83/03/507988303.db2.gz	UVFDSJFBBBUBDQ-JKSUJKDBSA-N	-1	0	361.344	2.914	50	0		FFAARM
CC(=O)N(C)c1cccc(NC(=O)CC2(C(=O)[O-])Cc3ccccc3C2)c1	ZINC000075078496	508081032	/nfs/dbraw/zinc/08/10/32/508081032.db2.gz	DJSOTRXDAAIZHT-UHFFFAOYSA-N	-1	0	366.417	2.868	50	0		FFAARM
COc1cccc2c1OC[C@H](C[N-]S(=O)(=O)c1c(F)cccc1F)C2	ZINC000095357528	508175604	/nfs/dbraw/zinc/17/56/04/508175604.db2.gz	TWHLIPWNYNWLGK-NSHDSACASA-N	-1	0	369.389	2.503	50	0		FFAARM
O=C([O-])c1ccc([C@@H]2CCCN(C(=O)CCC(=O)NC3CCCC3)C2)cc1	ZINC000095361092	508176323	/nfs/dbraw/zinc/17/63/23/508176323.db2.gz	IRRFFYUGBZQKOX-QGZVFWFLSA-N	-1	0	372.465	2.930	50	0		FFAARM
CC(C)c1cc(C(=O)N(CCC(=O)[O-])Cc2cccc(F)c2F)[nH]n1	ZINC000095424797	508184997	/nfs/dbraw/zinc/18/49/97/508184997.db2.gz	WJVOGQYUAIMJDK-UHFFFAOYSA-N	-1	0	351.353	2.928	50	0		FFAARM
Cn1ccc2ccc(C(=O)N[C@@H](CCOCc3ccccc3)C(=O)[O-])cc21	ZINC000095505094	508192085	/nfs/dbraw/zinc/19/20/85/508192085.db2.gz	NZOQKBYAADFLFS-SFHVURJKSA-N	-1	0	366.417	2.968	50	0		FFAARM
CCCn1cc(C(=O)N[C@H](C(=O)[O-])c2ccc(F)c(Cl)c2)c(C)n1	ZINC000095526675	508195763	/nfs/dbraw/zinc/19/57/63/508195763.db2.gz	BTDGMBMXKOGAIV-AWEZNQCLSA-N	-1	0	353.781	2.950	50	0		FFAARM
CC(C)Cc1cc(C(=O)N2CCc3ccccc3[C@@H]2CC(=O)[O-])n(C)n1	ZINC000095524910	508195798	/nfs/dbraw/zinc/19/57/98/508195798.db2.gz	UFINCDDGMYFHCK-KRWDZBQOSA-N	-1	0	355.438	2.833	50	0		FFAARM
COc1ccc(C)nc1NC(=O)c1nn(-c2ccc(F)cc2C)cc1[O-]	ZINC000081840288	508215934	/nfs/dbraw/zinc/21/59/34/508215934.db2.gz	FUMUETFUSQEGHC-UHFFFAOYSA-N	-1	0	356.357	2.990	50	0		FFAARM
O=C(N[C@H]1CCO[C@@]2(CCSC2)C1)c1ccc2[n-]c(=S)oc2c1	ZINC000157438703	508566146	/nfs/dbraw/zinc/56/61/46/508566146.db2.gz	ZNWKKRSHXMEFKM-ZBEGNZNMSA-N	-1	0	350.465	2.901	50	0		FFAARM
COc1ccc2nc(C3CC3)cc(C(=O)N(C)C[C@H](C)c3nnn[n-]3)c2c1	ZINC000124244758	508803203	/nfs/dbraw/zinc/80/32/03/508803203.db2.gz	VBZRJHOPKHLIKY-NSHDSACASA-N	-1	0	366.425	2.510	50	0		FFAARM
CC(=O)N[C@H](CC(=O)N1CCCC[C@@H]1CCC(=O)[O-])c1ccc(C)cc1	ZINC000236716898	509489642	/nfs/dbraw/zinc/48/96/42/509489642.db2.gz	OLKCOEHOGZWTKF-QZTJIDSGSA-N	-1	0	360.454	2.808	50	0		FFAARM
CCOc1ccc(-c2nc(CC(=O)N3CCC[C@H]3C(=O)[O-])cs2)cc1	ZINC000236869559	509520104	/nfs/dbraw/zinc/52/01/04/509520104.db2.gz	LIIVBWVPBKELKX-HNNXBMFYSA-N	-1	0	360.435	2.827	50	0		FFAARM
CC[C@H](C(=O)N1CCO[C@H](CC(=O)[O-])C1)c1cccc(C(F)(F)F)c1	ZINC000237074036	509565604	/nfs/dbraw/zinc/56/56/04/509565604.db2.gz	ARHMVXVMXOGXJD-KGLIPLIRSA-N	-1	0	359.344	2.901	50	0		FFAARM
COc1ccc(-n2ccc(C(=O)N3CCCC[C@H]3CCC(=O)[O-])n2)cc1	ZINC000237510968	509665252	/nfs/dbraw/zinc/66/52/52/509665252.db2.gz	JLYBRLYIGVKDOY-AWEZNQCLSA-N	-1	0	357.410	2.740	50	0		FFAARM
C[C@@]1(C(=O)[O-])CCN(C(=O)C2(c3cccc(Cl)c3)CCOCC2)C1	ZINC000237642577	509700181	/nfs/dbraw/zinc/70/01/81/509700181.db2.gz	KGLRZKDKZLXMLY-QGZVFWFLSA-N	-1	0	351.830	2.711	50	0		FFAARM
Cc1nc(-c2ccc3c(c2)CCN3C(=O)CN2CCC[C@H]2C(=O)[O-])cs1	ZINC000237696876	509713206	/nfs/dbraw/zinc/71/32/06/509713206.db2.gz	GNBNWSLPRQTNTO-KRWDZBQOSA-N	-1	0	371.462	2.557	50	0		FFAARM
C[C@]1(C(=O)[O-])CCN(C(=O)CCc2ccc(Br)cc2F)C1	ZINC000237776858	509731639	/nfs/dbraw/zinc/73/16/39/509731639.db2.gz	CFACHWHDQSMIBB-HNNXBMFYSA-N	-1	0	358.207	2.844	50	0		FFAARM
Cc1nn(Cc2ccc(C)cc2)c(C)c1CCC(=O)N1CC[C@H](C(=O)[O-])C1	ZINC000237851820	509754217	/nfs/dbraw/zinc/75/42/17/509754217.db2.gz	SASKYXWQNVDWJZ-SFHVURJKSA-N	-1	0	369.465	2.722	50	0		FFAARM
O=C([O-])C1(CC(=O)N[C@@H]2CCN(c3ncccc3F)C2)CCCCCC1	ZINC000237914452	509772631	/nfs/dbraw/zinc/77/26/31/509772631.db2.gz	SHOAPUFNTIAQPG-CQSZACIVSA-N	-1	0	363.433	2.731	50	0		FFAARM
O=C([O-])COc1cccc(CNC(=O)[C@@H]2C[C@H]2c2c(F)cccc2F)c1	ZINC000238019657	509802124	/nfs/dbraw/zinc/80/21/24/509802124.db2.gz	XEMVCXOZFZHOPJ-ZIAGYGMSSA-N	-1	0	361.344	2.848	50	0		FFAARM
O=C([O-])CCN(C(=O)[C@@H]1C[C@H]1c1ccccc1Cl)C1CCOCC1	ZINC000238069090	509813936	/nfs/dbraw/zinc/81/39/36/509813936.db2.gz	NOZDHAGARZLPEM-LSDHHAIUSA-N	-1	0	351.830	2.926	50	0		FFAARM
CC(C)n1cc([N-]S(=O)(=O)c2ccc(C(=O)N3CCCC3)cc2)cn1	ZINC000252488084	509840099	/nfs/dbraw/zinc/84/00/99/509840099.db2.gz	IIZQJOVSVBTAMS-UHFFFAOYSA-N	-1	0	362.455	2.501	50	0		FFAARM
CN(C(=O)c1ccc2c(c1)[n-]c(=S)[nH]c2=O)[C@@H]1[C@H]2CCO[C@H]2C1(C)C	ZINC000253534975	509886129	/nfs/dbraw/zinc/88/61/29/509886129.db2.gz	OMNZWFIPKBSAKB-MRVWCRGKSA-N	-1	0	359.451	2.510	50	0		FFAARM
CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)NC[C@H](CC(C)C)C(=O)[O-]	ZINC000262424439	510274991	/nfs/dbraw/zinc/27/49/91/510274991.db2.gz	DBVDQDGGHLUWHK-WMZOPIPTSA-N	-1	0	358.438	2.814	50	0		FFAARM
COc1cccc(Nc2ccccc2C(=O)N2CCO[C@H](CC(=O)[O-])C2)c1	ZINC000262692858	510372472	/nfs/dbraw/zinc/37/24/72/510372472.db2.gz	AKYSHCPCISWHCO-MRXNPFEDSA-N	-1	0	370.405	2.755	50	0		FFAARM
O=C([O-])COc1cccc(C(=O)N[C@H]2CCO[C@H](c3ccccc3)C2)c1	ZINC000262850795	510439295	/nfs/dbraw/zinc/43/92/95/510439295.db2.gz	WWLUVJMSSZXYFW-WMZOPIPTSA-N	-1	0	355.390	2.800	50	0		FFAARM
O=C([O-])C[C@@H]1CCCN1C(=O)c1ccc(CNC(=O)C2CCCC2)cc1	ZINC000262849258	510439862	/nfs/dbraw/zinc/43/98/62/510439862.db2.gz	CYFYECTWJGTZLP-KRWDZBQOSA-N	-1	0	358.438	2.572	50	0		FFAARM
Cc1noc(C)c1COc1ccc(CC(=O)N2CCCC[C@H]2C(=O)[O-])cc1	ZINC000181499080	510440825	/nfs/dbraw/zinc/44/08/25/510440825.db2.gz	ZVDUNQPSUOUPEG-SFHVURJKSA-N	-1	0	372.421	2.879	50	0		FFAARM
O=C([O-])[C@H](CNC(=O)c1ccc2c(c1)OCCCO2)c1ccc(F)cc1	ZINC000262963324	510497768	/nfs/dbraw/zinc/49/77/68/510497768.db2.gz	RXKZYOUGVVJVLL-OAHLLOKOSA-N	-1	0	359.353	2.585	50	0		FFAARM
Cc1cc2ncc(C(=O)N[C@H](C(=O)[O-])c3cccc(C)c3C)c(C)n2n1	ZINC000263148756	510586018	/nfs/dbraw/zinc/58/60/18/510586018.db2.gz	URDLAGVMLDEFCG-KRWDZBQOSA-N	-1	0	352.394	2.519	50	0		FFAARM
Cc1ccc(Cl)c(O[C@H](C)C(=O)N(CC(=O)[O-])C2CCOCC2)c1	ZINC000299752684	511668179	/nfs/dbraw/zinc/66/81/79/511668179.db2.gz	VATKGQRQTIBATM-GFCCVEGCSA-N	-1	0	355.818	2.508	50	0		FFAARM
COc1cc2c(cc1OC)[C@H](CC(=O)[O-])N(C(=O)[C@H]1CC=CCC1)CC2	ZINC000299741843	511668904	/nfs/dbraw/zinc/66/89/04/511668904.db2.gz	GMYDEYVOPCBYEE-BBRMVZONSA-N	-1	0	359.422	2.961	50	0		FFAARM
Cc1oc(CN(C)C(=O)c2cc(N3CCCC3=O)ccc2F)cc1C(=O)[O-]	ZINC000299747370	511669043	/nfs/dbraw/zinc/66/90/43/511669043.db2.gz	CWFDWBUGUDSYCO-UHFFFAOYSA-N	-1	0	374.368	2.824	50	0		FFAARM
O=C([O-])[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)Cc1cc2ccccc2[nH]c1=O	ZINC000299753760	511669134	/nfs/dbraw/zinc/66/91/34/511669134.db2.gz	ZFUMTDNEOZKCTF-XYPHTWIQSA-N	-1	0	354.406	2.727	50	0		FFAARM
COCCc1ccccc1NS(=O)(=O)c1cc(C(=O)[O-])sc1C	ZINC000322653480	511825624	/nfs/dbraw/zinc/82/56/24/511825624.db2.gz	AQBBOCLODMZDNM-UHFFFAOYSA-N	-1	0	355.437	2.744	50	0		FFAARM
Cc1ccc(S[C@@H](C)C(=O)NCCc2nc(C(=O)[O-])cs2)cc1	ZINC000455887235	514813507	/nfs/dbraw/zinc/81/35/07/514813507.db2.gz	HZVZOCWNJNNZRN-NSHDSACASA-N	-1	0	350.465	2.989	50	0		FFAARM
C[C@H](NC(=O)N1CCC[C@@H]1C(=O)[O-])c1ccc(OCC(F)(F)F)cc1	ZINC000555848204	517152792	/nfs/dbraw/zinc/15/27/92/517152792.db2.gz	FJHXADZNHNELGQ-GXFFZTMASA-N	-1	0	360.332	2.947	50	0		FFAARM
COc1ccc(C(=O)[O-])nc1-c1cccc(C(=O)N2C[C@@H](C)O[C@@H](C)C2)c1	ZINC000584886440	518522267	/nfs/dbraw/zinc/52/22/67/518522267.db2.gz	HVNBZLHFGRYHCP-BETUJISGSA-N	-1	0	370.405	2.705	50	0		FFAARM
COC(=O)C[C@H](NC(=O)[C@@H]1CCCC[C@H]1C(=O)[O-])c1cc(C)ccc1C	ZINC000239222092	523334836	/nfs/dbraw/zinc/33/48/36/523334836.db2.gz	UIZSNGWYNLFTHM-INMHGKMJSA-N	-1	0	361.438	2.915	50	0		FFAARM
O=C([O-])[C@@H]1C[C@@H]1C(=O)NCC1(c2cccc(C(F)(F)F)c2)CCOCC1	ZINC000268921640	526289050	/nfs/dbraw/zinc/28/90/50/526289050.db2.gz	SUXJCUQIGAYGPQ-UONOGXRCSA-N	-1	0	371.355	2.591	50	0		FFAARM
O=C(NCC1CCCC1)c1ccc(S(=O)(=O)[N-]c2nccs2)cc1	ZINC000084388035	527605257	/nfs/dbraw/zinc/60/52/57/527605257.db2.gz	ZKISVOFLHRJZJN-UHFFFAOYSA-N	-1	0	365.480	2.864	50	0		FFAARM
CCOc1ccc(S(=O)(=O)N2CCCc3ccccc32)cc1C(=O)[O-]	ZINC000072278046	535389603	/nfs/dbraw/zinc/38/96/03/535389603.db2.gz	FPTYNYMIBVOLBA-UHFFFAOYSA-N	-1	0	361.419	2.925	50	0		FFAARM
Cc1cc(C(=O)N2[C@@H]3CCCC[C@H]3C[C@H]2C(=O)[O-])ccc1N1CCOCC1	ZINC000647730865	568065792	/nfs/dbraw/zinc/06/57/92/568065792.db2.gz	ZMNZYPNDXHRJEM-IPELMVKDSA-N	-1	0	372.465	2.690	50	0		FFAARM
Cn1c(=O)c2ccc(C(=O)N[C@@H]3CCCc4occc43)cc2[n-]c1=S	ZINC000102181461	570828196	/nfs/dbraw/zinc/82/81/96/570828196.db2.gz	HYBFHQHFTIKTNB-CYBMUJFWSA-N	-1	0	355.419	2.623	50	0		FFAARM
COCC(=O)Nc1ccc(NC(=O)C[C@@](C)(C(=O)[O-])c2ccccc2)cc1	ZINC000044830711	570899491	/nfs/dbraw/zinc/89/94/91/570899491.db2.gz	AGYURIGGSXDADF-HXUWFJFHSA-N	-1	0	370.405	2.643	50	0		FFAARM
COCCn1nc(C)c(CNC(=O)c2ccc3[n-]c(=S)oc3c2)c1C	ZINC000118780369	571177152	/nfs/dbraw/zinc/17/71/52/571177152.db2.gz	BMEFBKPYNNDHNO-UHFFFAOYSA-N	-1	0	360.439	2.506	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)c2scc3c2CCCC3)C[C@H]1c1cccnc1	ZINC000091269812	571192836	/nfs/dbraw/zinc/19/28/36/571192836.db2.gz	YOGJMCDFRKULRJ-JKSUJKDBSA-N	-1	0	356.447	2.962	50	0		FFAARM
CCCC[C@@H]1Oc2ccc(S(=O)(=O)[N-]c3nccs3)cc2NC1=O	ZINC000252479525	571279914	/nfs/dbraw/zinc/27/99/14/571279914.db2.gz	BHBNAAVDJODLEH-ZDUSSCGKSA-N	-1	0	367.452	2.834	50	0		FFAARM
C[C@@H](C(=O)[O-])[C@H](NC(=O)CN1C(=O)CCc2ccccc21)c1ccccc1	ZINC000262539602	601172321	/nfs/dbraw/zinc/17/23/21/601172321.db2.gz	RAEMYMUTEXOFLF-VLIAUNLRSA-N	-1	0	366.417	2.544	50	0		FFAARM
O=C([O-])[C@@H]1c2ccccc2CCN1C(=O)c1ccc2c(c1)CCCC(=O)N2	ZINC000663145269	601492222	/nfs/dbraw/zinc/49/22/22/601492222.db2.gz	WRGHATDUVQZLEM-IBGZPJMESA-N	-1	0	364.401	2.786	50	0		FFAARM
C[C@@H]1OCCC[C@@H]1C(=O)N[C@H](C(=O)[O-])c1ccccc1Br	ZINC000668295081	733103913	/nfs/dbraw/zinc/10/39/13/733103913.db2.gz	IZLRQVOKBAXQRC-KWBADKCTSA-N	-1	0	356.216	2.506	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)Nc2ccc(-c3ccc(Cl)s3)nc2)CCO1	ZINC000669505858	733239168	/nfs/dbraw/zinc/23/91/68/733239168.db2.gz	LSLCSKMACVDSOT-NSHDSACASA-N	-1	0	367.814	2.781	50	0		FFAARM
C[C@H](C(=O)[O-])c1cccc(NC(=O)[C@@H]2CCCN(C(=O)N3CCCC3)C2)c1	ZINC000263178031	980536188	/nfs/dbraw/zinc/53/61/88/980536188.db2.gz	GYHNTFUXXOKUTB-GOEBONIOSA-N	-1	0	373.453	2.741	50	0		FFAARM
Cc1ccc(CC(=O)N[C@@H]2COCC[C@H]2Oc2ccc(C(=O)[O-])cc2)cc1	ZINC000217986094	1007047852	/nfs/dbraw/zinc/04/78/52/1007047852.db2.gz	XPABKKFUSNKOCV-RTBURBONSA-N	-1	0	369.417	2.588	50	0		FFAARM
CCOC(=O)c1ccc(NC(=O)c2c([O-])c3ccccc3n(C)c2=O)cc1	ZINC000004399696	1012394668	/nfs/dbraw/zinc/39/46/68/1012394668.db2.gz	KRVGPHNEPPTNSV-UHFFFAOYSA-N	-1	0	366.373	2.673	50	0		FFAARM
CC(Nc1ccc(F)cc1)=C1C(=O)[N-]C(=O)N(Cc2ccccc2)C1=O	ZINC000017029275	1022350464	/nfs/dbraw/zinc/35/04/64/1022350464.db2.gz	BNSSSWAUBGXNGE-FOWTUZBSSA-N	-1	0	353.353	2.790	50	0		FFAARM
CO[C@@](C)(C(=O)[O-])C(=O)NC[C@H]1CC2c3ccccc3C1c1ccccc12	ZINC000656848921	1025458367	/nfs/dbraw/zinc/45/83/67/1025458367.db2.gz	RPOHUWCQPYQPOV-GJDDIWRISA-N	-1	0	365.429	2.890	50	0		FFAARM
O=C([O-])C1(C(=O)Nc2ccc(CN3CCOCC3)cc2)CCCCCC1	ZINC000663080370	1026587472	/nfs/dbraw/zinc/58/74/72/1026587472.db2.gz	VAFROIUFPQHYLD-UHFFFAOYSA-N	-1	0	360.454	2.883	50	0		FFAARM
Cc1cccc(SC2CCN(C(=O)Cc3cc(=O)[nH][n-]c3=O)CC2)c1	ZINC001506410329	1059500446	/nfs/dbraw/zinc/50/04/46/1059500446.db2.gz	KGBULPTXUAQBSL-UHFFFAOYSA-N	-1	0	359.451	2.522	50	0		FFAARM
CC1CCN(S(=O)(=O)c2cc(C(=O)[O-])ccc2Br)CC1	ZINC000000753261	210268174	/nfs/dbraw/zinc/26/81/74/210268174.db2.gz	DRTSGVATIBBFEV-UHFFFAOYSA-N	-1	0	362.245	2.568	50	0		FFAARM
COc1ccc([C@@H]2N[C@@H](C(=O)[O-])Cc3c4ccccc4[nH]c32)c(OC)c1	ZINC000000754341	210267264	/nfs/dbraw/zinc/26/72/64/210267264.db2.gz	TWSTVZBEFBQGQE-AEFFLSMTSA-N	-1	0	352.390	2.873	50	0	biogenic	FFAARM
O=c1c2c3c(sc2[n-]c(=S)n1CCCN1CCOCC1)CCCC3	ZINC000017075151	210235744	/nfs/dbraw/zinc/23/57/44/210235744.db2.gz	FJUANFDZCBEGHW-UHFFFAOYSA-N	-1	0	365.524	2.722	50	0		FFAARM
C[C@@H](Oc1ccccc1Br)C(=O)N1CCC[C@@H](C(=O)[O-])C1	ZINC000136165424	210091073	/nfs/dbraw/zinc/09/10/73/210091073.db2.gz	OWPOGKFKAKTOGA-GHMZBOCLSA-N	-1	0	356.216	2.540	50	0		FFAARM
O=C([O-])[C@H]1CCCCN1C(=O)c1cccc(-n2ccc(C(F)(F)F)n2)c1	ZINC000128620059	210066863	/nfs/dbraw/zinc/06/68/63/210066863.db2.gz	LPSFJSFQQZJLSM-CYBMUJFWSA-N	-1	0	367.327	2.970	50	0		FFAARM
CC(C)(C)OC(=O)N1C[C@@H](Oc2c(F)cc(F)cc2F)C[C@H]1C(=O)[O-]	ZINC000039954187	210042383	/nfs/dbraw/zinc/04/23/83/210042383.db2.gz	NSYQCVHTVBDZLM-CABZTGNLSA-N	-1	0	361.316	2.945	50	0		FFAARM
O=C([O-])c1ccc([C@H]2CCCN(C(=O)C3(Cn4ccnc4)CC3)C2)cc1	ZINC000299772247	210019470	/nfs/dbraw/zinc/01/94/70/210019470.db2.gz	UGAAUUTUNBXIFP-KRWDZBQOSA-N	-1	0	353.422	2.768	50	0		FFAARM
COc1ccc(CCn2c(C)cc(=O)c(C(=O)[O-])c2C2CC2)cc1OC	ZINC000299768625	210017036	/nfs/dbraw/zinc/01/70/36/210017036.db2.gz	OOHPTXLSGNBPCF-UHFFFAOYSA-N	-1	0	357.406	2.992	50	0		FFAARM
O=C([O-])CC[C@@H]1CCCCN1C(=O)CC[C@H]1Cc2ccccc2NC1=O	ZINC000237923805	222910531	/nfs/dbraw/zinc/91/05/31/222910531.db2.gz	FZGRPNQENUMDAS-HOTGVXAUSA-N	-1	0	358.438	2.824	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)C[C@H]1CCCO1)c1ccc(OC(F)(F)F)cc1	ZINC000299382508	223078127	/nfs/dbraw/zinc/07/81/27/223078127.db2.gz	WVOJKUUBBCVWLX-OLZOCXBDSA-N	-1	0	361.316	2.786	50	0		FFAARM
COc1cc(NS(=O)(=O)c2ccc(C)c(C(=O)[O-])c2)cc(OC)c1	ZINC000013348977	220065237	/nfs/dbraw/zinc/06/52/37/220065237.db2.gz	IVQPBULQGSLSFZ-UHFFFAOYSA-N	-1	0	351.380	2.511	50	0		FFAARM
O=C([O-])[C@@H]1CCCN(C(=O)[C@H]2C[C@H]2c2ccc(Br)cc2)C1	ZINC000299742456	211823494	/nfs/dbraw/zinc/82/34/94/211823494.db2.gz	JGMSNNHVUQHNLC-XBFCOCLRSA-N	-1	0	352.228	2.876	50	0		FFAARM
O=C([O-])[C@@H]1COCCN1C(=O)c1ccc(Oc2ccc(F)c(F)c2)cc1	ZINC000299747487	211825471	/nfs/dbraw/zinc/82/54/71/211825471.db2.gz	DDWJTYIOFWIFJL-INIZCTEOSA-N	-1	0	363.316	2.683	50	0		FFAARM
CCSc1ncc(Cl)c(C(=O)N[C@@H](Cc2ccccc2)C(=O)[O-])n1	ZINC000041097329	211769336	/nfs/dbraw/zinc/76/93/36/211769336.db2.gz	WRIYDVMOOICWAC-LBPRGKRZSA-N	-1	0	365.842	2.668	50	0		FFAARM
CCc1ccc(N2C(=O)C[C@@H](Sc3ncccc3C(=O)[O-])C2=O)cc1	ZINC000019881511	211258733	/nfs/dbraw/zinc/25/87/33/211258733.db2.gz	RBVQGZPCFNGEKB-CQSZACIVSA-N	-1	0	356.403	2.766	50	0		FFAARM
O=C(c1cnc2c3cccnc3nn2c1)c1cc(Br)ccc1[O-]	ZINC000014157794	211078941	/nfs/dbraw/zinc/07/89/41/211078941.db2.gz	HAEJUGLMYOLLNW-UHFFFAOYSA-N	-1	0	369.178	2.977	50	0		FFAARM
Cc1c2ccccc2oc1C(=O)[N-]N1C(=O)NC2(CCC(C)CC2)C1=O	ZINC000014093775	211072414	/nfs/dbraw/zinc/07/24/14/211072414.db2.gz	OHIGPAMWZWHMDV-UHFFFAOYSA-N	-1	0	355.394	2.887	50	0		FFAARM
Cc1c(C(=O)[O-])sc2[nH]c(=O)cc(CSc3nnc4ccccn43)c12	ZINC000013416523	211031957	/nfs/dbraw/zinc/03/19/57/211031957.db2.gz	MADZJLVREWHPCP-UHFFFAOYSA-N	-1	0	372.431	2.931	50	0		FFAARM
O=C([O-])Cc1ccc(OCC(=O)NCCCSc2ccccc2)cc1	ZINC000012979968	211014090	/nfs/dbraw/zinc/01/40/90/211014090.db2.gz	XSTVEJCKNLCQQT-UHFFFAOYSA-N	-1	0	359.447	2.991	50	0		FFAARM
Cc1[n-]n(-c2nc(C(F)(F)F)cc(=O)[nH]2)c(=O)c1Cc1ccccc1	ZINC000004024776	210504601	/nfs/dbraw/zinc/50/46/01/210504601.db2.gz	BQCBWERCLSTCQQ-UHFFFAOYSA-N	-1	0	350.300	2.579	50	0		FFAARM
O=C([O-])[C@@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)c1ccccc1	ZINC000003883139	210497107	/nfs/dbraw/zinc/49/71/07/210497107.db2.gz	XYHSYEXRCKCHNN-ZDUSSCGKSA-N	-1	0	359.325	2.810	50	0		FFAARM
Cc1c(O)ccc2c(C)c(CCC(=O)N3CCCC[C@@H]3C(=O)[O-])c(=O)oc12	ZINC000002431985	210398203	/nfs/dbraw/zinc/39/82/03/210398203.db2.gz	FPKOXWRVOIQMKK-OAHLLOKOSA-N	-1	0	373.405	2.514	50	0		FFAARM
O=S(=O)([N-]c1nc2nccc(-c3ccccc3)n2n1)c1ccccc1	ZINC000002321923	210391221	/nfs/dbraw/zinc/39/12/21/210391221.db2.gz	HAXBLLLFRQOMRY-UHFFFAOYSA-N	-1	0	351.391	2.592	50	0		FFAARM
COc1ccc(NC(=O)c2c([O-])c3cccc4c3n(c2=O)CCC4)cc1	ZINC000001304984	210340630	/nfs/dbraw/zinc/34/06/30/210340630.db2.gz	RIIKSSUAHKSYEL-UHFFFAOYSA-N	-1	0	350.374	2.914	50	0		FFAARM
COc1ccc(C(=O)NC(=S)Nc2cccc(C(=O)[O-])c2)cc1OC	ZINC000001157483	210327557	/nfs/dbraw/zinc/32/75/57/210327557.db2.gz	BZWQZNJCJOVDMT-UHFFFAOYSA-N	-1	0	360.391	2.529	50	0		FFAARM
CCC1C(=O)N=C(S[C@@H](C)C(=O)Nc2cccc(Cl)c2)N=C1[O-]	ZINC000001122030	210319087	/nfs/dbraw/zinc/31/90/87/210319087.db2.gz	KXZBSEOXKDHADM-QMMMGPOBSA-N	-1	0	353.831	2.811	50	0		FFAARM
COc1cccc2cc(C(=O)Nc3ccc(CC(=O)[O-])cc3)c(=O)oc21	ZINC000001075044	210313845	/nfs/dbraw/zinc/31/38/45/210313845.db2.gz	RPDCVRGANPXWOL-UHFFFAOYSA-N	-1	0	353.330	2.681	50	0		FFAARM
CC1=C(C)C[C@H](C(=O)[O-])[C@H](C(=O)N2CCN(Cc3ccccc3)CC2)C1	ZINC000000894861	210288903	/nfs/dbraw/zinc/28/89/03/210288903.db2.gz	HQKSZMPYLDTIRF-MOPGFXCFSA-N	-1	0	356.466	2.778	50	0		FFAARM
CCc1cccc([N-]S(=O)(=O)c2cc3[nH]c(=O)[nH]c3cc2Cl)c1	ZINC000064976610	221160465	/nfs/dbraw/zinc/16/04/65/221160465.db2.gz	RHDJADBWKWVYCQ-UHFFFAOYSA-N	-1	0	351.815	2.873	50	0		FFAARM
COc1ccc(-c2c(C(=O)[O-])nnn2Cc2ccc(OC)c(F)c2)cc1	ZINC000065288283	221196510	/nfs/dbraw/zinc/19/65/10/221196510.db2.gz	JHKMUDZJQMSELT-UHFFFAOYSA-N	-1	0	357.341	2.848	50	0		FFAARM
CN(C)C(=O)c1ccc(NC(=O)[C@@H]2CC=CC[C@H]2C(=O)[O-])cc1Cl	ZINC000067456646	221254342	/nfs/dbraw/zinc/25/43/42/221254342.db2.gz	CXWODBOEGWUBHB-VXGBXAGGSA-N	-1	0	350.802	2.647	50	0		FFAARM
Cc1nn(C)cc1-c1csc(NC(=O)Cc2ccccc2C(=O)[O-])n1	ZINC000071279655	221336785	/nfs/dbraw/zinc/33/67/85/221336785.db2.gz	DRGDNZGUVXBGAL-UHFFFAOYSA-N	-1	0	356.407	2.731	50	0		FFAARM
CC(C)NC(=O)c1ccc(NC(=O)[C@@H]2[C@H](C(=O)[O-])C2(C)C)cc1Cl	ZINC000071286196	221340072	/nfs/dbraw/zinc/34/00/72/221340072.db2.gz	JHUGOOTYSSAQHB-QWHCGFSZSA-N	-1	0	352.818	2.774	50	0		FFAARM
O=C([O-])CN1c2ccc(Br)cc2-c2ccccc2S1(=O)=O	ZINC000242495110	132289479	/nfs/dbraw/zinc/28/94/79/132289479.db2.gz	FUYUZJNCIHVLAK-UHFFFAOYSA-N	-1	0	368.208	2.709	50	0		FFAARM
COc1cc(OC)cc(C2=NN(C(=O)CCC(=O)[O-])[C@H](c3ccco3)C2)c1	ZINC000095532114	221957672	/nfs/dbraw/zinc/95/76/72/221957672.db2.gz	XBOAYEDBNASBLC-INIZCTEOSA-N	-1	0	372.377	2.839	50	0		FFAARM
COC(=O)C[C@H](c1ccc(SC)cc1)c1c([O-])nc2ccccn2c1=O	ZINC000096118071	222033003	/nfs/dbraw/zinc/03/30/03/222033003.db2.gz	ZHEWSGBLHBZAEJ-CQSZACIVSA-N	-1	0	370.430	2.817	50	0		FFAARM
COc1ccc(/C=C\C(=O)[O-])cc1S(=O)(=O)N(C)c1ccc(C)cc1	ZINC000096291650	222111294	/nfs/dbraw/zinc/11/12/94/222111294.db2.gz	WYBUABDZGPPINB-XFFZJAGNSA-N	-1	0	361.419	2.927	50	0		FFAARM
O=C(Nc1ccccc1F)C1CCN(c2nc3[n-]cnc(=O)c3s2)CC1	ZINC000096331546	222115130	/nfs/dbraw/zinc/11/51/30/222115130.db2.gz	ZRPMYHKGYZLQDR-UHFFFAOYSA-N	-1	0	373.413	2.786	50	0		FFAARM
O=C([O-])Cn1nc(Cc2cccc(Cl)c2)nc1-c1ccc(CO)cc1	ZINC000097717347	222207702	/nfs/dbraw/zinc/20/77/02/222207702.db2.gz	TVLDDVGAHFPNHB-UHFFFAOYSA-N	-1	0	357.797	2.766	50	0		FFAARM
CCCCCn1c2ccccc2c([O-])c(C(=O)Nc2ncccn2)c1=O	ZINC000100329684	222241749	/nfs/dbraw/zinc/24/17/49/222241749.db2.gz	WLGHURCUEMTQNY-UHFFFAOYSA-N	-1	0	352.394	2.940	50	0		FFAARM
CCOc1ccc(-c2nnc3ccc(SC(C(C)=O)=C(C)O)nn32)cc1	ZINC000100712599	222250625	/nfs/dbraw/zinc/25/06/25/222250625.db2.gz	GOTLLAGHTGZDGA-UHFFFAOYSA-N	-1	0	370.434	2.829	50	0		FFAARM
O=c1c2[n-][nH]n(Cc3ccccc3F)c=2c(=O)n1-c1ccc(F)c(F)c1	ZINC000101168178	222265199	/nfs/dbraw/zinc/26/51/99/222265199.db2.gz	QXDPHBZEKHPVHZ-GJZGRUSLSA-N	-1	0	360.295	2.597	50	0		FFAARM
O=C1[C@@H]2ON=C(c3ccc(F)cc3)[C@@H]2C(=O)N1c1ccc(F)c(Cl)c1	ZINC000101342566	222270321	/nfs/dbraw/zinc/27/03/21/222270321.db2.gz	XCEQNPAPSKVSAI-DZGCQCFKSA-N	-1	0	362.719	2.911	50	0		FFAARM
Cc1ccccc1Cn1[nH][n-]c2c(=O)n(-c3ccc(F)c(F)c3)c(=O)c1=2	ZINC000101418102	222274261	/nfs/dbraw/zinc/27/42/61/222274261.db2.gz	WPCAHZSGHCNMNV-HZPDHXFCSA-N	-1	0	356.332	2.767	50	0		FFAARM
CCOc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccccc4C)c=3c2=O)cc1	ZINC000101417740	222274391	/nfs/dbraw/zinc/27/43/91/222274391.db2.gz	VIOVSNWSXDKUJK-MSOLQXFVSA-N	-1	0	364.405	2.887	50	0		FFAARM
COc1cc([C@H]2CC(C(=O)[O-])=Nc3ncnn32)ccc1OCCC(C)C	ZINC000101585165	222278037	/nfs/dbraw/zinc/27/80/37/222278037.db2.gz	KFAVGGURNJDUSH-CQSZACIVSA-N	-1	0	358.398	2.695	50	0		FFAARM
C[C@H](CNC(=O)c1ccc2c(c1)[n-]c(=S)n(C)c2=O)c1ccccc1	ZINC000102166597	222291017	/nfs/dbraw/zinc/29/10/17/222291017.db2.gz	KBCBYJXARVNLBQ-GFCCVEGCSA-N	-1	0	353.447	2.756	50	0		FFAARM
CCn1c(=O)c2ccc(C(=O)N[C@@H](C)c3cccnc3)cc2[n-]c1=S	ZINC000102759847	222307733	/nfs/dbraw/zinc/30/77/33/222307733.db2.gz	SWWSMLCKYFTDAH-NSHDSACASA-N	-1	0	354.435	2.591	50	0		FFAARM
CC(C)(C)CC(=O)Nc1ccc(CC(=O)N2CCC[C@H](C(=O)[O-])C2)cc1	ZINC000136128002	222544820	/nfs/dbraw/zinc/54/48/20/222544820.db2.gz	PSOWVKASGYJQHW-HNNXBMFYSA-N	-1	0	360.454	2.927	50	0		FFAARM
CC(=O)[N-]S(=O)(=O)c1ccc(NC(=O)Nc2cccc(Cl)c2)cc1	ZINC000001003542	506244049	/nfs/dbraw/zinc/24/40/49/506244049.db2.gz	NBEWWOWQLQMQSS-UHFFFAOYSA-N	-1	0	367.814	2.809	50	0		FFAARM
O=C([O-])CSc1nnc2n(CCOc3ccccc3)c3ccccc3n12	ZINC000002502930	506281558	/nfs/dbraw/zinc/28/15/58/506281558.db2.gz	ZUFLRKYXKXHEMS-UHFFFAOYSA-N	-1	0	368.418	2.940	50	0		FFAARM
COCCCNc1nc2ccccc2nc1[N-]S(=O)(=O)c1ccccc1	ZINC000002554869	506283854	/nfs/dbraw/zinc/28/38/54/506283854.db2.gz	GEPBDSVNOFOYCR-UHFFFAOYSA-N	-1	0	372.450	2.879	50	0		FFAARM
COc1ccc(-c2nnc(SCC(=O)NC3CCCCC3)[n-]c2=O)cc1	ZINC000032778624	506293374	/nfs/dbraw/zinc/29/33/74/506293374.db2.gz	CLPFZEXAWAQRBV-UHFFFAOYSA-N	-1	0	374.466	2.794	50	0		FFAARM
O=C([O-])[C@H]1CCCC[C@@H]1C(=O)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000002808338	506295375	/nfs/dbraw/zinc/29/53/75/506295375.db2.gz	JZTMKWZSWJLPMC-IRXDYDNUSA-N	-1	0	364.873	2.875	50	0		FFAARM
CC[C@@H](C)NC(=O)c1ccc2c(c1)[n-]c(=S)n(Cc1ccco1)c2=O	ZINC000002970886	506304767	/nfs/dbraw/zinc/30/47/67/506304767.db2.gz	VQPWHVPOEKUIEI-LLVKDONJSA-N	-1	0	357.435	2.855	50	0		FFAARM
CCOc1ccccc1NC(=O)CSc1nn(-c2ccccc2)c(=O)[n-]1	ZINC000032871473	506304803	/nfs/dbraw/zinc/30/48/03/506304803.db2.gz	VVRNPCGZBHWUSG-UHFFFAOYSA-N	-1	0	370.434	2.690	50	0		FFAARM
O=C([O-])c1cccc(NS(=O)(=O)c2ccc(Br)cc2)c1	ZINC000003025605	506307782	/nfs/dbraw/zinc/30/77/82/506307782.db2.gz	BUTBMLDLLOBSFI-UHFFFAOYSA-N	-1	0	356.197	2.948	50	0		FFAARM
CCOC(=O)[C@]([N-]c1nc2ccccc2s1)(NC(C)=O)C(F)(F)F	ZINC000003138607	506310837	/nfs/dbraw/zinc/31/08/37/506310837.db2.gz	ZDOQDSDMFVXPCV-CYBMUJFWSA-N	-1	0	361.345	2.666	50	0		FFAARM
Cn1cc(NC(=O)c2cc(NC(=O)OC(C)(C)C)cn2C)cc1C(=O)[O-]	ZINC000034443919	506367647	/nfs/dbraw/zinc/36/76/47/506367647.db2.gz	UKRBNYGJOCAJEL-UHFFFAOYSA-N	-1	0	362.386	2.661	50	0		FFAARM
CN(C)c1ccc(N(C(=O)NCC(=O)[O-])c2ccc(N(C)C)cc2)cc1	ZINC000034344695	506368192	/nfs/dbraw/zinc/36/81/92/506368192.db2.gz	XWGFMKLIWWTPDP-UHFFFAOYSA-N	-1	0	356.426	2.751	50	0		FFAARM
COc1cc([C@@H]2[C@H](C(=O)[O-])c3ccccc3C(=O)N2C)cc(OC)c1OC	ZINC000004563627	506382669	/nfs/dbraw/zinc/38/26/69/506382669.db2.gz	HZWXNYYVVCDQFJ-IAGOWNOFSA-N	-1	0	371.389	2.708	50	0		FFAARM
Cc1sc(-c2noc(C3CC3)n2)cc1S(=O)(=O)[N-]c1ccccn1	ZINC000035539465	506388511	/nfs/dbraw/zinc/38/85/11/506388511.db2.gz	CONIEXFZLBTOPR-UHFFFAOYSA-N	-1	0	362.436	3.180	50	0		FFAARM
O=C([O-])[C@@H]1CCCC[C@@H]1C(=O)N1CCN(c2ccccc2Cl)CC1	ZINC000004749307	506393226	/nfs/dbraw/zinc/39/32/26/506393226.db2.gz	MKTQWEILLANZID-UONOGXRCSA-N	-1	0	350.846	2.880	50	0		FFAARM
O=C([O-])c1cc2n(n1)[C@@H](C(F)(F)F)C[C@H](c1ccc3c(c1)OCO3)N2	ZINC000004812138	506395733	/nfs/dbraw/zinc/39/57/33/506395733.db2.gz	XLRYNLAQFRRTLC-PRHODGIISA-N	-1	0	355.272	2.970	50	0		FFAARM
Cc1ccc(S(=O)(=O)[N-]c2cccc(-c3ccc4nncn4n3)c2)s1	ZINC000005150745	506424616	/nfs/dbraw/zinc/42/46/16/506424616.db2.gz	QDLOIOTXURIOIT-UHFFFAOYSA-N	-1	0	371.447	2.962	50	0		FFAARM
COc1cccc(C[C@H](C(=O)Nc2cc(C)cc(C)c2)c2nnn[n-]2)c1	ZINC000005488746	506446148	/nfs/dbraw/zinc/44/61/48/506446148.db2.gz	VYGQTSCISDVOPV-KRWDZBQOSA-N	-1	0	351.410	2.790	50	0		FFAARM
C/C(=C\C(=O)Nc1sc2c(c1C(N)=O)CC[C@@H](C(C)(C)C)C2)C(=O)[O-]	ZINC000005516737	506446582	/nfs/dbraw/zinc/44/65/82/506446582.db2.gz	PVDNLIOZJYZEOE-TTZKWOQHSA-N	-1	0	364.467	2.967	50	0		FFAARM
NC1=NC(=O)C(CCC[C@H](C(=O)[O-])c2cccc3ccccc32)C(=O)N1	ZINC000039438678	506450202	/nfs/dbraw/zinc/45/02/02/506450202.db2.gz	OAAWMZINEDCHGN-AWEZNQCLSA-N	-1	0	353.378	2.814	50	0		FFAARM
CC(NCc1ccc(F)cc1)=C1C(=O)[N-]C(=O)N(C2CCCCC2)C1=O	ZINC000006373559	506479093	/nfs/dbraw/zinc/47/90/93/506479093.db2.gz	UZEMNWNYKRIRQS-VBKFSLOCSA-N	-1	0	359.401	2.600	50	0		FFAARM
O=C([O-])[C@@H]1C2CCC(CC2)[C@H]1C(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000006715355	506500617	/nfs/dbraw/zinc/50/06/17/506500617.db2.gz	NPRFPORHLJRTSB-VKYMVXLJSA-N	-1	0	360.429	2.611	50	0		FFAARM
C[C@H]1Oc2ccc([N-]S(=O)(=O)c3ccc(F)c(F)c3F)cc2NC1=O	ZINC000007729326	506585487	/nfs/dbraw/zinc/58/54/87/506585487.db2.gz	MFGPBAGVGIFKFG-SSDOTTSWSA-N	-1	0	372.324	2.624	50	0		FFAARM
Cc1ccc(C2=Nn3c(nnc3[C@H]3CCCO3)S[C@@H]2CC(=O)[O-])cc1	ZINC000008428707	506649545	/nfs/dbraw/zinc/64/95/45/506649545.db2.gz	UPWGLMBITHDUMP-CHWSQXEVSA-N	-1	0	358.423	2.639	50	0		FFAARM
O=C([O-])c1ccc(Nc2nc(N3CCCC3)nc(N3CCCC3)n2)cc1	ZINC000008418693	506649859	/nfs/dbraw/zinc/64/98/59/506649859.db2.gz	HNSRLBBWAXTAIE-UHFFFAOYSA-N	-1	0	354.414	2.514	50	0		FFAARM
CC(C)C(=O)Nc1scc2c1c(=O)n(-c1ccccc1)nc2C(=O)[O-]	ZINC000008768990	506667773	/nfs/dbraw/zinc/66/77/73/506667773.db2.gz	WRRXSBFYAHWOCR-UHFFFAOYSA-N	-1	0	357.391	2.740	50	0		FFAARM
O=C(CSC1=NC(=O)C(Cc2ccccc2)C([O-])=N1)Nc1ccccc1	ZINC000008772845	506669437	/nfs/dbraw/zinc/66/94/37/506669437.db2.gz	OBBIKVAJNYZMOC-UHFFFAOYSA-N	-1	0	367.430	2.797	50	0		FFAARM
O=C([O-])c1ccc(NC(=O)Cc2sc(Nc3ccccc3)nc2O)cc1	ZINC000008995222	506677975	/nfs/dbraw/zinc/67/79/75/506677975.db2.gz	YOGKJURSKCRMFK-CQSZACIVSA-N	-1	0	369.402	2.824	50	0		FFAARM
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)[N-]OCc1ccccc1	ZINC000043936949	506800932	/nfs/dbraw/zinc/80/09/32/506800932.db2.gz	XNDRFJMBZVXYNJ-CQSZACIVSA-N	-1	0	354.472	2.881	50	0		FFAARM
O=C([O-])[C@@H](CCO)Sc1nnc(-c2c[nH]c3ccccc32)n1C1CC1	ZINC000012751022	506895521	/nfs/dbraw/zinc/89/55/21/506895521.db2.gz	SIQXZBYZFHSGST-CQSZACIVSA-N	-1	0	358.423	2.689	50	0		FFAARM
O=C([O-])c1sccc1S(=O)(=O)NCC1(c2ccccc2)CCC1	ZINC000012916285	506915566	/nfs/dbraw/zinc/91/55/66/506915566.db2.gz	WOUZNEFHMLIKBN-UHFFFAOYSA-N	-1	0	351.449	2.847	50	0		FFAARM
CCc1nc2sc([C@H](c3ccc(C)cc3)N3CCOCC3)c([O-])n2n1	ZINC000022854235	507314771	/nfs/dbraw/zinc/31/47/71/507314771.db2.gz	MNHQFZRJVWKKRK-HNNXBMFYSA-N	-1	0	358.467	2.789	50	0		FFAARM
CCc1nc2sc([C@@H](c3ccc(C)cc3)N3CCOCC3)c([O-])n2n1	ZINC000022854238	507315136	/nfs/dbraw/zinc/31/51/36/507315136.db2.gz	MNHQFZRJVWKKRK-OAHLLOKOSA-N	-1	0	358.467	2.789	50	0		FFAARM
CCCN(CC(=O)Nc1ccccc1F)Cc1nc(=O)c2sccc2[n-]1	ZINC000024864293	507445450	/nfs/dbraw/zinc/44/54/50/507445450.db2.gz	YUTQZUYLEIZJEV-UHFFFAOYSA-N	-1	0	374.441	2.974	50	0		FFAARM
COc1cc2c(cc1OC)CN(Cc1nc(=O)c3sccc3[n-]1)CC2	ZINC000025499374	507505230	/nfs/dbraw/zinc/50/52/30/507505230.db2.gz	HPFZFSDZDXRULX-UHFFFAOYSA-N	-1	0	357.435	2.972	50	0		FFAARM
CCCCC[C@H](O)/C=C/[C@H]1O[C@H](O)C[C@@H](O)[C@H]1C/C=C\CCCC(=O)[O-]	ZINC000071756353	507712882	/nfs/dbraw/zinc/71/28/82/507712882.db2.gz	XNRNNGPBEPRNAR-YDQDXGRRSA-N	-1	0	370.486	2.769	50	0		FFAARM
O=C([O-])c1cc(NS(=O)(=O)N2CCc3ccccc3C2)ccc1Cl	ZINC000071939711	507728619	/nfs/dbraw/zinc/72/86/19/507728619.db2.gz	DFEGIYXSPZRJMW-UHFFFAOYSA-N	-1	0	366.826	2.753	50	0		FFAARM
Cc1c(Cl)c(C(=O)N2CC[C@H](Cc3cccc(C(=O)[O-])c3)C2)nn1C	ZINC000072152481	507761824	/nfs/dbraw/zinc/76/18/24/507761824.db2.gz	YXBNCRNDXXSQRQ-CYBMUJFWSA-N	-1	0	361.829	2.785	50	0		FFAARM
O=C([O-])c1ccc(C[C@H]2CCN(S(=O)(=O)Cc3ccccc3)C2)cc1	ZINC000072408596	507784849	/nfs/dbraw/zinc/78/48/49/507784849.db2.gz	MSWOEUFHGMDUSV-QGZVFWFLSA-N	-1	0	359.447	2.779	50	0		FFAARM
COc1ccc(/C=C/c2nc3ccccc3c(=O)n2CCC(=O)[O-])cc1O	ZINC000029737026	507788528	/nfs/dbraw/zinc/78/85/28/507788528.db2.gz	LVOAKMPULCSROJ-VQHVLOKHSA-N	-1	0	366.373	2.756	50	0		FFAARM
Cc1nc(CCNc2nccc(-c3cc(C(=O)[O-])ccn3)n2)sc1C	ZINC000072433485	507790790	/nfs/dbraw/zinc/79/07/90/507790790.db2.gz	JULIVPDYRYABPM-UHFFFAOYSA-N	-1	0	355.423	2.965	50	0		FFAARM
COc1ccccc1OC1(C(=O)[O-])CCN(C(=O)[C@@H]2CC23CCC3)CC1	ZINC000072462917	507793672	/nfs/dbraw/zinc/79/36/72/507793672.db2.gz	QWMNZSQETLWPDK-AWEZNQCLSA-N	-1	0	359.422	2.710	50	0		FFAARM
CN(Cc1noc2c1CCCC2)c1nccc(-c2cc(C(=O)[O-])ccn2)n1	ZINC000072480535	507797489	/nfs/dbraw/zinc/79/74/89/507797489.db2.gz	PDEZCERTDMIYEA-UHFFFAOYSA-N	-1	0	365.393	2.740	50	0		FFAARM
CC(C)[C@@H](C(=O)N1CCn2nc(CCC(=O)[O-])cc2C1)c1ccccc1	ZINC000072479343	507797498	/nfs/dbraw/zinc/79/74/98/507797498.db2.gz	IIEKNPSKJVZUSS-LJQANCHMSA-N	-1	0	355.438	2.682	50	0		FFAARM
CC(=O)Nc1cc(C(=O)Cn2nnc(-c3ccc(Cl)cc3)n2)ccc1[O-]	ZINC000031653250	507820937	/nfs/dbraw/zinc/82/09/37/507820937.db2.gz	YBKQPTHDHWKLAM-UHFFFAOYSA-N	-1	0	371.784	2.540	50	0		FFAARM
O=C([O-])[C@@H]1CCCN1CC(=O)NCc1cccc(Oc2ccccc2)c1	ZINC000089845839	507874029	/nfs/dbraw/zinc/87/40/29/507874029.db2.gz	MJMLDFYDSPWQNQ-SFHVURJKSA-N	-1	0	354.406	2.644	50	0		FFAARM
CC(C)Cc1cc(C(=O)N2C[C@@H](c3ccccc3)[C@H](C(=O)[O-])C2)n(C)n1	ZINC000092099698	508043221	/nfs/dbraw/zinc/04/32/21/508043221.db2.gz	VWNZRGIGUUJMJS-DLBZAZTESA-N	-1	0	355.438	2.559	50	0		FFAARM
CC(=O)Nc1ccc([N-]S(=O)(=O)c2cc(-c3cc[nH]n3)oc2C)cc1	ZINC000075518964	508113210	/nfs/dbraw/zinc/11/32/10/508113210.db2.gz	RPXKWYJTBOUPEY-UHFFFAOYSA-N	-1	0	360.395	2.737	50	0		FFAARM
CC(C)Oc1ccc([C@@H](C(=O)[O-])N2CCN(Cc3ccccn3)CC2)cc1	ZINC000095384680	508182216	/nfs/dbraw/zinc/18/22/16/508182216.db2.gz	LZSAZTPCPNZQNR-FQEVSTJZSA-N	-1	0	369.465	2.812	50	0		FFAARM
Cn1ccnc1CN1CCN([C@H](C(=O)[O-])c2csc3ccccc32)CC1	ZINC000095384514	508182358	/nfs/dbraw/zinc/18/23/58/508182358.db2.gz	POWHZMJLIYEMHK-SFHVURJKSA-N	-1	0	370.478	2.578	50	0		FFAARM
Cc1nc(CN(C)C(=O)c2cc(C(=O)[O-])nn2-c2ccccc2)cs1	ZINC000095424282	508185094	/nfs/dbraw/zinc/18/50/94/508185094.db2.gz	RUEQLYPNUKBOTE-UHFFFAOYSA-N	-1	0	356.407	2.608	50	0		FFAARM
Cc1cc(CC(=O)N[C@@H](CC(=O)[O-])c2ccc(Br)cc2)no1	ZINC000095463870	508186912	/nfs/dbraw/zinc/18/69/12/508186912.db2.gz	ZRNGHOHXYDGDOT-ZDUSSCGKSA-N	-1	0	367.199	2.620	50	0		FFAARM
O=C([O-])[C@@H](c1ccc(F)c(CO)c1)N1CCc2[nH]c3ccccc3c2C1	ZINC000095518755	508193849	/nfs/dbraw/zinc/19/38/49/508193849.db2.gz	IMNWKHUDGYKUDL-LJQANCHMSA-N	-1	0	354.381	2.983	50	0		FFAARM
Cc1ccc(OCc2ccc(C(=O)N(C)C[C@@H](C)c3nnn[n-]3)o2)c(C)c1	ZINC000095939708	508198531	/nfs/dbraw/zinc/19/85/31/508198531.db2.gz	NJHUSWGLFDYGTR-CQSZACIVSA-N	-1	0	369.425	2.864	50	0		FFAARM
O=C([O-])[C@@H](Cc1c[nH]c2cc(F)ccc12)NC(=O)CC[C@@H]1CCCCO1	ZINC000095989863	508200734	/nfs/dbraw/zinc/20/07/34/508200734.db2.gz	FBDADPPUHSKQPJ-WMLDXEAASA-N	-1	0	362.401	2.768	50	0		FFAARM
CCOc1cc([N-]S(=O)(=O)c2ccc(F)c(C(F)(F)F)c2)ncn1	ZINC000077100987	508277808	/nfs/dbraw/zinc/27/78/08/508277808.db2.gz	XYZNMMNWLAYEFQ-UHFFFAOYSA-N	-1	0	365.308	2.834	50	0		FFAARM
CC(C)c1noc([C@@H]2CCCN2C(=O)c2cc(=O)n(-c3ccccc3)[n-]2)n1	ZINC000077386008	508308832	/nfs/dbraw/zinc/30/88/32/508308832.db2.gz	SSKMATJXCIONBV-HNNXBMFYSA-N	-1	0	367.409	2.649	50	0		FFAARM
O=C(c1ccc2[n-]c(=S)oc2c1)N1CCOC[C@@H]1C[C@H](O)c1ccco1	ZINC000159015159	508780790	/nfs/dbraw/zinc/78/07/90/508780790.db2.gz	BQPDQORTTGIUFX-JSGCOSHPSA-N	-1	0	374.418	2.674	50	0		FFAARM
O=S(=O)([N-]Cc1ccnc(OC2CCC2)c1)c1c(F)cc(F)cc1F	ZINC000121095754	509126869	/nfs/dbraw/zinc/12/68/69/509126869.db2.gz	SNRDJTVMUZCZHG-UHFFFAOYSA-N	-1	0	372.368	2.909	50	0		FFAARM
COc1ccc([C@H](C2=C([O-])COC2=O)c2cc3c(cc2O)OCO3)cc1	ZINC000199162807	509233449	/nfs/dbraw/zinc/23/34/49/509233449.db2.gz	RIEROYUYIIFCAA-KRWDZBQOSA-N	-1	0	356.330	2.630	50	0		FFAARM
Cn1cc(S(=O)(=O)[N-]c2ccccc2-c2cn3ccsc3n2)cn1	ZINC000206908361	509236986	/nfs/dbraw/zinc/23/69/86/509236986.db2.gz	AAVNGUGRBSMIOS-UHFFFAOYSA-N	-1	0	359.436	2.597	50	0		FFAARM
[O-]c1c([C@@H](c2ccc(F)c(Cl)c2)N2CCOCC2)sc2ncnn12	ZINC000218513152	509278443	/nfs/dbraw/zinc/27/84/43/509278443.db2.gz	FMYHXYWCWHSJFX-GFCCVEGCSA-N	-1	0	368.821	2.711	50	0		FFAARM
O=C(c1cc(=O)n(-c2ccccc2)[n-]1)N1CCc2[nH]c3ccccc3c2C1	ZINC000219847021	509291419	/nfs/dbraw/zinc/29/14/19/509291419.db2.gz	BZZOOOUNYNBKFE-UHFFFAOYSA-N	-1	0	358.401	2.845	50	0		FFAARM
O=C([O-])CC[C@]1(CCC(=O)NCc2ccc3sccc3c2)CCC(=O)N1	ZINC000222331025	509314301	/nfs/dbraw/zinc/31/43/01/509314301.db2.gz	XXLMHOPFOZDULU-IBGZPJMESA-N	-1	0	374.462	2.811	50	0		FFAARM
COCCCCCC(=O)N1CCc2[nH]c(-c3cccc(C(=O)[O-])c3)nc2C1	ZINC000222839048	509324637	/nfs/dbraw/zinc/32/46/37/509324637.db2.gz	DNAVBNXWCRMOHA-UHFFFAOYSA-N	-1	0	371.437	2.866	50	0		FFAARM
CCO[C@H](C)c1nc(CC(=O)N2Cc3ccccc3C[C@H]2C(=O)[O-])cs1	ZINC000236925534	509533728	/nfs/dbraw/zinc/53/37/28/509533728.db2.gz	KOMLTUODQSJEAM-WBMJQRKESA-N	-1	0	374.462	2.821	50	0		FFAARM
COc1ccc(-n2ccc(C(=O)N3[C@H](C(=O)[O-])C[C@@H]4CCCC[C@@H]43)n2)cc1	ZINC000237446753	509648807	/nfs/dbraw/zinc/64/88/07/509648807.db2.gz	SUWQTTWPQCYDOG-KKXDTOCCSA-N	-1	0	369.421	2.739	50	0		FFAARM
C[C@@]1(C(=O)[O-])CCN(C(=O)c2ccccc2C(=O)c2ccc(F)cc2)C1	ZINC000237654204	509703209	/nfs/dbraw/zinc/70/32/09/509703209.db2.gz	AXZWIEGMSNYULC-HXUWFJFHSA-N	-1	0	355.365	2.994	50	0		FFAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)/C=C/c2cnn(-c3ccccc3)c2)C1	ZINC000237965839	509788023	/nfs/dbraw/zinc/78/80/23/509788023.db2.gz	PTKKUIDMXRPKQS-DZZUKKPASA-N	-1	0	353.422	2.989	50	0		FFAARM
O=C([O-])c1ccc(C(=O)N2CCO[C@H](c3ccc(F)c(F)c3)C2)s1	ZINC000237998745	509795399	/nfs/dbraw/zinc/79/53/99/509795399.db2.gz	WEXTVJFMNUVCRW-LBPRGKRZSA-N	-1	0	353.346	2.938	50	0		FFAARM
O=C([O-])COc1cccc(CNC(=O)[C@@H]2C[C@H]2c2cc(F)ccc2F)c1	ZINC000238019716	509801451	/nfs/dbraw/zinc/80/14/51/509801451.db2.gz	HUGGUINYSXVEFB-GOEBONIOSA-N	-1	0	361.344	2.848	50	0		FFAARM
O=C([O-])C1CCN(C(=O)c2[nH]c3ccccc3c2Br)CC1	ZINC000238033413	509805738	/nfs/dbraw/zinc/80/57/38/509805738.db2.gz	IDXLWKOVZCEAMX-UHFFFAOYSA-N	-1	0	351.200	2.867	50	0		FFAARM
O=C([O-])c1ccc(C(=O)N[C@H]2CCN(c3ccccc3Cl)C2=O)s1	ZINC000238040893	509807820	/nfs/dbraw/zinc/80/78/20/509807820.db2.gz	GYHQONGKSNTFOY-JTQLQIEISA-N	-1	0	364.810	2.635	50	0		FFAARM
O=C([O-])CCN(C[C@@H]1CCCO1)C(=O)Cc1ccccc1C(F)(F)F	ZINC000238087744	509817431	/nfs/dbraw/zinc/81/74/31/509817431.db2.gz	RXZJDGIQJSDPHZ-ZDUSSCGKSA-N	-1	0	359.344	2.730	50	0		FFAARM
O=C([O-])CCN(C[C@@H]1CCCO1)C(=O)c1cc2ccc(Cl)cc2[nH]1	ZINC000238096123	509819031	/nfs/dbraw/zinc/81/90/31/509819031.db2.gz	MONBMINJDHQLKL-ZDUSSCGKSA-N	-1	0	350.802	2.917	50	0		FFAARM
O=C([O-])[C@H]1CCCN1CC(=O)N1CCc2sccc2[C@@H]1c1ccccc1	ZINC000238091635	509819552	/nfs/dbraw/zinc/81/95/52/509819552.db2.gz	BBSNPOILQGCBTO-APWZRJJASA-N	-1	0	370.474	2.771	50	0		FFAARM
O=C([O-])c1ccc(CNC(=O)CC[C@H]2Cc3ccccc3NC2=O)cc1	ZINC000238108079	509821547	/nfs/dbraw/zinc/82/15/47/509821547.db2.gz	BKYCXODIDXQSEZ-INIZCTEOSA-N	-1	0	352.390	2.592	50	0		FFAARM
O=C([O-])CN(C(=O)c1csc(-c2ccc(F)cc2)n1)C1CCOCC1	ZINC000238115701	509824352	/nfs/dbraw/zinc/82/43/52/509824352.db2.gz	QKPNVBJQRWTQCG-UHFFFAOYSA-N	-1	0	364.398	2.655	50	0		FFAARM
O=C([O-])c1cccc(CNC(=O)C2(c3cccc(F)c3)CCOCC2)c1	ZINC000238213883	509834077	/nfs/dbraw/zinc/83/40/77/509834077.db2.gz	YNRCOHBFVXZOGT-UHFFFAOYSA-N	-1	0	357.381	2.889	50	0		FFAARM
CCN(CC)c1ccc([N-]S(=O)(=O)c2ccc(OC)cc2F)cn1	ZINC000252494819	509844198	/nfs/dbraw/zinc/84/41/98/509844198.db2.gz	OFPMPTAUGPLJKC-UHFFFAOYSA-N	-1	0	353.419	2.876	50	0		FFAARM
C/C(=C\C(=O)N1CCO[C@@H](CC(=O)[O-])C1)c1cccc(C(F)(F)F)c1	ZINC000269048519	510209953	/nfs/dbraw/zinc/20/99/53/510209953.db2.gz	UNIBESDVWNKIGB-OIOXUXFSSA-N	-1	0	357.328	2.811	50	0		FFAARM
C/C(=C\C(=O)N1CCO[C@H](CC(=O)[O-])C1)c1cccc(C(F)(F)F)c1	ZINC000269048518	510210343	/nfs/dbraw/zinc/21/03/43/510210343.db2.gz	UNIBESDVWNKIGB-DPQIITEBSA-N	-1	0	357.328	2.811	50	0		FFAARM
Cc1oc(CNC(=O)c2ccc(OC[C@@H]3CCCO3)cc2)cc1C(=O)[O-]	ZINC000262979111	510505145	/nfs/dbraw/zinc/50/51/45/510505145.db2.gz	MTRXQNUUCLTFLJ-HNNXBMFYSA-N	-1	0	359.378	2.774	50	0		FFAARM
C[C@@H](c1ccccc1)N1C[C@H](C(=O)NCc2ccc(C(=O)[O-])s2)CC1=O	ZINC000263164955	510593461	/nfs/dbraw/zinc/59/34/61/510593461.db2.gz	ISBHIUOAQJEANN-GXTWGEPZSA-N	-1	0	372.446	2.672	50	0		FFAARM
COc1cccc([C@H]2CN(C(=O)c3ccc(C(=O)[O-])cc3F)CCO2)c1	ZINC000263550238	510745587	/nfs/dbraw/zinc/74/55/87/510745587.db2.gz	WBFJVOCPHCYYHR-QGZVFWFLSA-N	-1	0	359.353	2.746	50	0		FFAARM
O=C([O-])[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1CCOc2ccccc21	ZINC000299742881	511668480	/nfs/dbraw/zinc/66/84/80/511668480.db2.gz	JBHXTLUKQBVRSR-WMZOPIPTSA-N	-1	0	364.401	2.846	50	0		FFAARM
O=C([O-])COc1cccc(CNC(=O)[C@@H]2SCCc3ccccc32)c1	ZINC000299750384	511668606	/nfs/dbraw/zinc/66/86/06/511668606.db2.gz	NHZZMWWDBCKXHH-GOSISDBHSA-N	-1	0	357.431	2.797	50	0		FFAARM
COc1cc2c(cc1OC)[C@@H](CC(=O)[O-])N(C(=O)[C@H]1CC=CCC1)CC2	ZINC000299742046	511668618	/nfs/dbraw/zinc/66/86/18/511668618.db2.gz	GMYDEYVOPCBYEE-XJKSGUPXSA-N	-1	0	359.422	2.961	50	0		FFAARM
O=C([O-])COc1ccc(CCNC(=O)[C@@H]2SCCc3ccccc32)cc1	ZINC000299750765	511668828	/nfs/dbraw/zinc/66/88/28/511668828.db2.gz	OHTMCOUFCPOKOQ-LJQANCHMSA-N	-1	0	371.458	2.839	50	0		FFAARM
Cc1cc(C(=O)N[C@@H](Cc2c[nH]cn2)C(=O)[O-])sc1-c1ccccc1	ZINC000426372205	513917249	/nfs/dbraw/zinc/91/72/49/513917249.db2.gz	JEXAOMCTGXEXLE-AWEZNQCLSA-N	-1	0	355.419	2.872	50	0		FFAARM
O=C([O-])[C@@H]1CCCN1C(=O)/C=C\c1ccc(OCc2cccnc2)cc1	ZINC000606441099	521069124	/nfs/dbraw/zinc/06/91/24/521069124.db2.gz	GMKRLBXAPQTTLA-VOCYLRNQSA-N	-1	0	352.390	2.749	50	0		FFAARM
CCn1cc(C(=O)N[C@H](C(=O)[O-])c2ccccc2Br)c(C)n1	ZINC000630207268	522699546	/nfs/dbraw/zinc/69/95/46/522699546.db2.gz	LFEQEJOFIHRQJS-ZDUSSCGKSA-N	-1	0	366.215	2.530	50	0		FFAARM
CCn1ncc(Cl)c1C(=O)Nc1ccc(O[C@@H](C)C(=O)[O-])c(F)c1	ZINC000630260321	522745184	/nfs/dbraw/zinc/74/51/84/522745184.db2.gz	JVAYZXNFWBIXAO-QMMMGPOBSA-N	-1	0	355.753	2.800	50	0		FFAARM
COc1ccc(-n2ccc(C(=O)N3[C@@H]4CCCC[C@H]4C[C@H]3C(=O)[O-])n2)cc1	ZINC000268950814	523332790	/nfs/dbraw/zinc/33/27/90/523332790.db2.gz	SUWQTTWPQCYDOG-VHSSKADRSA-N	-1	0	369.421	2.739	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)C[C@@H]1CCOC1)c1cccc(Br)c1	ZINC000299753900	527624264	/nfs/dbraw/zinc/62/42/64/527624264.db2.gz	ZSJITYGKWVAYCY-GXFFZTMASA-N	-1	0	356.216	2.508	50	0		FFAARM
O=C([O-])[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCOc2ccccc21	ZINC000299742880	527648184	/nfs/dbraw/zinc/64/81/84/527648184.db2.gz	JBHXTLUKQBVRSR-SJLPKXTDSA-N	-1	0	364.401	2.846	50	0		FFAARM
CCOc1ccc(-c2ccnc(N3CCC[C@@](C)(O)C3)n2)cc1C(=O)[O-]	ZINC000072480224	535692951	/nfs/dbraw/zinc/69/29/51/535692951.db2.gz	BIBDASKRQGRSEP-LJQANCHMSA-N	-1	0	357.410	2.592	50	0		FFAARM
COc1ccc(S(=O)(=O)N2CCCc3cccc(F)c32)cc1C(=O)[O-]	ZINC000055581129	536870462	/nfs/dbraw/zinc/87/04/62/536870462.db2.gz	DVAXYFBZDSMJND-UHFFFAOYSA-N	-1	0	365.382	2.674	50	0		FFAARM
COc1ccccc1OC1(C(=O)[O-])CCN(c2nc(C)nc(C)c2C)CC1	ZINC000082097978	537088103	/nfs/dbraw/zinc/08/81/03/537088103.db2.gz	XHUIAOCCCOSDSI-UHFFFAOYSA-N	-1	0	371.437	2.913	50	0		FFAARM
O=C([C@@H](c1ccccc1)S(=O)(=O)c1nc2ccccc2[n-]1)N1CCCC1	ZINC000047939817	570932918	/nfs/dbraw/zinc/93/29/18/570932918.db2.gz	QLQIUZMPLGHZMW-QGZVFWFLSA-N	-1	0	369.446	2.700	50	0		FFAARM
CC1CCC2(CC1)NC(=O)N([N-]C(=O)c1ccccc1C(F)(F)F)C2=O	ZINC000048333180	570946734	/nfs/dbraw/zinc/94/67/34/570946734.db2.gz	URWJENBWVACMSU-UHFFFAOYSA-N	-1	0	369.343	2.851	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)/C=C(\c2ccc(Cl)cc2)C(F)(F)F)CCO1	ZINC000584908407	602352516	/nfs/dbraw/zinc/35/25/16/602352516.db2.gz	NLJJQJZENVJRRS-VNKGSWCUSA-N	-1	0	363.719	2.598	50	0		FFAARM
CC[C@]1(c2ccccc2)C(=O)[N-]C(=O)N(C(=O)c2ccc(Cl)cc2)C1=O	ZINC000005005921	975591459	/nfs/dbraw/zinc/59/14/59/975591459.db2.gz	ISNDNYKIMWBWIB-IBGZPJMESA-N	-1	0	370.792	2.907	50	0		FFAARM
CC(C)c1noc([C@H](C)NS(=O)(=O)c2cc(C(=O)[O-])ccc2Cl)n1	ZINC000822285059	998843710	/nfs/dbraw/zinc/84/37/10/998843710.db2.gz	NWKGAWRVLQCNTH-QMMMGPOBSA-N	-1	0	373.818	2.584	50	0		FFAARM
CCc1cc(-c2cc(-c3[nH]c(C)c(C(=O)[O-])c3C)nc(N)c2C#N)n[nH]1	ZINC000071405568	1019650890	/nfs/dbraw/zinc/65/08/90/1019650890.db2.gz	YUQUIQBGIACTED-UHFFFAOYSA-N	-1	0	350.382	2.798	50	0		FFAARM
C[C@H](NC(=O)Nc1ccnn1Cc1ccccn1)[C@@H]1C[C@H](C(=O)[O-])C1(C)C	ZINC000653541411	1024935827	/nfs/dbraw/zinc/93/58/27/1024935827.db2.gz	OWTHHIWVHAEFGN-AEGPPILISA-N	-1	0	371.441	2.583	50	0		FFAARM
COc1ccc(-c2c(-c3ccccc3)ncn2[C@@H](CO)C(=O)[O-])cc1O	ZINC000091416896	1026751906	/nfs/dbraw/zinc/75/19/06/1026751906.db2.gz	YMDURANLZPFSCR-AWEZNQCLSA-N	-1	0	354.362	2.549	50	0		FFAARM
CCOc1ccccc1N1CCN([C@H](C(=O)[O-])c2cccc(CO)c2)CC1	ZINC000095355096	1028542526	/nfs/dbraw/zinc/54/25/26/1028542526.db2.gz	WTSOBXJUULBRCU-FQEVSTJZSA-N	-1	0	370.449	2.526	50	0		FFAARM
Cc1[nH]c(C(=O)[O-])c(C)c1C(=O)N1CCC[C@H](c2nc(CC(C)C)no2)C1	ZINC001506403666	1059496482	/nfs/dbraw/zinc/49/64/82/1059496482.db2.gz	CVALMJDKRGCZRH-ZDUSSCGKSA-N	-1	0	374.441	2.931	50	0		FFAARM
Cc1ncsc1CN(Cc1ccccc1)C(=O)c1[nH]cnc1C(=O)[O-]	ZINC001506411926	1059500180	/nfs/dbraw/zinc/50/01/80/1059500180.db2.gz	LXPXYILZHLDQKR-UHFFFAOYSA-N	-1	0	356.407	2.715	50	0		FFAARM
COc1cc(C=Cc2nc3ccccc3c(=O)[nH]2)ccc1OCC(=O)[O-]	ZINC000033497344	210186380	/nfs/dbraw/zinc/18/63/80/210186380.db2.gz	UIMKNGPVABPJAZ-CLFYSBASSA-N	-1	0	352.346	2.566	50	0		FFAARM
O=C([O-])[C@H]1CCCCN1C(=O)c1ccc(-n2ccc(C(F)(F)F)n2)cc1	ZINC000136488591	210094768	/nfs/dbraw/zinc/09/47/68/210094768.db2.gz	KXORQIHAZJVXMA-CYBMUJFWSA-N	-1	0	367.327	2.970	50	0		FFAARM
COc1cccc(-c2cccc(C(=O)N3CCN(CCC(=O)[O-])CC3)c2)c1	ZINC000299766495	210014823	/nfs/dbraw/zinc/01/48/23/210014823.db2.gz	DXKGOPLXCDCWQB-UHFFFAOYSA-N	-1	0	368.433	2.595	50	0		FFAARM
O=C1[N-]N(c2cccc(Br)c2)C(=O)/C1=C/c1ccc(O)cc1	ZINC000000728556	219318307	/nfs/dbraw/zinc/31/83/07/219318307.db2.gz	YWMVPFBAULHSJP-RIYZIHGNSA-N	-1	0	359.179	2.616	50	0		FFAARM
Cc1c(C(=O)Nc2ccc(C)cc2C)sc2ncn(CC(=O)[O-])c(=O)c12	ZINC000000958411	219347931	/nfs/dbraw/zinc/34/79/31/219347931.db2.gz	KKVRHNXOLDJWEN-UHFFFAOYSA-N	-1	0	371.418	2.720	50	0		FFAARM
Cc1ccc(/C=C/C(=O)[O-])cc1S(=O)(=O)Nc1ccc2c(c1)OCO2	ZINC000001155578	219382690	/nfs/dbraw/zinc/38/26/90/219382690.db2.gz	NUWGJRVRNFNVFT-QPJJXVBHSA-N	-1	0	361.375	2.622	50	0		FFAARM
O=C([O-])[C@H]1CCCN(S(=O)(=O)Cc2ccc(Cl)c(Cl)c2)C1	ZINC000226087369	222882527	/nfs/dbraw/zinc/88/25/27/222882527.db2.gz	CFWBQGMHJVKTNL-JTQLQIEISA-N	-1	0	352.239	2.620	50	0		FFAARM
CC(C)Oc1cc(Br)cc(C(=O)N2CC[C@@H](C(=O)[O-])C2)c1	ZINC000236694503	222904177	/nfs/dbraw/zinc/90/41/77/222904177.db2.gz	CIYAFJJUVYSNQF-SNVBAGLBSA-N	-1	0	356.216	2.783	50	0		FFAARM
COC(=O)c1cc(S(=O)(=O)[N-]c2cc(Cl)ccc2OC)c(C)n1C	ZINC000064923091	212047826	/nfs/dbraw/zinc/04/78/26/212047826.db2.gz	GWGOXPHQQNDTCI-UHFFFAOYSA-N	-1	0	372.830	2.583	50	0		FFAARM
O=C([O-])[C@@H](c1cccc2c1Sc1ccccc1S2)N1CCNC(=O)C1	ZINC000063869900	212035881	/nfs/dbraw/zinc/03/58/81/212035881.db2.gz	JASFTGYYXCMUDU-MRXNPFEDSA-N	-1	0	372.471	2.860	50	0		FFAARM
CCn1ncc2ccc(NS(=O)(=O)c3ccc(C)c(C(=O)[O-])c3)cc21	ZINC000058366568	212006474	/nfs/dbraw/zinc/00/64/74/212006474.db2.gz	HQXMWEFSZOEWHY-UHFFFAOYSA-N	-1	0	359.407	2.864	50	0		FFAARM
CCNC(=O)c1ccc(Cl)cc1NC(=O)[C@@H]1CC=CC[C@@H]1C(=O)[O-]	ZINC000055150233	211938275	/nfs/dbraw/zinc/93/82/75/211938275.db2.gz	SAKJFVXUXIJFAP-NEPJUHHUSA-N	-1	0	350.802	2.695	50	0		FFAARM
O=C([O-])CCc1ccc(S(=O)(=O)N2CCC[C@H](C(F)(F)F)C2)cc1	ZINC000013089038	220057099	/nfs/dbraw/zinc/05/70/99/220057099.db2.gz	RUQSOMHUSBUZCJ-LBPRGKRZSA-N	-1	0	365.373	2.667	50	0		FFAARM
O=C([O-])[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(Cn2cccn2)cc1	ZINC000299750893	211833056	/nfs/dbraw/zinc/83/30/56/211833056.db2.gz	ORDWIUHVFKGECK-IBGZPJMESA-N	-1	0	361.401	2.583	50	0		FFAARM
O=C([O-])[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc(Cn2cccn2)cc1	ZINC000299743549	211823970	/nfs/dbraw/zinc/82/39/70/211823970.db2.gz	LGLFETURCKJNKR-KSZLIROESA-N	-1	0	353.422	2.789	50	0		FFAARM
CNC(=O)c1cc(S(=O)(=O)[N-]c2ccccc2C(F)(F)F)cs1	ZINC000016649184	220190048	/nfs/dbraw/zinc/19/00/48/220190048.db2.gz	QRLMJBCAXKLHLM-UHFFFAOYSA-N	-1	0	364.370	2.927	50	0		FFAARM
CCCC[C@@H](NS(=O)(=O)c1cccc2c1cccc2N(C)C)C(=O)[O-]	ZINC000032210649	211546791	/nfs/dbraw/zinc/54/67/91/211546791.db2.gz	OGHUUPAEGJCGAK-OAHLLOKOSA-N	-1	0	364.467	2.828	50	0		FFAARM
COc1cccc(-n2c(=O)c3[n-][nH]n(-c4ccc(F)c(Cl)c4)c=3c2=O)c1	ZINC000023125736	211377416	/nfs/dbraw/zinc/37/74/16/211377416.db2.gz	UTHWXDAQUBYHEW-HUUCEWRRSA-N	-1	0	374.759	2.986	50	0		FFAARM
Cc1ccc([N-]S(=O)(=O)c2ccc(-c3ccc(=O)[nH]n3)s2)cc1F	ZINC000020574750	211288475	/nfs/dbraw/zinc/28/84/75/211288475.db2.gz	HFCZLMUZTDAQSN-UHFFFAOYSA-N	-1	0	365.411	2.747	50	0		FFAARM
Cc1ccc(N2C(=O)C[C@@H](Sc3ncccc3C(=O)[O-])C2=O)c(C)c1	ZINC000019881454	211259600	/nfs/dbraw/zinc/25/96/00/211259600.db2.gz	BCDKCERGWIBYHV-CQSZACIVSA-N	-1	0	356.403	2.821	50	0		FFAARM
O=C([O-])c1cccc(COc2ccc(C=C3NC(=S)NC3=O)cc2)c1	ZINC000015769404	211141164	/nfs/dbraw/zinc/14/11/64/211141164.db2.gz	WIGXHEFVHQTFEP-OQLLNIDSSA-N	-1	0	354.387	2.720	50	0		FFAARM
O=C(C[C@@H]1SC(=O)[N-]C1=O)N1CCC[C@H]1c1nc2ccccc2s1	ZINC000014083385	211072140	/nfs/dbraw/zinc/07/21/40/211072140.db2.gz	NSPAHKJXFDMAOC-JQWIXIFHSA-N	-1	0	361.448	2.702	50	0		FFAARM
CC(=O)N1CCc2cc(NC(=O)C[C@@H](C(=O)[O-])c3ccccc3)ccc21	ZINC000013468111	211034633	/nfs/dbraw/zinc/03/46/33/211034633.db2.gz	IFSMTTLIFDTSRY-QGZVFWFLSA-N	-1	0	352.390	2.793	50	0		FFAARM
CCCn1c(=O)cc([O-])nc1S[C@H](C)C(=O)Nc1ccccc1F	ZINC000013018584	211020087	/nfs/dbraw/zinc/02/00/87/211020087.db2.gz	OLTOUVDVLZOEGM-SNVBAGLBSA-N	-1	0	351.403	2.617	50	0		FFAARM
CC[C@]1(C)NC(=O)N([N-]C(=O)c2ccc(-c3ccc(C(C)=O)cc3)o2)C1=O	ZINC000008342821	210783879	/nfs/dbraw/zinc/78/38/79/210783879.db2.gz	BSJXETHMCFQSHD-IBGZPJMESA-N	-1	0	369.377	2.515	50	0		FFAARM
CCc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccc(OC)cc4)c=3c2=O)cc1	ZINC000006770774	210699683	/nfs/dbraw/zinc/69/96/83/210699683.db2.gz	JUQCWCDCPQFJKA-QZTJIDSGSA-N	-1	0	364.405	2.751	50	0		FFAARM
O=C([O-])c1ccccc1NS(=O)(=O)c1ccc(Br)cc1	ZINC000002005602	210375934	/nfs/dbraw/zinc/37/59/34/210375934.db2.gz	RPCZXFGZZGTKIV-UHFFFAOYSA-N	-1	0	356.197	2.948	50	0		FFAARM
CCCC[C@@H](NC(=O)COc1ccc2c(C)c(C)c(=O)oc2c1)C(=O)[O-]	ZINC000002150427	210381928	/nfs/dbraw/zinc/38/19/28/210381928.db2.gz	HTMHASZKGCVGFE-OAHLLOKOSA-N	-1	0	361.394	2.548	50	0	biogenic	FFAARM
C[C@@H]1CN([C@@H](c2sc3ncnn3c2[O-])c2ccc(F)cc2)C[C@H](C)O1	ZINC000022609708	220390727	/nfs/dbraw/zinc/39/07/27/220390727.db2.gz	BESIFSPXZFVYLU-UHIISALHSA-N	-1	0	362.430	2.834	50	0		FFAARM
CNC(=O)c1ccc([N-]S(=O)(=O)c2ccc(Cl)nc2Cl)cc1	ZINC000058161946	221100345	/nfs/dbraw/zinc/10/03/45/221100345.db2.gz	HZAWVOZQXLNPSL-UHFFFAOYSA-N	-1	0	360.222	2.549	50	0		FFAARM
Cc1ccc([N-]S(=O)(=O)c2cc3c(cc2Cl)n(C)c(=O)n3C)cc1	ZINC000064976638	221160810	/nfs/dbraw/zinc/16/08/10/221160810.db2.gz	HMLYTEWOYPWYRQ-UHFFFAOYSA-N	-1	0	365.842	2.640	50	0		FFAARM
CCc1nn2c(nc(C)c2S(=O)(=O)[N-]c2ccc(F)c(C)c2)s1	ZINC000065183795	221176150	/nfs/dbraw/zinc/17/61/50/221176150.db2.gz	VDOKZMHQKPQDMR-UHFFFAOYSA-N	-1	0	354.432	2.910	50	0		FFAARM
CCC(=O)N1CCc2sc(S(=O)(=O)[N-]c3ccccc3F)cc2C1	ZINC000065196158	221178463	/nfs/dbraw/zinc/17/84/63/221178463.db2.gz	YBPOXRKKCZFTCQ-UHFFFAOYSA-N	-1	0	368.455	2.983	50	0		FFAARM
O=C(CSc1nc2[nH]c(=O)cc([O-])c2s1)Nc1ccc(F)cc1	ZINC000065365890	221203686	/nfs/dbraw/zinc/20/36/86/221203686.db2.gz	XOIXKSNFFCCJNX-UHFFFAOYSA-N	-1	0	351.384	2.560	50	0		FFAARM
O=C([O-])CSc1nnc(Cn2cccn2)n1-c1cccc2ccccc21	ZINC000065383767	221207917	/nfs/dbraw/zinc/20/79/17/221207917.db2.gz	OUGDTSZMUPIZCI-UHFFFAOYSA-N	-1	0	365.418	2.842	50	0		FFAARM
Cc1ccc(-c2nc(CNC(=O)c3cc(=O)[nH][n-]3)[nH]c2-c2ccccn2)cc1	ZINC000067758065	221281737	/nfs/dbraw/zinc/28/17/37/221281737.db2.gz	HRVSIYXPWSASOJ-UHFFFAOYSA-N	-1	0	374.404	2.806	50	0		FFAARM
COc1cc(NC(=O)[C@H]2[C@@H](C(=O)[O-])C2(C)C)ccc1NC(=O)c1ccco1	ZINC000071280379	221338425	/nfs/dbraw/zinc/33/84/25/221338425.db2.gz	XZJQARGVAKCOTF-CABCVRRESA-N	-1	0	372.377	2.836	50	0		FFAARM
COc1cccc(-c2cc(NC(=O)Cc3ccccc3C(=O)[O-])n[nH]2)c1	ZINC000071288601	221339951	/nfs/dbraw/zinc/33/99/51/221339951.db2.gz	XHMWXTPZCYYIQD-UHFFFAOYSA-N	-1	0	351.362	2.965	50	0		FFAARM
CC1(C)[C@H](C(=O)Nc2ccccc2C(=O)Nc2nccs2)[C@@H]1C(=O)[O-]	ZINC000071286567	221340041	/nfs/dbraw/zinc/34/00/41/221340041.db2.gz	FXUARFZWLTWCJT-NWDGAFQWSA-N	-1	0	359.407	2.691	50	0		FFAARM
O=C([O-])c1ccccc1CC(=O)Nc1cc(-n2cnnc2)ccc1Cl	ZINC000071286263	221340727	/nfs/dbraw/zinc/34/07/27/221340727.db2.gz	DIMUIMIDAUNXOH-UHFFFAOYSA-N	-1	0	356.769	2.800	50	0		FFAARM
COc1cccc(C[C@@]2(C(=O)[O-])CCCN(c3nc(CO)cs3)C2)c1	ZINC000071757087	221367028	/nfs/dbraw/zinc/36/70/28/221367028.db2.gz	BSCYOZFTKLZVMP-SFHVURJKSA-N	-1	0	362.451	2.558	50	0		FFAARM
CC1(C)[C@H](C(=O)Nc2ccc3c(c2)N(C(=O)C2CC2)CCC3)[C@@H]1C(=O)[O-]	ZINC000071285602	136138771	/nfs/dbraw/zinc/13/87/71/136138771.db2.gz	NHAQLKDPSRCBOA-JKSUJKDBSA-N	-1	0	356.422	2.671	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)CSc2ccncc2)C[C@H]1c1ccc(F)cc1	ZINC000091624558	221773829	/nfs/dbraw/zinc/77/38/29/221773829.db2.gz	GMDQKOAEGVQOGS-JKSUJKDBSA-N	-1	0	360.410	2.640	50	0		FFAARM
Cc1cnc(CNC(=O)c2cc(OCC3CCC3)cc(C(=O)[O-])c2)cn1	ZINC000097492522	222184173	/nfs/dbraw/zinc/18/41/73/222184173.db2.gz	KKWZTXVRYSRFAL-UHFFFAOYSA-N	-1	0	355.394	2.592	50	0		FFAARM
CC1(C)Cc2c3c(nc(N4CCCC4)c2CO1)sc1c3[n-]cnc1=O	ZINC000100815460	222254321	/nfs/dbraw/zinc/25/43/21/222254321.db2.gz	CRUNYLPVSRJZJL-UHFFFAOYSA-N	-1	0	356.451	2.984	50	0		FFAARM
CCCCn1c(=O)c([C@H]2c3ccccc3CCN2C(C)=O)c([O-])[nH]c1=S	ZINC000101009138	222259176	/nfs/dbraw/zinc/25/91/76/222259176.db2.gz	JJEKPADKTMZJJQ-MRXNPFEDSA-N	-1	0	373.478	2.906	50	0		FFAARM
CCOc1ccc(-n2c(=O)c3[n-][nH]n(Cc4cccc(C)c4)c=3c2=O)cc1	ZINC000101167842	222265458	/nfs/dbraw/zinc/26/54/58/222265458.db2.gz	APEKABPSHXGTFT-ZWKOTPCHSA-N	-1	0	364.405	2.887	50	0		FFAARM
O=c1c2[n-][nH]n(Cc3ccccc3Cl)c=2c(=O)n1-c1ccc(F)cc1	ZINC000101167819	222265633	/nfs/dbraw/zinc/26/56/33/222265633.db2.gz	RAELTFMPEFUALW-GJZGRUSLSA-N	-1	0	358.760	2.973	50	0		FFAARM
COc1ccc(Cn2[nH][n-]c3c(=O)n(-c4cccc(Cl)c4)c(=O)c2=3)cc1	ZINC000101418084	222274347	/nfs/dbraw/zinc/27/43/47/222274347.db2.gz	HUGQHDQFZAMNIF-JKSUJKDBSA-N	-1	0	370.796	2.842	50	0		FFAARM
CCc1ccc(Cn2[nH][n-]c3c(=O)n(-c4ccc(OC)cc4)c(=O)c2=3)cc1	ZINC000101418027	222274714	/nfs/dbraw/zinc/27/47/14/222274714.db2.gz	KQUZKUDZMFKZDS-QZTJIDSGSA-N	-1	0	364.405	2.751	50	0		FFAARM
CCn1c2ccccc2c2cc([C@@H]3CC(C(=O)[O-])=Nc4nnnn43)ccc21	ZINC000101675293	222281027	/nfs/dbraw/zinc/28/10/27/222281027.db2.gz	YVVXSENCXDNFDG-KRWDZBQOSA-N	-1	0	360.377	2.784	50	0		FFAARM
CCn1c(=O)c2ccc(C(=O)Oc3ccccc3OC)cc2[n-]c1=S	ZINC000102752213	222306750	/nfs/dbraw/zinc/30/67/50/222306750.db2.gz	MUTDBCNNLHJFHR-UHFFFAOYSA-N	-1	0	356.403	2.933	50	0		FFAARM
O=C([N-]S(=O)(=O)Cc1c(F)cccc1F)[C@H]1CSc2ccccc21	ZINC000132745119	222540460	/nfs/dbraw/zinc/54/04/60/222540460.db2.gz	TWOZFKRDZUOTMU-NSHDSACASA-N	-1	0	369.414	2.800	50	0		FFAARM
O=C(CCCn1c(=O)c2ccccc2[n-]c1=S)NCc1cccnc1	ZINC000002971419	263327447	/nfs/dbraw/zinc/32/74/47/263327447.db2.gz	NTDOVMVIEJAUTC-UHFFFAOYSA-N	-1	0	354.435	2.551	50	0		FFAARM
COc1cc(NC=C2C(=O)c3ccccc3C2=O)c(C(=O)[O-])cc1OC	ZINC000001017500	506243710	/nfs/dbraw/zinc/24/37/10/506243710.db2.gz	HEVFPYCJYUCDSZ-UHFFFAOYSA-N	-1	0	353.330	2.777	50	0		FFAARM
Cc1ccc(N2C(=O)[N-]C(=O)C(=Cc3cnn(-c4ccccc4)c3)C2=O)cc1	ZINC000001181334	506253991	/nfs/dbraw/zinc/25/39/91/506253991.db2.gz	MHFMDHCLGWOSGE-WOJGMQOQSA-N	-1	0	372.384	2.847	50	0		FFAARM
CCN1CCCn2cc(S(=O)(=O)[N-]c3cccc(C)c3C)cc2C1=O	ZINC000065258775	506277500	/nfs/dbraw/zinc/27/75/00/506277500.db2.gz	VPGNFTHNVILCTD-UHFFFAOYSA-N	-1	0	361.467	2.772	50	0		FFAARM
Cc1ccc([N-]S(=O)(=O)c2cc3n(c2)CCCN(C(C)C)C3=O)cc1	ZINC000065258818	506277524	/nfs/dbraw/zinc/27/75/24/506277524.db2.gz	FRHKNOHVOIFDKU-UHFFFAOYSA-N	-1	0	361.467	2.852	50	0		FFAARM
COc1ccc(CCNC(=S)Nc2ccc(C(=O)[O-])cc2)cc1OC	ZINC000002698118	506287700	/nfs/dbraw/zinc/28/77/00/506287700.db2.gz	DOGYILIAVDJCAY-UHFFFAOYSA-N	-1	0	360.435	2.931	50	0		FFAARM
O=C([O-])C[C@@H](NS(=O)(=O)c1ccc(Br)cc1)c1ccco1	ZINC000003025607	506307310	/nfs/dbraw/zinc/30/73/10/506307310.db2.gz	UKBZHPSKGDTQKI-LLVKDONJSA-N	-1	0	374.212	2.536	50	0		FFAARM
Cc1ccc(NC(=O)[C@H](C)n2nc(C(=O)[O-])c3ccccc3c2=O)cc1	ZINC000003517314	506339307	/nfs/dbraw/zinc/33/93/07/506339307.db2.gz	NKDGGFNGSXLNFN-LBPRGKRZSA-N	-1	0	351.362	2.603	50	0		FFAARM
Cc1ccc(S(=O)(=O)N[C@@H](Cc2ccc(Cl)cc2)C(=O)[O-])cc1	ZINC000004040316	506355146	/nfs/dbraw/zinc/35/51/46/506355146.db2.gz	JZOICEPXBNEDMH-HNNXBMFYSA-N	-1	0	353.827	2.623	50	0		FFAARM
COc1cc([C@H]2[C@H](C(=O)[O-])c3ccccc3C(=O)N2C)cc(OC)c1OC	ZINC000004563628	506383462	/nfs/dbraw/zinc/38/34/62/506383462.db2.gz	HZWXNYYVVCDQFJ-SJORKVTESA-N	-1	0	371.389	2.708	50	0		FFAARM
CC(=O)c1[n-]n(-c2ccccc2C)c2c(O)n(-c3ccc(C)cc3)c(=O)c1-2	ZINC000004811407	506395272	/nfs/dbraw/zinc/39/52/72/506395272.db2.gz	QFZJMGYATJXYAD-MJGOQNOKSA-N	-1	0	361.401	2.627	50	0		FFAARM
CC(=O)c1cn(CC(=O)NCc2ccc(C(=O)[O-])cc2)c2ccccc12	ZINC000036360463	506402704	/nfs/dbraw/zinc/40/27/04/506402704.db2.gz	VDMVDAXRBOJGRB-UHFFFAOYSA-N	-1	0	350.374	2.859	50	0		FFAARM
COCCn1c2nc(-c3ccc(C)cc3)cc(C(=O)[O-])c2c(=O)[nH]c1=S	ZINC000036617286	506408379	/nfs/dbraw/zinc/40/83/79/506408379.db2.gz	GVMJSZDFXVWKCF-UHFFFAOYSA-N	-1	0	371.418	2.774	50	0		FFAARM
O=C(Nc1ccc2nc3n(c(=O)c2c1)CCC3)c1c([O-])cc(F)cc1F	ZINC000066045283	506416624	/nfs/dbraw/zinc/41/66/24/506416624.db2.gz	VYKQJCDNBAURTM-UHFFFAOYSA-N	-1	0	357.316	2.579	50	0		FFAARM
COc1ccccc1C[C@H](C(=O)Nc1ccc(C)cc1C)c1nnn[n-]1	ZINC000005489120	506446351	/nfs/dbraw/zinc/44/63/51/506446351.db2.gz	HXXBQDGYZYCCTN-HNNXBMFYSA-N	-1	0	351.410	2.790	50	0		FFAARM
O=C(CC1CCCC1)Nc1ccc(S(=O)(=O)[N-]c2ncccn2)cc1	ZINC000005942160	506460848	/nfs/dbraw/zinc/46/08/48/506460848.db2.gz	NVJOLVXWNHXBMH-UHFFFAOYSA-N	-1	0	360.439	2.796	50	0		FFAARM
Cc1ccc(C)c(-n2nnnc2SCc2nc(=O)c3sccc3[n-]2)c1	ZINC000006315099	506476330	/nfs/dbraw/zinc/47/63/30/506476330.db2.gz	FEPOAZRCWUHZLM-UHFFFAOYSA-N	-1	0	370.463	2.869	50	0		FFAARM
COc1ccccc1-n1c(CNC(=O)COc2ccccc2)n[n-]c1=S	ZINC000006498192	506485919	/nfs/dbraw/zinc/48/59/19/506485919.db2.gz	DOPJRMACADNHPF-UHFFFAOYSA-N	-1	0	370.434	2.634	50	0		FFAARM
O=C([O-])c1cc(S(=O)(=O)NCc2cccnc2)c(Cl)cc1Cl	ZINC000006550023	506488062	/nfs/dbraw/zinc/48/80/62/506488062.db2.gz	KOWUPYHMTMYGSA-UHFFFAOYSA-N	-1	0	361.206	2.565	50	0		FFAARM
Cc1coc2c1c(C)cc1oc(=O)c(CC(=O)N[C@@H](C)C(=O)[O-])c(C)c21	ZINC000006624147	506492672	/nfs/dbraw/zinc/49/26/72/506492672.db2.gz	YNGLNAKQBJSSGA-NSHDSACASA-N	-1	0	357.362	2.596	50	0	biogenic	FFAARM
Cc1csc2nc(C)c(S(=O)(=O)[N-]c3ccc(F)cc3C)c(=O)n12	ZINC000006823628	506510984	/nfs/dbraw/zinc/51/09/84/506510984.db2.gz	OSLAASARFCJSRW-UHFFFAOYSA-N	-1	0	367.427	2.621	50	0		FFAARM
O=C(NC1CC1)c1ccccc1[N-]S(=O)(=O)c1c(F)cccc1F	ZINC000007054365	506529397	/nfs/dbraw/zinc/52/93/97/506529397.db2.gz	PJWMESAELRKDNO-UHFFFAOYSA-N	-1	0	352.362	2.658	50	0		FFAARM
C[C@@]1(c2ccco2)NC(=O)N([N-]C(=O)c2cc(Cl)sc2Cl)C1=O	ZINC000008748188	506666172	/nfs/dbraw/zinc/66/61/72/506666172.db2.gz	NHQFRSCSHUBYOY-ZDUSSCGKSA-N	-1	0	374.205	2.760	50	0		FFAARM
Cc1nn(CC(=O)[O-])c(C)c1NC(=O)c1cc(-n2cccn2)ccc1Cl	ZINC000055325025	506728520	/nfs/dbraw/zinc/72/85/20/506728520.db2.gz	BCNGHCUPXKJOBB-UHFFFAOYSA-N	-1	0	373.800	2.676	50	0		FFAARM
COc1ccc(S(=O)(=O)Nc2cc(C(=O)[O-])c(F)cc2F)c(C)c1	ZINC000055612183	506797287	/nfs/dbraw/zinc/79/72/87/506797287.db2.gz	AOZZHAKOKMSGOB-UHFFFAOYSA-N	-1	0	357.334	2.781	50	0		FFAARM
CCOc1ccc2nc([N-]S(=O)(=O)c3cn(C)nc3C)sc2c1	ZINC000011923771	506803010	/nfs/dbraw/zinc/80/30/10/506803010.db2.gz	YQLQAFPBTDISMP-UHFFFAOYSA-N	-1	0	352.441	2.538	50	0		FFAARM
Cn1ccnc1C(=O)c1ccc(NC(=O)CC2(C(=O)[O-])CCCC2)cc1	ZINC000012507183	506870408	/nfs/dbraw/zinc/87/04/08/506870408.db2.gz	WFHBKEYLTBXJCM-UHFFFAOYSA-N	-1	0	355.394	2.625	50	0		FFAARM
CCN1C[C@H](CN(C)Cc2nc(=O)c3sccc3[n-]2)Oc2ccccc21	ZINC000012526680	506872520	/nfs/dbraw/zinc/87/25/20/506872520.db2.gz	CQHFSISWUXOPBS-ZDUSSCGKSA-N	-1	0	370.478	2.704	50	0		FFAARM
O=C([O-])c1cc2c(cc1NS(=O)(=O)/C=C/c1ccccc1)OCCO2	ZINC000012541818	506873883	/nfs/dbraw/zinc/87/38/83/506873883.db2.gz	VBYRKRQKRUXMFC-RMKNXTFCSA-N	-1	0	361.375	2.569	50	0		FFAARM
CCc1nnc(NC(=O)CCn2c(=O)c3ccccc3[n-]c2=S)s1	ZINC000012733797	506894490	/nfs/dbraw/zinc/89/44/90/506894490.db2.gz	OLPUEPJZBRNMPO-UHFFFAOYSA-N	-1	0	361.452	2.502	50	0		FFAARM
CC1=C(C)C[C@@H](C(=O)Nc2ccc(N3CCOCC3)cc2)[C@H](C(=O)[O-])C1	ZINC000017073968	507114748	/nfs/dbraw/zinc/11/47/48/507114748.db2.gz	KYZBFBFWBZDZAH-QZTJIDSGSA-N	-1	0	358.438	2.909	50	0		FFAARM
Cc1ccc(S(=O)(=O)[N-]c2ccc(CN3C(=O)CCC3=O)cc2)s1	ZINC000028255168	507716004	/nfs/dbraw/zinc/71/60/04/507716004.db2.gz	ZKAZVASNLCIRRX-UHFFFAOYSA-N	-1	0	364.448	2.506	50	0		FFAARM
CCOc1ccc(-c2ccnc(NCc3cc(C)n[nH]3)n2)cc1C(=O)[O-]	ZINC000072418129	507786264	/nfs/dbraw/zinc/78/62/64/507786264.db2.gz	SYMIFLCSZGZNCT-UHFFFAOYSA-N	-1	0	353.382	2.884	50	0		FFAARM
O=C1CCCN1Cc1cccc([N-]S(=O)(=O)c2ccc(F)cc2F)c1	ZINC000030531208	507809939	/nfs/dbraw/zinc/80/99/39/507809939.db2.gz	IPHOENHIGGBNRV-UHFFFAOYSA-N	-1	0	366.389	2.888	50	0		FFAARM
COCC[C@@]1(C(=O)[O-])CCCN(C(=O)c2scc3c2CCCC3)C1	ZINC000091320290	507980253	/nfs/dbraw/zinc/98/02/53/507980253.db2.gz	QCZWECNQEHWGAO-SFHVURJKSA-N	-1	0	351.468	2.970	50	0		FFAARM
Cc1cc(N2CCC[C@]3(CNC(=O)O3)CC2)nc(-c2ccccc2[O-])n1	ZINC000091381695	507982906	/nfs/dbraw/zinc/98/29/06/507982906.db2.gz	RLEVIEXEUXOYHO-LJQANCHMSA-N	-1	0	354.410	2.627	50	0		FFAARM
CCc1ccccc1C(=O)N1CCC2(CCC(=O)N([C@@H](C)C(=O)[O-])C2)CC1	ZINC000091860757	508020416	/nfs/dbraw/zinc/02/04/16/508020416.db2.gz	IYOKNWCJOBREBJ-HNNXBMFYSA-N	-1	0	372.465	2.567	50	0		FFAARM
O=C([O-])c1ccc(CCNC(=O)c2c[nH]nc2-c2cccc(F)c2)cc1	ZINC000095367438	508177892	/nfs/dbraw/zinc/17/78/92/508177892.db2.gz	YRMIUANJRPWMPI-UHFFFAOYSA-N	-1	0	353.353	2.887	50	0		FFAARM
Cc1nc(CC(=O)N2Cc3[nH]c4ccccc4c3C[C@H]2C(=O)[O-])cs1	ZINC000095380416	508180434	/nfs/dbraw/zinc/18/04/34/508180434.db2.gz	RJEJYFLHRTVNQB-INIZCTEOSA-N	-1	0	355.419	2.513	50	0		FFAARM
CC1=NN(c2ccc(C(=O)N[C@@H](C(=O)[O-])c3ccccc3F)cc2)CC1	ZINC000095464035	508187280	/nfs/dbraw/zinc/18/72/80/508187280.db2.gz	VGIPHNPHTANOOA-QGZVFWFLSA-N	-1	0	355.369	2.967	50	0		FFAARM
O=C([O-])c1ccc(=O)n(CC(=O)Nc2cc(C(F)(F)F)ccc2Cl)c1	ZINC000095471827	508187946	/nfs/dbraw/zinc/18/79/46/508187946.db2.gz	SZGOSUUGLLQFQI-UHFFFAOYSA-N	-1	0	374.702	2.857	50	0		FFAARM
COCCn1ccc2cc(C(=O)N=c3[n-]c(C(=O)OC)c(C)s3)ccc21	ZINC000095479178	508188893	/nfs/dbraw/zinc/18/88/93/508188893.db2.gz	AMHGTGQLDYNFMA-UHFFFAOYSA-N	-1	0	373.434	3.092	50	0		FFAARM
O=C([O-])[C@H]1Cc2[nH]cnc2CN1C(=O)c1ccc(-c2ccccc2Cl)o1	ZINC000095520335	508194826	/nfs/dbraw/zinc/19/48/26/508194826.db2.gz	YKPBQUHOGQKDED-CQSZACIVSA-N	-1	0	371.780	2.975	50	0		FFAARM
CCOc1cc(S(=O)(=O)[N-]c2cc(C)ccn2)c(OCC)cc1C	ZINC000095946077	508198719	/nfs/dbraw/zinc/19/87/19/508198719.db2.gz	PAHYYFQLQWXCJK-UHFFFAOYSA-N	-1	0	350.440	3.297	50	0		FFAARM
C[C@H]1CCN(S(=O)(=O)[N-]c2cc(Cl)ccc2C(=O)N2CCCC2)C1	ZINC000095993783	508200563	/nfs/dbraw/zinc/20/05/63/508200563.db2.gz	YJPXLVKUBLGNER-LBPRGKRZSA-N	-1	0	371.890	2.575	50	0		FFAARM
Cc1nc2c(c(=O)[nH]1)CC[N@H+](Cc1ccc3cccc(Cl)c3n1)CC2	ZINC000216500447	509261600	/nfs/dbraw/zinc/26/16/00/509261600.db2.gz	XSPITAFUBWWCIG-UHFFFAOYSA-N	-1	0	354.841	2.881	50	0		FFAARM
O=C(NCCOc1cccc2cccnc21)c1cc(=O)n(-c2ccccc2)[n-]1	ZINC000220203402	509298057	/nfs/dbraw/zinc/29/80/57/509298057.db2.gz	OOGKYAUZNCYJDH-UHFFFAOYSA-N	-1	0	374.400	2.523	50	0		FFAARM
Cc1nn(CC(C)C)c(C)c1CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)[O-]	ZINC000236626346	509466812	/nfs/dbraw/zinc/46/68/12/509466812.db2.gz	YNWOZNCOWPQLRG-LJQANCHMSA-N	-1	0	369.465	2.737	50	0		FFAARM
CC(C)[S@@](=O)c1ccc(C(=O)N2Cc3ccccc3C[C@@H]2C(=O)[O-])cc1	ZINC000236700336	509485081	/nfs/dbraw/zinc/48/50/81/509485081.db2.gz	YNYMCDXUNWAQFN-WXTAPIANSA-N	-1	0	371.458	2.854	50	0		FFAARM
COCCn1c(C)c(C)c2cc(C(=O)N3CC[C@@](C)(C(=O)[O-])C3)ccc21	ZINC000237133784	509579284	/nfs/dbraw/zinc/57/92/84/509579284.db2.gz	MCHGIQCSSSCPEO-HXUWFJFHSA-N	-1	0	358.438	2.841	50	0		FFAARM
COc1ccc(CCC(=O)N2CCC(C(=O)[O-])CC2)cc1Br	ZINC000237185967	509589958	/nfs/dbraw/zinc/58/99/58/509589958.db2.gz	QRLCEJLPTWBNRG-UHFFFAOYSA-N	-1	0	370.243	2.714	50	0		FFAARM
COc1ccc(CCC(=O)N2CCCC[C@@H]2C(=O)[O-])cc1Br	ZINC000237186181	509590142	/nfs/dbraw/zinc/59/01/42/509590142.db2.gz	MCZSBZCXCLRPDB-CYBMUJFWSA-N	-1	0	370.243	2.856	50	0		FFAARM
C[C@@H]1CN(Cc2ccc(C(=O)NC3CCC(C(=O)[O-])CC3)cc2)C[C@@H](C)O1	ZINC000237415575	509641441	/nfs/dbraw/zinc/64/14/41/509641441.db2.gz	BGOMWBUOUBRHSJ-QAQJPARQSA-N	-1	0	374.481	2.669	50	0		FFAARM
C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N1CCO[C@H](CC(=O)[O-])C1	ZINC000237528561	509671485	/nfs/dbraw/zinc/67/14/85/509671485.db2.gz	GDRYTECYSNFNTB-SMDDNHRTSA-N	-1	0	359.344	2.586	50	0		FFAARM
CCCCC[C@H](NC(=O)[C@H]1CCCN(C(=O)c2ccccc2)C1)C(=O)[O-]	ZINC000170592112	509674166	/nfs/dbraw/zinc/67/41/66/509674166.db2.gz	QOZOFHGPWOJWST-IRXDYDNUSA-N	-1	0	360.454	2.689	50	0		FFAARM
COc1ccccc1CNC(=O)c1c([O-])c2cccc3c2n(c1=O)[C@@H](C)C3	ZINC000170624696	509682978	/nfs/dbraw/zinc/68/29/78/509682978.db2.gz	CUSZYVLZUUIPEX-LBPRGKRZSA-N	-1	0	364.401	2.763	50	0		FFAARM
Cc1cc(C(=O)N2CCO[C@H](C(=O)[O-])C2)c(C)n1[C@@H](C)c1ccccc1	ZINC000237638802	509698032	/nfs/dbraw/zinc/69/80/32/509698032.db2.gz	OPYIERXDAYTHAS-KSSFIOAISA-N	-1	0	356.422	2.640	50	0		FFAARM
Cc1nc2ccccc2c(C)c1CC(=O)N(CCC(=O)[O-])C[C@H]1CCCO1	ZINC000237751349	509726410	/nfs/dbraw/zinc/72/64/10/509726410.db2.gz	MEDFDUCSNGNWPZ-MRXNPFEDSA-N	-1	0	370.449	2.876	50	0		FFAARM
Cc1nn(-c2ccccc2)c(C)c1/C=C/C(=O)N1CC[C@@](C)(C(=O)[O-])C1	ZINC000237825513	509743338	/nfs/dbraw/zinc/74/33/38/509743338.db2.gz	JJKDXGUXRIGTSF-SQUSKLHYSA-N	-1	0	353.422	2.826	50	0		FFAARM
Cc1ccc2cc(C(=O)N(CCC(=O)[O-])C[C@H]3CCCO3)c(C)nc2c1	ZINC000237887286	509762699	/nfs/dbraw/zinc/76/26/99/509762699.db2.gz	UFERAIMKVVJIHF-MRXNPFEDSA-N	-1	0	356.422	2.948	50	0		FFAARM
O=C([O-])[C@H]1Cc2ccccc2CN1C(=O)Cc1coc(-c2cccs2)n1	ZINC000238032031	509805013	/nfs/dbraw/zinc/80/50/13/509805013.db2.gz	BMJUBHGPXPWESR-OAHLLOKOSA-N	-1	0	368.414	2.984	50	0		FFAARM
O=C([O-])CCN(C[C@@H]1CCCO1)C(=O)[C@@H]1C[C@@H]1c1c(F)cccc1F	ZINC000238089006	509817946	/nfs/dbraw/zinc/81/79/46/509817946.db2.gz	CCHKOIYYXZQFDD-RWMBFGLXSA-N	-1	0	353.365	2.551	50	0		FFAARM
CCOCCOc1ccccc1C(=O)N1Cc2ccccc2C[C@@H]1C(=O)[O-]	ZINC000244858571	509874363	/nfs/dbraw/zinc/87/43/63/509874363.db2.gz	VNPNQTVODDVQTP-GOSISDBHSA-N	-1	0	369.417	2.754	50	0		FFAARM
COc1ccc(CCC(=O)N2Cc3ccccc3C[C@@H]2C(=O)[O-])cc1OC	ZINC000262410078	510271868	/nfs/dbraw/zinc/27/18/68/510271868.db2.gz	NWOQLXFVYYTQDM-QGZVFWFLSA-N	-1	0	369.417	2.675	50	0		FFAARM
COc1cccc([C@@H]2CN(C(=O)c3ccc(C(=O)[O-])cc3F)CCO2)c1	ZINC000263550237	510745858	/nfs/dbraw/zinc/74/58/58/510745858.db2.gz	WBFJVOCPHCYYHR-KRWDZBQOSA-N	-1	0	359.353	2.746	50	0		FFAARM
CCOc1c(Cl)cc(/C=C/C(=O)N2CCC[C@H]2C(=O)[O-])cc1OC	ZINC000299268390	511572140	/nfs/dbraw/zinc/57/21/40/511572140.db2.gz	KIKLSTSLORVKDF-YBJDMEARSA-N	-1	0	353.802	2.836	50	0		FFAARM
O=C([O-])CCN(C[C@H]1CCCO1)C(=O)c1ccc(OC(F)(F)F)cc1	ZINC000299753697	511668207	/nfs/dbraw/zinc/66/82/07/511668207.db2.gz	YZKWKGUCBHPUDZ-CYBMUJFWSA-N	-1	0	361.316	2.681	50	0		FFAARM
C[C@@H](Oc1ccc(F)cc1Cl)C(=O)N(CCC(=O)[O-])C1CCOCC1	ZINC000299751668	511668507	/nfs/dbraw/zinc/66/85/07/511668507.db2.gz	RGIFUOMPMBSQQG-LLVKDONJSA-N	-1	0	373.808	2.729	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)C[C@H]1CCOC1)c1cccc(Br)c1	ZINC000299753901	511668667	/nfs/dbraw/zinc/66/86/67/511668667.db2.gz	ZSJITYGKWVAYCY-MFKMUULPSA-N	-1	0	356.216	2.508	50	0		FFAARM
O=C([O-])c1cccc(C[C@@H]2CCN(C(=O)c3onc4c3CCCC4)C2)c1	ZINC000426701778	514018892	/nfs/dbraw/zinc/01/88/92/514018892.db2.gz	YDKMOHJSYGGQSI-AWEZNQCLSA-N	-1	0	354.406	2.956	50	0		FFAARM
Cc1ccc(S[C@H](C)C(=O)NCCc2nc(C(=O)[O-])cs2)cc1	ZINC000455887234	514813010	/nfs/dbraw/zinc/81/30/10/514813010.db2.gz	HZVZOCWNJNNZRN-LLVKDONJSA-N	-1	0	350.465	2.989	50	0		FFAARM
O=C([O-])C1CCC(NC(=O)c2cnn(Cc3ccccc3Cl)c2)CC1	ZINC000299745038	518201283	/nfs/dbraw/zinc/20/12/83/518201283.db2.gz	QVWZSOREZUERPG-UHFFFAOYSA-N	-1	0	361.829	2.958	50	0		FFAARM
COc1ccc(C(=O)[O-])nc1-c1cccc(C(=O)NCC2CCOCC2)c1	ZINC000584894709	518528357	/nfs/dbraw/zinc/52/83/57/518528357.db2.gz	QTYATKYQHYPKGE-UHFFFAOYSA-N	-1	0	370.405	2.612	50	0		FFAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)/C=C\c2cnn(-c3ccccc3)c2)C1	ZINC000606445202	521070175	/nfs/dbraw/zinc/07/01/75/521070175.db2.gz	PTKKUIDMXRPKQS-YHWKNFMLSA-N	-1	0	353.422	2.989	50	0		FFAARM
CC[C@](NC(=O)/C=C\c1ccc(C(=O)NC)cc1)(C(=O)[O-])c1ccccc1	ZINC000606445190	521070424	/nfs/dbraw/zinc/07/04/24/521070424.db2.gz	DQFHRJUMXCNPOH-YXAHYSCSSA-N	-1	0	366.417	2.566	50	0		FFAARM
COc1ccc([C@@H](CC(=O)[O-])NC(=O)[C@@H]2COc3ccccc32)cc1OC	ZINC000268942232	525174197	/nfs/dbraw/zinc/17/41/97/525174197.db2.gz	LQAZKYSMDPYLAM-HUUCEWRRSA-N	-1	0	371.389	2.512	50	0		FFAARM
O=C([O-])[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1cc(=O)[nH]c2cc(F)ccc21	ZINC000262342567	526290551	/nfs/dbraw/zinc/29/05/51/526290551.db2.gz	GHMIKGPMGGVJMS-JQAFLVLXSA-N	-1	0	358.369	2.937	50	0		FFAARM
O=C([O-])c1ccc(CNC(=O)[C@H]2C[C@H]2c2ccc3c(c2)OCCO3)cc1	ZINC000268943893	526367278	/nfs/dbraw/zinc/36/72/78/526367278.db2.gz	NOZSCKXCFJBBJB-HOTGVXAUSA-N	-1	0	353.374	2.576	50	0		FFAARM
CCC(NCCc1ccccc1)=C1C(=O)[N-]C(=O)N(c2ccccc2)C1=O	ZINC000001287782	535227521	/nfs/dbraw/zinc/22/75/21/535227521.db2.gz	SUORTWCISXTKKM-ISLYRVAYSA-N	-1	0	363.417	2.766	50	0		FFAARM
Cc1ccccc1S(=O)(=O)[N-]C(=O)c1cc(Cl)c2c(c1)OCCO2	ZINC000042242092	538135074	/nfs/dbraw/zinc/13/50/74/538135074.db2.gz	UAOIZJKKOLZVOQ-UHFFFAOYSA-N	-1	0	367.810	2.538	50	0		FFAARM
COC(=O)C[C@H](c1ccc(Cl)cc1)c1c(=O)nc2ccccn2c1[O-]	ZINC000205976324	570555089	/nfs/dbraw/zinc/55/50/89/570555089.db2.gz	ZKAISWBXSGUSNL-CYBMUJFWSA-N	-1	0	358.781	2.749	50	0		FFAARM
O=C(Nc1ccc(Br)cc1)C([O-])=C1C(=O)Nc2ccccc21	ZINC000102134330	570827302	/nfs/dbraw/zinc/82/73/02/570827302.db2.gz	QTGZPYFSHFTQMA-CYBMUJFWSA-N	-1	0	359.179	2.693	50	0		FFAARM
Cc1nc(C)n(-c2ccc(C(=O)N3[C@H](C(=O)[O-])C[C@H]4CCCC[C@@H]43)cc2)n1	ZINC000108377560	570906166	/nfs/dbraw/zinc/90/61/66/570906166.db2.gz	BCRWEPCBZUZZOZ-NJAFHUGGSA-N	-1	0	368.437	2.742	50	0		FFAARM
Cc1cccc([N-]S(=O)(=O)c2cc(Br)c(C)cc2C)n1	ZINC000041096173	571097018	/nfs/dbraw/zinc/09/70/18/571097018.db2.gz	ZBBQIPLDGKXPJQ-UHFFFAOYSA-N	-1	0	355.257	3.570	50	0		FFAARM
COc1ccccc1-c1nc(CC(=O)N[C@H](CC(C)C)C(=O)[O-])cs1	ZINC000085432451	571115492	/nfs/dbraw/zinc/11/54/92/571115492.db2.gz	SZLLQGPMXSWXHT-CQSZACIVSA-N	-1	0	362.451	2.977	50	0		FFAARM
O=C([O-])C1CCC(NC(=O)N2CCO[C@@H](c3ccc(F)c(F)c3)C2)CC1	ZINC000263487719	600031839	/nfs/dbraw/zinc/03/18/39/600031839.db2.gz	PYHDDZZNPAVODF-IJGSQOGDSA-N	-1	0	368.380	2.691	50	0		FFAARM
Cc1ccc(-n2nc(C(=O)N(CC(=O)[O-])C(C)C)c3c2CCC3)c(C)c1	ZINC000194947098	600037873	/nfs/dbraw/zinc/03/78/73/600037873.db2.gz	RCAIETZCAZWMEH-UHFFFAOYSA-N	-1	0	355.438	2.913	50	0		FFAARM
COc1ccc(NCC(=O)NN=C(CCC(=O)[O-])c2cccs2)cc1	ZINC000254501238	729626670	/nfs/dbraw/zinc/62/66/70/729626670.db2.gz	MREJTZYTFFDTFY-UHFFFAOYSA-N	-1	0	361.423	2.554	50	0		FFAARM
Cc1csc([C@H](NC(=O)NC2CCC(C(=O)[O-])CC2)C(F)(F)F)n1	ZINC000262986234	729675812	/nfs/dbraw/zinc/67/58/12/729675812.db2.gz	CSPHTURXNPNVIO-RTBKNWGFSA-N	-1	0	365.377	2.998	50	0		FFAARM
O=C([O-])[C@@H](NC(=O)[C@@H]1C[C@H]1c1cccc(C(F)(F)F)c1)[C@@H]1CCCOC1	ZINC000262705297	939066762	/nfs/dbraw/zinc/06/67/62/939066762.db2.gz	AKOKVMLNINLOGP-BEAPCOKYSA-N	-1	0	371.355	2.805	50	0		FFAARM
O=C([O-])c1ccccc1OCCN1CCN(C(=O)CC2CCCCC2)CC1	ZINC000183920185	964088061	/nfs/dbraw/zinc/08/80/61/964088061.db2.gz	MJZIVAZYLYHYRK-UHFFFAOYSA-N	-1	0	374.481	2.878	50	0		FFAARM
O=C([O-])c1ccc(C(=O)Nc2cccc(NC(=O)[C@H]3CCCO3)c2)cc1	ZINC000002880708	966684505	/nfs/dbraw/zinc/68/45/05/966684505.db2.gz	PCZRIWQYMATSJL-MRXNPFEDSA-N	-1	0	354.362	2.755	50	0		FFAARM
O=C([O-])COc1ccc(Cl)cc1CN1CCN(c2ccccc2)C(=O)C1	ZINC000082134193	979437409	/nfs/dbraw/zinc/43/74/09/979437409.db2.gz	QSMDEHBNODATIP-UHFFFAOYSA-N	-1	0	374.824	2.652	50	0		FFAARM
CO[C@@H]1C[C@H](CC(=O)[O-])N(C(=O)[C@H]2C[C@H]2c2cccc(C(F)(F)F)c2)C1	ZINC000263205106	980557173	/nfs/dbraw/zinc/55/71/73/980557173.db2.gz	ZAWKBQIDLVBQEO-KBXIAJHMSA-N	-1	0	371.355	2.900	50	0		FFAARM
O=C([O-])c1cnc(N[C@@H]2COCC[C@H]2OCc2ccccn2)c(Cl)c1	ZINC000825504437	999327212	/nfs/dbraw/zinc/32/72/12/999327212.db2.gz	WACUELMPTDRURO-HUUCEWRRSA-N	-1	0	363.801	2.614	50	0		FFAARM
C[C@H](NC(=O)Nc1cc([C@@H]2CCCO2)nn1C)[C@@H]1C[C@H](C(=O)[O-])C1(C)C	ZINC000653544345	1024938505	/nfs/dbraw/zinc/93/85/05/1024938505.db2.gz	URRLZDQHKFVBDN-FMSGJZPZSA-N	-1	0	364.446	2.529	50	0		FFAARM
COc1ccc(Cl)cc1[C@@H](C(=O)[O-])N(C)Cc1nncn1C(C)C	ZINC001506413197	1059504821	/nfs/dbraw/zinc/50/48/21/1059504821.db2.gz	IHQZLHKEWROLOW-HNNXBMFYSA-N	-1	0	352.822	2.779	50	0		FFAARM
O=C([O-])c1ccccc1Nc1nc(N2CCCC2)nc(N2CCCC2)n1	ZINC000000689905	210262875	/nfs/dbraw/zinc/26/28/75/210262875.db2.gz	SOQONSYEZMRCAS-UHFFFAOYSA-N	-1	0	354.414	2.514	50	0		FFAARM
Cc1cc(=O)oc2cc(OCC(=O)Nc3cccc(C(=O)[O-])c3)ccc12	ZINC000001061009	210224387	/nfs/dbraw/zinc/22/43/87/210224387.db2.gz	NLZSPGQQXTYWSD-UHFFFAOYSA-N	-1	0	353.330	2.817	50	0	biogenic	FFAARM
COC(=O)C[C@@H](c1ccc(C(=O)[O-])cc1)c1oc2ccccc2c(=O)c1O	ZINC000253413255	210215220	/nfs/dbraw/zinc/21/52/20/210215220.db2.gz	UHAUKBFVWCFPQP-AWEZNQCLSA-N	-1	0	368.341	2.892	50	0	biogenic	FFAARM
Cc1ccccc1CSCC(=O)NCCc1nc(C(=O)[O-])cs1	ZINC000221262255	222722954	/nfs/dbraw/zinc/72/29/54/222722954.db2.gz	MDCHNYJAGYBRID-UHFFFAOYSA-N	-1	0	350.465	2.742	50	0		FFAARM
COc1ccc(-c2noc(CN3[C@@H]4CCCC[C@H]4C[C@H]3C(=O)[O-])n2)cc1	ZINC000294297821	210102517	/nfs/dbraw/zinc/10/25/17/210102517.db2.gz	WBMRMVTXYPCSOD-IMJJTQAJSA-N	-1	0	357.410	2.963	50	0		FFAARM
COc1c(Br)c(C)sc1C(=O)N1CCC[C@@H](C(=O)[O-])C1	ZINC000136114187	210090175	/nfs/dbraw/zinc/09/01/75/210090175.db2.gz	KFSIUOSWHXOQOV-MRVPVSSYSA-N	-1	0	362.245	2.764	50	0		FFAARM
COc1ccccc1NC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)[O-]	ZINC000002146330	219429969	/nfs/dbraw/zinc/42/99/69/219429969.db2.gz	VPPZUXGKYBZGKK-INIZCTEOSA-N	-1	0	353.378	2.994	50	0	biogenic	FFAARM
O=C([O-])[C@H]1CCCC[C@H]1C(=O)NCCc1csc(-c2cccnc2)n1	ZINC000004167051	219551645	/nfs/dbraw/zinc/55/16/45/219551645.db2.gz	IFNJJJMFBFRHGX-CABCVRRESA-N	-1	0	359.451	2.755	50	0		FFAARM
COc1cc(NS(=O)(=O)c2ccc(C)c(C)c2)c(C(=O)[O-])cc1OC	ZINC000012541781	220004311	/nfs/dbraw/zinc/00/43/11/220004311.db2.gz	OBJFRKUNUWBFOP-UHFFFAOYSA-N	-1	0	365.407	2.820	50	0		FFAARM
Cc1cc(C(=O)[O-])c(O)c(S(=O)(=O)Nc2ccc(F)cc2Cl)c1	ZINC000058368339	212006914	/nfs/dbraw/zinc/00/69/14/212006914.db2.gz	OKAUSRRGAYKIAQ-UHFFFAOYSA-N	-1	0	359.762	2.992	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)CCNC(=O)C1CCCC1)c1ccccc1Cl	ZINC000058131489	211986157	/nfs/dbraw/zinc/98/61/57/211986157.db2.gz	JCPBXMKMODNONN-HNNXBMFYSA-N	-1	0	366.845	2.669	50	0		FFAARM
CS(=O)(=O)c1ccc(NC(=O)CC2(C(=O)[O-])CCCCCC2)cc1	ZINC000013255261	220062555	/nfs/dbraw/zinc/06/25/55/220062555.db2.gz	NYXQDINUNUWINX-UHFFFAOYSA-N	-1	0	353.440	2.844	50	0		FFAARM
COc1ccc(S(=O)(=O)Nc2c(C)cccc2C(=O)[O-])cc1OC	ZINC000013464629	220068613	/nfs/dbraw/zinc/06/86/13/220068613.db2.gz	JBKKAKKFJFPXFZ-UHFFFAOYSA-N	-1	0	351.380	2.511	50	0		FFAARM
COc1ccc2c(c1)OC[C@@H](C(=O)N(C)Cc1cc(C(=O)[O-])c(C)o1)C2	ZINC000299750899	211834883	/nfs/dbraw/zinc/83/48/83/211834883.db2.gz	ORMZWDGIULRITN-ZDUSSCGKSA-N	-1	0	359.378	2.505	50	0		FFAARM
O=C([O-])C[C@H]1CN(C(=O)c2ccc(Oc3cccc(F)c3)cc2)CCO1	ZINC000299749891	211830863	/nfs/dbraw/zinc/83/08/63/211830863.db2.gz	LZCWVFCMQUHCSN-KRWDZBQOSA-N	-1	0	359.353	2.934	50	0		FFAARM
O=C([O-])c1cc(C(=O)N2CCOc3ccccc3C2)n(-c2ccccc2)n1	ZINC000299744415	211823953	/nfs/dbraw/zinc/82/39/53/211823953.db2.gz	OQUCBCNBHRSKRI-UHFFFAOYSA-N	-1	0	363.373	2.605	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)c2ccc3c(c2)NC(=O)CS3)c2ccccc21	ZINC000299741577	211822446	/nfs/dbraw/zinc/82/24/46/211822446.db2.gz	GNXKCBOKVMTBBT-GFCCVEGCSA-N	-1	0	354.387	2.559	50	0		FFAARM
Cc1cccc(CSc2ncc(Cl)c(C(=O)NCC(=O)[O-])n2)c1	ZINC000041154537	211771512	/nfs/dbraw/zinc/77/15/12/211771512.db2.gz	HBMCWFSIHBSOIM-UHFFFAOYSA-N	-1	0	351.815	2.545	50	0		FFAARM
O=C([O-])[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1cnn(Cc2ccccc2)c1	ZINC000299327656	211770533	/nfs/dbraw/zinc/77/05/33/211770533.db2.gz	BNIDNLXXOAFNAI-NJAFHUGGSA-N	-1	0	353.422	2.789	50	0		FFAARM
CC1CCC2(CC1)NC(=O)N([N-]C(=O)c1cc(Cl)ccc1F)C2=O	ZINC000018038689	220221135	/nfs/dbraw/zinc/22/11/35/220221135.db2.gz	FLSXLDXUSMQZBT-UHFFFAOYSA-N	-1	0	353.781	2.625	50	0		FFAARM
O=C(Nc1cc(=O)nc2[n-]c(COc3ccccc3)nn21)c1ccccc1	ZINC000016956937	211173325	/nfs/dbraw/zinc/17/33/25/211173325.db2.gz	OQEPJMBTHSUQQN-UHFFFAOYSA-N	-1	0	361.361	2.661	50	0		FFAARM
CCn1c(=O)c2ccc(C(=O)NCc3ccc(C)cc3)cc2[n-]c1=S	ZINC000016645147	211165017	/nfs/dbraw/zinc/16/50/17/211165017.db2.gz	VWYBCHAGRDCLLF-UHFFFAOYSA-N	-1	0	353.447	2.944	50	0		FFAARM
O=C([O-])c1cc(S(=O)(=O)NC2CCCCC2)ccc1Br	ZINC000037300690	211094416	/nfs/dbraw/zinc/09/44/16/211094416.db2.gz	AMAIBGYHZCOXEK-UHFFFAOYSA-N	-1	0	362.245	2.758	50	0		FFAARM
CC(=O)N1CCc2cc(C(=O)N[C@H](CC(=O)[O-])c3cccs3)ccc21	ZINC000013390009	211031862	/nfs/dbraw/zinc/03/18/62/211031862.db2.gz	NVUMCFXCLPBSSG-CQSZACIVSA-N	-1	0	358.419	2.603	50	0		FFAARM
CC(=O)N1CCc2cc(NC(=O)C[C@](C)(C(=O)[O-])c3ccccc3)ccc21	ZINC000013468097	211033922	/nfs/dbraw/zinc/03/39/22/211033922.db2.gz	ZMSPXTDQBCEKQM-NRFANRHFSA-N	-1	0	366.417	2.967	50	0		FFAARM
CC(C)Cn1c(=O)cc([O-])nc1SCC(=O)Nc1ccccc1Cl	ZINC000013040421	211023390	/nfs/dbraw/zinc/02/33/90/211023390.db2.gz	WYRFUASLHBAMRV-UHFFFAOYSA-N	-1	0	367.858	2.989	50	0		FFAARM
CCc1c(C)nc2c(-c3ccc(OC)c(OC)c3)c(COC)[n-]n2c1=O	ZINC000009261131	210823826	/nfs/dbraw/zinc/82/38/26/210823826.db2.gz	JTRZJGRPBGCHMZ-UHFFFAOYSA-N	-1	0	357.410	2.724	50	0		FFAARM
Nc1nc(SCC(=O)Nc2cccc(C(F)(F)F)c2)ncc1C(=O)[O-]	ZINC000004414378	210529906	/nfs/dbraw/zinc/52/99/06/210529906.db2.gz	HOXBISWVJMKQDI-UHFFFAOYSA-N	-1	0	372.328	2.507	50	0		FFAARM
O=C([O-])C[C@H](NS(=O)(=O)c1ccc(Br)cc1)c1ccco1	ZINC000003025609	210445528	/nfs/dbraw/zinc/44/55/28/210445528.db2.gz	UKBZHPSKGDTQKI-NSHDSACASA-N	-1	0	374.212	2.536	50	0		FFAARM
COc1ccc(C(=O)Nc2ccccc2C(=O)NCCCC(=O)[O-])cc1	ZINC000002137347	210379650	/nfs/dbraw/zinc/37/96/50/210379650.db2.gz	WFOSLZPLFCAXQZ-UHFFFAOYSA-N	-1	0	356.378	2.542	50	0	biogenic	FFAARM
CCCCOC(=O)Nc1ccc(S(=O)(=O)[N-]c2ncccn2)cc1	ZINC000001770713	210369504	/nfs/dbraw/zinc/36/95/04/210369504.db2.gz	LKRPDYLXZDXORB-UHFFFAOYSA-N	-1	0	350.400	2.626	50	0		FFAARM
Cc1ccc(NS(=O)(=O)c2c[nH]c(C(=O)[O-])c2)c(Br)c1	ZINC000019978525	220309291	/nfs/dbraw/zinc/30/92/91/220309291.db2.gz	DGFLXSSNWGEKLB-UHFFFAOYSA-N	-1	0	359.201	2.585	50	0		FFAARM
CCN1CCN([C@H](c2cccs2)c2sc3nc(C)nn3c2[O-])CC1	ZINC000020216032	220319257	/nfs/dbraw/zinc/31/92/57/220319257.db2.gz	DTLHFNMTISVOMG-CYBMUJFWSA-N	-1	0	363.512	2.593	50	0		FFAARM
COc1ccc(OC)c(S(=O)(=O)[N-]c2cc(OC)cc(OC)c2)c1	ZINC000001146817	210324446	/nfs/dbraw/zinc/32/44/46/210324446.db2.gz	STYAIIJOWYEEMW-UHFFFAOYSA-N	-1	0	353.396	2.522	50	0		FFAARM
CC1=C(C)C[C@H](C(=O)N2CCN(Cc3ccccc3)CC2)[C@H](C(=O)[O-])C1	ZINC000000894855	210288185	/nfs/dbraw/zinc/28/81/85/210288185.db2.gz	HQKSZMPYLDTIRF-RBUKOAKNSA-N	-1	0	356.466	2.778	50	0		FFAARM
COc1cc(C(=O)N/C(=C/c2ccccc2)C(=O)[O-])cc(OC)c1OC	ZINC000000868178	210284141	/nfs/dbraw/zinc/28/41/41/210284141.db2.gz	PVKXMGUXMCAGJM-NTEUORMPSA-N	-1	0	357.362	2.568	50	0	biogenic	FFAARM
O=C(Nc1ccc(S(=O)(=O)[N-]c2nccs2)cc1)c1cccnc1	ZINC000000822432	210276175	/nfs/dbraw/zinc/27/61/75/210276175.db2.gz	FMYCZWKBVIMWHI-UHFFFAOYSA-N	-1	0	360.420	2.591	50	0		FFAARM
O=C([O-])[C@@H]1CC=CC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCCCC2)c1	ZINC000000794640	210271544	/nfs/dbraw/zinc/27/15/44/210271544.db2.gz	XMSLPTJAWDQIRU-DLBZAZTESA-N	-1	0	356.422	2.918	50	0		FFAARM
Cc1ccccc1C(=O)Nc1ccc(S(=O)(=O)[N-]c2ncccn2)cc1	ZINC000000800956	210272455	/nfs/dbraw/zinc/27/24/55/210272455.db2.gz	GKIQGKNRRSDJOA-UHFFFAOYSA-N	-1	0	368.418	2.838	50	0		FFAARM
CCc1nc2sc([C@H](c3ccc(C)cc3)N3CCN(C)CC3)c([O-])n2n1	ZINC000022577884	220390548	/nfs/dbraw/zinc/39/05/48/220390548.db2.gz	XGKXOOAIEPFJHG-INIZCTEOSA-N	-1	0	371.510	2.704	50	0		FFAARM
Cc1ccc(CN(C(=O)c2ccc3c(=O)[nH]c(=S)[n-]c3c2)C2CC2)o1	ZINC000065476394	221224220	/nfs/dbraw/zinc/22/42/20/221224220.db2.gz	ADOQHOABZJLXPV-UHFFFAOYSA-N	-1	0	355.419	2.918	50	0		FFAARM
CC(C)(C)C(=O)N1CCc2c(c(C(=O)[O-])nn2Cc2ccc(F)cc2)C1	ZINC000067842533	221292241	/nfs/dbraw/zinc/29/22/41/221292241.db2.gz	NJIYUXDVUSYZPX-UHFFFAOYSA-N	-1	0	359.401	2.700	50	0		FFAARM
CC1(C)[C@H](C(=O)Nc2cc(Cl)ccc2C(=O)N2CCCC2)[C@@H]1C(=O)[O-]	ZINC000071285647	221339652	/nfs/dbraw/zinc/33/96/52/221339652.db2.gz	NUVHWRWGGRJMPG-UONOGXRCSA-N	-1	0	364.829	2.871	50	0		FFAARM
O=C([O-])c1ccc([C@H]2CCN(C(=O)c3cccc(-n4cnnc4)c3)C2)cc1	ZINC000072162628	221438664	/nfs/dbraw/zinc/43/86/64/221438664.db2.gz	PSTUYBZIRBFLQB-KRWDZBQOSA-N	-1	0	362.389	2.595	50	0		FFAARM
C[C@]([N-]S(=O)(=O)c1cnc2n1CCC2)(c1ccccc1)C(F)(F)F	ZINC000328614148	258116438	/nfs/dbraw/zinc/11/64/38/258116438.db2.gz	QWXCCGGDRZZRET-AWEZNQCLSA-N	-1	0	359.373	2.585	50	0		FFAARM
CC(NCc1ccccc1)=C1C(=O)[N-]C(=O)N(c2ccc(C)cc2C)C1=O	ZINC000005800584	533418040	/nfs/dbraw/zinc/41/80/40/533418040.db2.gz	ZFGNCWPLRYCLSP-OBGWFSINSA-N	-1	0	363.417	2.950	50	0		FFAARM
O=C([O-])c1cccc(N2CCC[C@@H](c3nccn3Cc3ccncc3)C2)n1	ZINC000092028850	132205736	/nfs/dbraw/zinc/20/57/36/132205736.db2.gz	BAQCIHMEAJOSGW-MRXNPFEDSA-N	-1	0	363.421	2.804	50	0		FFAARM
O=C([O-])[C@@H](c1ccc2c(c1)OCCO2)N1CCN(c2ccc(F)cc2)CC1	ZINC000095374966	132209148	/nfs/dbraw/zinc/20/91/48/132209148.db2.gz	UDAQMLZHUIBJOT-LJQANCHMSA-N	-1	0	372.396	2.545	50	0		FFAARM
Cc1ccccc1N1CCN(c2ccccc2NC(=O)/C=C/C(=O)[O-])CC1	ZINC000001019576	132252341	/nfs/dbraw/zinc/25/23/41/132252341.db2.gz	BDQAIZFJKVJOKE-ZHACJKMWSA-N	-1	0	365.433	2.901	50	0		FFAARM
C[C@@H](O)c1cccc(N2CCc3nc(-c4ccc(C(=O)[O-])cc4)[nH]c3C2)n1	ZINC000219005934	132273688	/nfs/dbraw/zinc/27/36/88/132273688.db2.gz	FOWKCSVTVDXUEE-GFCCVEGCSA-N	-1	0	364.405	2.786	50	0		FFAARM
O=C([O-])c1ccc2c(c1)CCCN2S(=O)(=O)c1ccc(F)cc1F	ZINC000058773017	132303837	/nfs/dbraw/zinc/30/38/37/132303837.db2.gz	HEHRLTFFYVREPW-UHFFFAOYSA-N	-1	0	353.346	2.805	50	0		FFAARM
CCCc1cc(C(=O)N2Cc3[nH]c4ccccc4c3C[C@H]2C(=O)[O-])n(C)n1	ZINC000095391622	221897452	/nfs/dbraw/zinc/89/74/52/221897452.db2.gz	ZJMBHMSMMGFEOG-SFHVURJKSA-N	-1	0	366.421	2.506	50	0		FFAARM
COC(=O)C[C@@H](c1ccccc1Cl)c1c([O-])nc2ccccn2c1=O	ZINC000096117309	222032892	/nfs/dbraw/zinc/03/28/92/222032892.db2.gz	JGQPTQSLKXOXQC-LBPRGKRZSA-N	-1	0	358.781	2.749	50	0		FFAARM
COc1ccccc1Cc1nc(-c2cccc(C(C)=O)c2)n(CC(=O)[O-])n1	ZINC000096133065	222037855	/nfs/dbraw/zinc/03/78/55/222037855.db2.gz	WLXHFEZFPYMPBI-UHFFFAOYSA-N	-1	0	365.389	2.832	50	0		FFAARM
COCc1ccc(C(=O)N2C[C@@H]3c4ccccc4OC[C@]3(C(=O)[O-])C2)s1	ZINC000096166577	222066052	/nfs/dbraw/zinc/06/60/52/222066052.db2.gz	TUOMNESWFZJOMO-AUUYWEPGSA-N	-1	0	373.430	2.598	50	0		FFAARM
COc1ccc(Cl)cc1[N-]S(=O)(=O)c1c[nH]c(-c2nnc(C)o2)c1	ZINC000096321587	222115210	/nfs/dbraw/zinc/11/52/10/222115210.db2.gz	BOSSRIGBKLFRAJ-UHFFFAOYSA-N	-1	0	368.802	2.836	50	0		FFAARM
O=C(NCCc1ccc(Cl)cc1)c1c([O-])c2cccc3c2n(c1=O)CC3	ZINC000100621245	222247976	/nfs/dbraw/zinc/24/79/76/222247976.db2.gz	BLTDMCDFYKKSPK-UHFFFAOYSA-N	-1	0	368.820	2.889	50	0		FFAARM
O=C(c1ccc2c(c1)OCO2)N1CCc2[n-]n(-c3ccccc3)c(=O)c2C1	ZINC000102708965	222305759	/nfs/dbraw/zinc/30/57/59/222305759.db2.gz	IWHHTSYJLDZVOO-UHFFFAOYSA-N	-1	0	363.373	2.505	50	0		FFAARM
CC(=O)c1cc2c(cc1NC(=O)C[C@@H](C(=O)[O-])c1ccc(F)cc1)OCO2	ZINC000025208599	263388376	/nfs/dbraw/zinc/38/83/76/263388376.db2.gz	NOGTUAFZZHBRJM-CQSZACIVSA-N	-1	0	373.336	2.954	50	0		FFAARM
COc1ccc(OC)c(S(=O)(=O)[N-]c2ccnn2[C@@H](C)C2CC2)c1	ZINC000032604201	506269535	/nfs/dbraw/zinc/26/95/35/506269535.db2.gz	FTSAWEDSBMBVID-NSHDSACASA-N	-1	0	351.428	2.672	50	0		FFAARM
CC[C@H](NC(=O)Cc1c(C)c2cc3c(C)coc3cc2oc1=O)C(=O)[O-]	ZINC000002104661	506272370	/nfs/dbraw/zinc/27/23/70/506272370.db2.gz	WNELPCFAEUUHGI-AWEZNQCLSA-N	-1	0	357.362	2.678	50	0	biogenic	FFAARM
O=C(COc1ccccc1F)n1cc(C(=O)c2cc(F)ccc2[O-])cn1	ZINC000002652832	506286039	/nfs/dbraw/zinc/28/60/39/506286039.db2.gz	XOMSIZMVZRPPGE-UHFFFAOYSA-N	-1	0	358.300	2.817	50	0		FFAARM
CC[C@H](C(=O)Nc1cc(S(=O)(=O)CC)ccc1[O-])n1cc(Cl)cn1	ZINC000002804786	506294512	/nfs/dbraw/zinc/29/45/12/506294512.db2.gz	HPMPNRPKEJYKAM-CYBMUJFWSA-N	-1	0	371.846	2.626	50	0		FFAARM
COc1ccc(N(CCC(=O)[O-])S(=O)(=O)c2ccc(C)c(C)c2)cc1	ZINC000003295384	506318638	/nfs/dbraw/zinc/31/86/38/506318638.db2.gz	ISKJTAWWVLKNLX-UHFFFAOYSA-N	-1	0	363.435	2.982	50	0		FFAARM
COc1ccc(C(=O)CSC2=Nc3ccccc3S(=O)(=O)[N-]2)cc1	ZINC000004329649	506373293	/nfs/dbraw/zinc/37/32/93/506373293.db2.gz	XQGACCJGLIPMMH-UHFFFAOYSA-N	-1	0	362.432	2.782	50	0		FFAARM
COc1ccc(N(CC(=O)[O-])S(=O)(=O)c2ccc(C)cc2)cc1Cl	ZINC000004977034	506410812	/nfs/dbraw/zinc/41/08/12/506410812.db2.gz	WYDIKHRNIJEKGR-UHFFFAOYSA-N	-1	0	369.826	2.937	50	0		FFAARM
O=C([O-])CSc1nc2sc3c(c2c(=O)n1Cc1ccco1)CCC3	ZINC000005001008	506414728	/nfs/dbraw/zinc/41/47/28/506414728.db2.gz	QQNRJYMJDVHXKQ-UHFFFAOYSA-N	-1	0	362.432	2.765	50	0		FFAARM
Nc1nc(SCc2ccccc2)[n-]c(=O)c1NC(=O)c1ccccc1	ZINC000005078307	506420314	/nfs/dbraw/zinc/42/03/14/506420314.db2.gz	ZSBBNKUVDBVOLF-UHFFFAOYSA-N	-1	0	352.419	2.897	50	0		FFAARM
CC(C)[C@H](O)[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)[O-]	ZINC000038528946	506440102	/nfs/dbraw/zinc/44/01/02/506440102.db2.gz	LYRGLIQVUMAZJU-OALUTQOASA-N	-1	0	369.417	2.995	50	0		FFAARM
CCOc1ccccc1NC(=O)[C@@H](Cc1ccc(OC)cc1)c1nnn[n-]1	ZINC000005444732	506442611	/nfs/dbraw/zinc/44/26/11/506442611.db2.gz	ACLISOJUKUBDAC-HNNXBMFYSA-N	-1	0	367.409	2.572	50	0		FFAARM
Cc1noc(C)c1S(=O)(=O)[N-]c1ccccc1C(=O)N1CCCCC1	ZINC000006551934	506487960	/nfs/dbraw/zinc/48/79/60/506487960.db2.gz	AOQJUDQFELMWEQ-UHFFFAOYSA-N	-1	0	363.439	2.718	50	0		FFAARM
CC1=C(C)C[C@H](C(=O)[O-])[C@H](C(=O)N2CCN(Cc3cccc(F)c3)CC2)C1	ZINC000006741883	506502326	/nfs/dbraw/zinc/50/23/26/506502326.db2.gz	RHAWVMBDVZUSKT-MOPGFXCFSA-N	-1	0	374.456	2.917	50	0		FFAARM
CCc1ccc(Cn2[nH][n-]c3c(=O)n(-c4ccc(OC)cc4)c(=O)c2=3)cc1	ZINC000006770512	506505976	/nfs/dbraw/zinc/50/59/76/506505976.db2.gz	KQUZKUDZMFKZDS-MSOLQXFVSA-N	-1	0	364.405	2.751	50	0		FFAARM
Cc1noc(C)c1S(=O)(=O)[N-]c1cc(Cl)ccc1N1CCOCC1	ZINC000007059968	506530638	/nfs/dbraw/zinc/53/06/38/506530638.db2.gz	YZSKNADSUNTBNW-UHFFFAOYSA-N	-1	0	371.846	2.582	50	0		FFAARM
COCc1[n-]n2c(nc(C)c(Cl)c2=O)c1-c1ccc(OC)c(OC)c1	ZINC000009261122	506687137	/nfs/dbraw/zinc/68/71/37/506687137.db2.gz	PYLAQOUVXATBOL-UHFFFAOYSA-N	-1	0	363.801	2.815	50	0		FFAARM
Cc1ccc(N2C(=O)[N-]C(=O)[C@]3(Cc4cc(C)ccc4N(C)C3)C2=O)cc1	ZINC000009476810	506696756	/nfs/dbraw/zinc/69/67/56/506696756.db2.gz	ZJFHMZNLEKRTFC-OAQYLSRUSA-N	-1	0	363.417	2.565	50	0		FFAARM
CCCCOc1ccc(S(=O)(=O)N2CCC(C(=O)[O-])CC2)cc1C	ZINC000011565970	506781912	/nfs/dbraw/zinc/78/19/12/506781912.db2.gz	CLOBRFVTZOANRB-UHFFFAOYSA-N	-1	0	355.456	2.659	50	0		FFAARM
O=C(NCc1ccco1)c1csc([N-]S(=O)(=O)c2cccs2)n1	ZINC000011693222	506789218	/nfs/dbraw/zinc/78/92/18/506789218.db2.gz	FPGWUCRDRRFKOQ-UHFFFAOYSA-N	-1	0	369.449	2.528	50	0		FFAARM
Cc1cccc(C)c1N1C(=O)C[C@@H](Nc2ccc(CC(=O)[O-])cc2)C1=O	ZINC000012607735	506883813	/nfs/dbraw/zinc/88/38/13/506883813.db2.gz	MEUBRYMECIZSKQ-MRXNPFEDSA-N	-1	0	352.390	2.675	50	0		FFAARM
CCOc1cc(C(=O)N(C)Cc2nc(=O)c3sccc3[n-]2)ccc1OC	ZINC000012747068	506893903	/nfs/dbraw/zinc/89/39/03/506893903.db2.gz	FYVGNBKBFMDTTI-UHFFFAOYSA-N	-1	0	373.434	2.664	50	0		FFAARM
NC(=O)c1ccc(NC(=O)CCSCc2ccc(C(=O)[O-])cc2)cc1	ZINC000012779062	506900625	/nfs/dbraw/zinc/90/06/25/506900625.db2.gz	DRSXLTJXFOKIOO-UHFFFAOYSA-N	-1	0	358.419	2.746	50	0		FFAARM
O=C([O-])c1cccc(N2N=C(c3ccc4c(c3)OCCO4)CCC2=O)c1	ZINC000013060434	506926784	/nfs/dbraw/zinc/92/67/84/506926784.db2.gz	PCLSHYQGSJJBNE-UHFFFAOYSA-N	-1	0	352.346	2.687	50	0		FFAARM
COc1cc(S(=O)(=O)Nc2ccc(Cl)cc2)cc(C(=O)[O-])c1OC	ZINC000045945859	507050404	/nfs/dbraw/zinc/05/04/04/507050404.db2.gz	UDDZYPQBMGPAKO-UHFFFAOYSA-N	-1	0	371.798	2.856	50	0		FFAARM
CCONC(=O)c1ccccc1[N-]S(=O)(=O)c1ccc(F)cc1C	ZINC000024925505	507449550	/nfs/dbraw/zinc/44/95/50/507449550.db2.gz	XIAAVMXFJJNSOK-UHFFFAOYSA-N	-1	0	352.387	2.616	50	0		FFAARM
O=C([O-])C[C@@H]1COCCN1C(=O)c1cc(C(F)(F)F)ccc1Cl	ZINC000072151937	507761621	/nfs/dbraw/zinc/76/16/21/507761621.db2.gz	XDLRPUUZZQRCIR-SECBINFHSA-N	-1	0	351.708	2.675	50	0		FFAARM
CCc1nccn1CCC(=O)N1CC[C@H](Cc2ccc(C(=O)[O-])cc2)C1	ZINC000072420391	507786685	/nfs/dbraw/zinc/78/66/85/507786685.db2.gz	WCVFUECORJIQBP-MRXNPFEDSA-N	-1	0	355.438	2.625	50	0		FFAARM
O=C([O-])CCc1cc2n(n1)CCCN(C(=O)C[C@@H]1CCc3ccccc31)C2	ZINC000072429845	507789836	/nfs/dbraw/zinc/78/98/36/507789836.db2.gz	QJFVVUCIJHABRG-INIZCTEOSA-N	-1	0	367.449	2.753	50	0		FFAARM
CC[C@@H](C)[C@H](NS(=O)(=O)c1cccc2c1cccc2N(C)C)C(=O)[O-]	ZINC000030836192	507813507	/nfs/dbraw/zinc/81/35/07/507813507.db2.gz	NJTOKQLVHXSRPR-PXAZEXFGSA-N	-1	0	364.467	2.683	50	0		FFAARM
COC(=O)c1ccc(S(=O)(=O)[N-]c2cc(-n3cccc3)ccc2F)o1	ZINC000078661530	507894703	/nfs/dbraw/zinc/89/47/03/507894703.db2.gz	CSASIMGOKCMRQN-UHFFFAOYSA-N	-1	0	364.354	2.797	50	0		FFAARM
Cc1nc2cc(CC(=O)N3C[C@@H](c4ccccc4)[C@H](C(=O)[O-])C3)ccc2[nH]1	ZINC000091468608	507988244	/nfs/dbraw/zinc/98/82/44/507988244.db2.gz	DPEJIASVZLRMHB-DLBZAZTESA-N	-1	0	363.417	2.741	50	0		FFAARM
Cc1ccc(NC(=O)N2CCC3(CCC(=O)N([C@@H](C)C(=O)[O-])C3)CC2)cc1	ZINC000091656634	508000506	/nfs/dbraw/zinc/00/05/06/508000506.db2.gz	HDDPSSAUVSKVNM-HNNXBMFYSA-N	-1	0	373.453	2.705	50	0		FFAARM
Cc1cc(N2CCCN(C(=O)C3CCC3)CC2)nc(-c2ccccc2[O-])n1	ZINC000092028125	508034271	/nfs/dbraw/zinc/03/42/71/508034271.db2.gz	DLOAJKALNBAPMV-UHFFFAOYSA-N	-1	0	366.465	2.996	50	0		FFAARM
CC(=O)Nc1ccc([N-]S(=O)(=O)c2ccc(-c3cc[nH]n3)s2)cc1	ZINC000075351863	508101074	/nfs/dbraw/zinc/10/10/74/508101074.db2.gz	MMQQEVMSSBKTQG-UHFFFAOYSA-N	-1	0	362.436	2.897	50	0		FFAARM
COc1ccccc1[N-]S(=O)(=O)c1c(C)[nH]c(C)c1-c1nnc(C)o1	ZINC000075504976	508112082	/nfs/dbraw/zinc/11/20/82/508112082.db2.gz	FOBMWNHWGJTUTO-UHFFFAOYSA-N	-1	0	362.411	2.799	50	0		FFAARM
Cc1ccc(C(=O)[O-])cc1S(=O)(=O)N(CCC#N)c1ccc(F)cc1	ZINC000075610173	508121661	/nfs/dbraw/zinc/12/16/61/508121661.db2.gz	OYFFNFNDRLXDHB-UHFFFAOYSA-N	-1	0	362.382	2.941	50	0		FFAARM
COc1ccc(Cn2cc([C@@H](C(=O)[O-])N(C)Cc3ccoc3)cn2)cc1	ZINC000095352528	508174084	/nfs/dbraw/zinc/17/40/84/508174084.db2.gz	HYPVRSYDYKWCEL-SFHVURJKSA-N	-1	0	355.394	2.791	50	0		FFAARM
Cc1cc(C)n(CCC(=O)N2CCC[C@@H](c3ccc(C(=O)[O-])cc3)C2)n1	ZINC000095352353	508174090	/nfs/dbraw/zinc/17/40/90/508174090.db2.gz	OOUOTNMPWCXDJF-GOSISDBHSA-N	-1	0	355.438	2.994	50	0		FFAARM
C[C@H](SCc1ccccc1)C(=O)Nc1cccc(C(=O)NCC(=O)[O-])c1	ZINC000095389893	508183531	/nfs/dbraw/zinc/18/35/31/508183531.db2.gz	LQTIFIQHIHRTBE-ZDUSSCGKSA-N	-1	0	372.446	2.761	50	0		FFAARM
Cn1ccc2ccc(C(=O)N3CC(Oc4ccc(C(=O)[O-])cc4)C3)cc21	ZINC000095498113	508189995	/nfs/dbraw/zinc/18/99/95/508189995.db2.gz	SDDLSBOIYLOOSV-UHFFFAOYSA-N	-1	0	350.374	2.780	50	0		FFAARM
CCOc1ccc(-c2ccnc(NCc3cn(C)nc3C)n2)cc1C(=O)[O-]	ZINC000077455764	508318746	/nfs/dbraw/zinc/31/87/46/508318746.db2.gz	RDPINBXWBPRXFU-UHFFFAOYSA-N	-1	0	367.409	2.895	50	0		FFAARM
O=C([N-]S(=O)(=O)CCCC(F)(F)F)[C@@H]1CSc2ccccc21	ZINC000157044513	508514493	/nfs/dbraw/zinc/51/44/93/508514493.db2.gz	IVUAZHDATXXFAG-SNVBAGLBSA-N	-1	0	353.387	2.664	50	0		FFAARM
CCN(C1CC1)S(=O)(=O)c1cc(C(=O)[O-])cc(Br)c1C	ZINC000122368658	508524387	/nfs/dbraw/zinc/52/43/87/508524387.db2.gz	MVSLCICXHVMGCR-UHFFFAOYSA-N	-1	0	362.245	2.629	50	0		FFAARM
CCc1nc(C(=O)N2CCCC[C@H]2C(=O)[O-])nn1-c1ccccc1Cl	ZINC000136503595	508698166	/nfs/dbraw/zinc/69/81/66/508698166.db2.gz	FZTJDHHSXJFJIJ-ZDUSSCGKSA-N	-1	0	362.817	2.562	50	0		FFAARM
Cc1cccn2cc(-c3ccccc3[N-]S(=O)(=O)c3cn(C)cn3)nc12	ZINC000206910406	509236539	/nfs/dbraw/zinc/23/65/39/509236539.db2.gz	CMPGQSWJIRCIBA-UHFFFAOYSA-N	-1	0	367.434	2.844	50	0		FFAARM
COCCn1c(C)c(C)c2cc(C(=O)N3CCC[C@@H](C(=O)[O-])C3)ccc21	ZINC000237133556	509579269	/nfs/dbraw/zinc/57/92/69/509579269.db2.gz	DNJRURBMFYDANP-MRXNPFEDSA-N	-1	0	358.438	2.841	50	0		FFAARM
COc1ccc(CCC(=O)N2CCCC[C@H]2C(=O)[O-])cc1Br	ZINC000237186577	509589987	/nfs/dbraw/zinc/58/99/87/509589987.db2.gz	MCZSBZCXCLRPDB-ZDUSSCGKSA-N	-1	0	370.243	2.856	50	0		FFAARM
COc1c(Br)c(C)sc1C(=O)N1CCC(C(=O)[O-])CC1	ZINC000237276735	509610652	/nfs/dbraw/zinc/61/06/52/509610652.db2.gz	TXHFSNZEEKINKH-UHFFFAOYSA-N	-1	0	362.245	2.764	50	0		FFAARM
C[C@@]1(C(=O)[O-])CCN(C(=O)c2nc(C3CC3)n(-c3ccccc3Cl)n2)C1	ZINC000237391478	509637876	/nfs/dbraw/zinc/63/78/76/509637876.db2.gz	CZNZOATXNFKFSO-GOSISDBHSA-N	-1	0	374.828	2.735	50	0		FFAARM
C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N1CCO[C@H](CC(=O)[O-])C1	ZINC000237489308	509660227	/nfs/dbraw/zinc/66/02/27/509660227.db2.gz	GDRYTECYSNFNTB-BXUZGUMPSA-N	-1	0	359.344	2.586	50	0		FFAARM
Cc1oc(-c2ccco2)nc1CC(=O)N1Cc2ccccc2C[C@H]1C(=O)[O-]	ZINC000237657346	509703090	/nfs/dbraw/zinc/70/30/90/509703090.db2.gz	VYQDQUZISVCPQF-INIZCTEOSA-N	-1	0	366.373	2.824	50	0		FFAARM
Cc1ccc(CN2C(=O)CC[C@H]2C(=O)NCc2cccc(C(=O)[O-])c2)cc1	ZINC000237734512	509722713	/nfs/dbraw/zinc/72/27/13/509722713.db2.gz	KSKSPLCVSZRYCN-SFHVURJKSA-N	-1	0	366.417	2.501	50	0		FFAARM
Cc1ccc(-c2nc(C(=O)N(CC(=O)[O-])C3CCOCC3)cs2)cc1	ZINC000237744842	509725655	/nfs/dbraw/zinc/72/56/55/509725655.db2.gz	QYGKGXDDSQWLQJ-UHFFFAOYSA-N	-1	0	360.435	2.824	50	0		FFAARM
Cc1nn(Cc2ccc(C)cc2)c(C)c1CCC(=O)N1CCC[C@@H]1C(=O)[O-]	ZINC000237851322	509751790	/nfs/dbraw/zinc/75/17/90/509751790.db2.gz	YNCHOPWHJVXCJE-LJQANCHMSA-N	-1	0	369.465	2.865	50	0		FFAARM
O=C([O-])[C@H]1Cc2ccccc2CN1C(=O)Cc1csc(-c2ccoc2)n1	ZINC000238032434	509805958	/nfs/dbraw/zinc/80/59/58/509805958.db2.gz	AWEISNOGUOSBFK-MRXNPFEDSA-N	-1	0	368.414	2.984	50	0		FFAARM
O=C([O-])CCN(C[C@@H]1CCCO1)C(=O)[C@H]1C[C@@H]1c1cccc(F)c1F	ZINC000238090056	509817448	/nfs/dbraw/zinc/81/74/48/509817448.db2.gz	FGULFEMWQFQOKV-YUTCNCBUSA-N	-1	0	353.365	2.551	50	0		FFAARM
O=C([O-])[C@H]1CCCN1C(=O)c1cccc(OCc2cn3ccccc3n2)c1	ZINC000238089438	509818273	/nfs/dbraw/zinc/81/82/73/509818273.db2.gz	WWKHBTGIDLREAR-QGZVFWFLSA-N	-1	0	365.389	2.603	50	0		FFAARM
O=C([O-])c1ccc(CCNC(=O)c2cc(N3CCCC3=O)ccc2F)cc1	ZINC000238095592	509820291	/nfs/dbraw/zinc/82/02/91/509820291.db2.gz	QNYKCXKGICKUMV-UHFFFAOYSA-N	-1	0	370.380	2.623	50	0		FFAARM
O=C([O-])c1ccc(CNC(=O)[C@H]2CCCN2Cc2ccc(F)cc2)cc1	ZINC000238121062	509824109	/nfs/dbraw/zinc/82/41/09/509824109.db2.gz	LWCNKCFUTBDZSD-GOSISDBHSA-N	-1	0	356.397	2.805	50	0		FFAARM
O=C([O-])CN(Cc1ccccc1)C(=O)c1ccc(CN2CCCC2=O)cc1	ZINC000238152076	509826981	/nfs/dbraw/zinc/82/69/81/509826981.db2.gz	NPTRJCZMMWRCHT-UHFFFAOYSA-N	-1	0	366.417	2.536	50	0		FFAARM
Cc1nc(C)n(-c2ccc(C(=O)N3[C@@H]4CCCC[C@@H]4C[C@H]3C(=O)[O-])cc2)n1	ZINC000252510664	509847846	/nfs/dbraw/zinc/84/78/46/509847846.db2.gz	BCRWEPCBZUZZOZ-NXHRZFHOSA-N	-1	0	368.437	2.742	50	0		FFAARM
O=C(N=c1[n-]nc(C2CCOCC2)s1)N1CCCc2ccccc2CC1	ZINC000333603478	511297889	/nfs/dbraw/zinc/29/78/89/511297889.db2.gz	DAHFQSGXWSNVHE-UHFFFAOYSA-N	-1	0	372.494	3.455	50	0		FFAARM
Cc1nc(-c2ccc(Cl)s2)sc1C(=O)N1CCOC[C@H]1C(=O)[O-]	ZINC000299750234	511668010	/nfs/dbraw/zinc/66/80/10/511668010.db2.gz	MZJXFURCKMAKHO-QMMMGPOBSA-N	-1	0	372.855	2.759	50	0		FFAARM
C[C@@H]1Sc2ccc(C(=O)N3[C@H](C(=O)[O-])C[C@H]4CCCC[C@@H]43)cc2NC1=O	ZINC000299745778	511668408	/nfs/dbraw/zinc/66/84/08/511668408.db2.gz	SHLCCVGUYOEJAC-JLUCKKNBSA-N	-1	0	374.462	2.977	50	0		FFAARM
O=C([O-])[C@H]1CCCN1CC(=O)N1CCc2sccc2[C@H]1c1ccccc1	ZINC000299738464	511668560	/nfs/dbraw/zinc/66/85/60/511668560.db2.gz	BBSNPOILQGCBTO-VQIMIIECSA-N	-1	0	370.474	2.771	50	0		FFAARM
O=C([O-])CN(Cc1ccccc1)C(=O)C[C@H]1Sc2ccccc2NC1=O	ZINC000299741800	511668751	/nfs/dbraw/zinc/66/87/51/511668751.db2.gz	GEKLDZHCQYWCME-MRXNPFEDSA-N	-1	0	370.430	2.603	50	0		FFAARM
CCOc1cccc2c1OC[C@@H](C(=O)N(C)Cc1cc(C(=O)[O-])c(C)o1)C2	ZINC000299748354	511668889	/nfs/dbraw/zinc/66/88/89/511668889.db2.gz	HBJHSIZAKPSSFP-AWEZNQCLSA-N	-1	0	373.405	2.895	50	0		FFAARM
CCc1nc2ccccc2n1CCC(=O)NCCc1nc(C(=O)[O-])cs1	ZINC000426397636	513927308	/nfs/dbraw/zinc/92/73/08/513927308.db2.gz	UAZODUXXEPQPCC-UHFFFAOYSA-N	-1	0	372.450	2.502	50	0		FFAARM
O=C(NCC1CCc2ccccc2CC1)c1ccc(-c2nc(=O)o[n-]2)cc1	ZINC000530263859	517666393	/nfs/dbraw/zinc/66/63/93/517666393.db2.gz	GAFAVRMKIJYPDW-UHFFFAOYSA-N	-1	0	363.417	2.955	50	0		FFAARM
C[C@@H](NC(=O)C(C)(C)C(=O)[O-])c1ccc(NC(=O)c2ccncc2)cc1	ZINC000563200266	517730162	/nfs/dbraw/zinc/73/01/62/517730162.db2.gz	LXTIFWGXKXWKCS-GFCCVEGCSA-N	-1	0	355.394	2.622	50	0		FFAARM
O=C([O-])c1cnc(C(=O)N2CCC[C@H]2Cc2c(F)cccc2Cl)cn1	ZINC000568389809	519016232	/nfs/dbraw/zinc/01/62/32/519016232.db2.gz	ARGKCCLUYSCQAU-JTQLQIEISA-N	-1	0	363.776	2.815	50	0		FFAARM
CC(C)n1ncc2cc(S(=O)(=O)[N-]c3cnn(CC(F)F)c3)ccc21	ZINC000079111627	520085075	/nfs/dbraw/zinc/08/50/75/520085075.db2.gz	LFBSMVWFYJAYOB-UHFFFAOYSA-N	-1	0	369.397	2.880	50	0		FFAARM
O=C([O-])c1ccc(/C=C\C(=O)N2CCC(CN3CCCCC3=O)CC2)cc1	ZINC000606441839	521068565	/nfs/dbraw/zinc/06/85/65/521068565.db2.gz	MNVIFCLLEANIAO-TWGQIWQCSA-N	-1	0	370.449	2.649	50	0		FFAARM
C[C@H](NC(=O)Nc1ccccc1C[S@@](C)=O)[C@@H]1C[C@H](C(=O)[O-])C1(C)C	ZINC000593963184	521318494	/nfs/dbraw/zinc/31/84/94/521318494.db2.gz	ZBZOVJHDYMQMPT-DCYOQDFUSA-N	-1	0	366.483	2.822	50	0		FFAARM
O=C([O-])COc1ccc(C(=O)N[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)cc1	ZINC000621540196	522916025	/nfs/dbraw/zinc/91/60/25/522916025.db2.gz	NTFRYHXWEHFBON-AEFFLSMTSA-N	-1	0	373.380	2.939	50	0		FFAARM
Cc1nn(CCO)cc1-c1c(-c2ccccc2)ncn1[C@H](C)CC(=O)[O-]	ZINC000091616668	526281636	/nfs/dbraw/zinc/28/16/36/526281636.db2.gz	CRFPSXQVVZTDRZ-CYBMUJFWSA-N	-1	0	354.410	2.750	50	0		FFAARM
O=C([O-])[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)CC[C@H]1Cc2ccccc2NC1=O	ZINC000268935946	526290379	/nfs/dbraw/zinc/29/03/79/526290379.db2.gz	HKNIJECRIHRKRW-LAQRGFTBSA-N	-1	0	370.449	2.822	50	0		FFAARM
O=C([O-])[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)C[C@H]1Sc2ccccc2NC1=O	ZINC000299750603	526292185	/nfs/dbraw/zinc/29/21/85/526292185.db2.gz	OASVCKBLNVIKIT-OEYIWLLWSA-N	-1	0	374.462	2.734	50	0		FFAARM
O=C([O-])[C@@H]1Cc2ccccc2CN1C(=O)C[C@@H]1OCCc2ccccc21	ZINC000268951225	526292939	/nfs/dbraw/zinc/29/29/39/526292939.db2.gz	QKKHGQNSRYDBHG-OALUTQOASA-N	-1	0	351.402	2.729	50	0		FFAARM
O=C([O-])[C@H]1CCCC[C@@H]1C(=O)N1CCN(c2cccc(Cl)c2)CC1	ZINC000000178898	526320735	/nfs/dbraw/zinc/32/07/35/526320735.db2.gz	NNVAEGDGLIJWFI-HOTGVXAUSA-N	-1	0	350.846	2.880	50	0		FFAARM
O=C([O-])c1ccc(C(=O)N2CCC[C@H]2c2ccc3c(c2)OCCO3)cn1	ZINC000262334043	526362521	/nfs/dbraw/zinc/36/25/21/526362521.db2.gz	WHSDYKYSZGUYOH-HNNXBMFYSA-N	-1	0	354.362	2.528	50	0		FFAARM
Cc1oc(CN(C)C(=O)C(C)(C)c2ccc3c(c2)OCCO3)cc1C(=O)[O-]	ZINC000268928477	526767906	/nfs/dbraw/zinc/76/79/06/526767906.db2.gz	HCXHGBOACUFLKO-UHFFFAOYSA-N	-1	0	373.405	2.994	50	0		FFAARM
CCN1C(=O)COc2cc3c(cc21)[C@@H](c1ccc(C(=O)[O-])s1)CC(=O)N3	ZINC000065417562	535432431	/nfs/dbraw/zinc/43/24/31/535432431.db2.gz	WUTUOMLDHVRENC-JTQLQIEISA-N	-1	0	372.402	2.666	50	0		FFAARM
CC(C)[C@@H](NC(=O)Cn1ccc2ccc(Br)cc21)C(=O)[O-]	ZINC000206202582	570641513	/nfs/dbraw/zinc/64/15/13/570641513.db2.gz	SHNCFUHYWYLESY-CQSZACIVSA-N	-1	0	353.216	2.629	50	0		FFAARM
O=C(CC[C@@H]1NC(=O)c2ccccc2NC1=O)Nc1cc(Cl)ccc1O	ZINC000206236676	570641528	/nfs/dbraw/zinc/64/15/28/570641528.db2.gz	YDPXTKJERKIYRV-ZDUSSCGKSA-N	-1	0	373.796	2.515	50	0		FFAARM
COc1ccc(CC(=O)[O-])cc1S(=O)(=O)Nc1ccc(C)cc1F	ZINC000048332671	570946954	/nfs/dbraw/zinc/94/69/54/570946954.db2.gz	YMKDWUKOVKFQPD-UHFFFAOYSA-N	-1	0	353.371	2.571	50	0		FFAARM
Cc1nc([N-]S(=O)(=O)c2ccc3c(c2)C(C)(C)CC(=O)N3)sc1C	ZINC000096183250	571134239	/nfs/dbraw/zinc/13/42/39/571134239.db2.gz	VEHWDFWUYPPHEG-UHFFFAOYSA-N	-1	0	365.480	3.181	50	0		FFAARM
Cc1cc2ncc(C(=O)N[C@@H](c3ccccc3)[C@H](C)C(=O)[O-])c(C)n2n1	ZINC000262544431	601169379	/nfs/dbraw/zinc/16/93/79/601169379.db2.gz	VPRSZWIAUXAALY-YVEFUNNKSA-N	-1	0	352.394	2.538	50	0		FFAARM
Cc1ccc(S(=O)(=O)[N-]C(=O)Oc2ccc3oc(=O)sc3c2)cc1	ZINC000005061096	727779593	/nfs/dbraw/zinc/77/95/93/727779593.db2.gz	MUMMKMPQPQCKCV-UHFFFAOYSA-N	-1	0	365.388	2.640	50	0		FFAARM
O=C1Cc2cc(S(=O)(=O)[N-]c3ccccc3OCC3CC3)ccc2N1	ZINC000150875368	728743616	/nfs/dbraw/zinc/74/36/16/728743616.db2.gz	CVIHRBFBEUWNBD-UHFFFAOYSA-N	-1	0	358.419	2.771	50	0		FFAARM
CO[C@](C)(C(=O)[O-])C(=O)N[C@@H]1CCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000663046320	732376179	/nfs/dbraw/zinc/37/61/79/732376179.db2.gz	SMJQMFIVYOBALE-KFNAQCHYSA-N	-1	0	359.344	2.947	50	0		FFAARM
C[C@@H]1OCCC[C@H]1C(=O)N[C@H](C(=O)[O-])c1ccccc1Br	ZINC000668295080	733103837	/nfs/dbraw/zinc/10/38/37/733103837.db2.gz	IZLRQVOKBAXQRC-CWSCBRNRSA-N	-1	0	356.216	2.506	50	0		FFAARM
O=C([O-])[C@H]1CN(C(=O)Nc2ccc(-c3ccc(Cl)s3)nc2)CCO1	ZINC000669505857	733239348	/nfs/dbraw/zinc/23/93/48/733239348.db2.gz	LSLCSKMACVDSOT-LLVKDONJSA-N	-1	0	367.814	2.781	50	0		FFAARM
CN1C(=O)CCc2cc(C(=O)N[C@@H](CC(=O)[O-])c3cccs3)ccc21	ZINC000683298958	734142291	/nfs/dbraw/zinc/14/22/91/734142291.db2.gz	OIRVTJZNVTVFRV-ZDUSSCGKSA-N	-1	0	358.419	2.603	50	0		FFAARM
O=C([O-])[C@H]1CCN(C(=O)/C=C/c2ccc(Oc3cccnc3)c(F)c2)C1	ZINC000178266873	970131802	/nfs/dbraw/zinc/13/18/02/970131802.db2.gz	ICEWSQYTOONLKD-YVZNUBBCSA-N	-1	0	356.353	2.959	50	0		FFAARM
O=C([O-])c1cnc(C(=O)N(CCc2ccccc2F)C2CCCC2)cn1	ZINC000647119849	1022956648	/nfs/dbraw/zinc/95/66/48/1022956648.db2.gz	OCHSCICGDRYTKV-UHFFFAOYSA-N	-1	0	357.385	2.941	50	0		FFAARM
Cc1c(C(=O)[O-])cnn1-c1ccc(C(=O)N2C[C@H](C)OCC2(C)C)cc1	ZINC000191653013	1023887209	/nfs/dbraw/zinc/88/72/09/1023887209.db2.gz	YDQZUSCJJMNWTP-LBPRGKRZSA-N	-1	0	357.410	2.518	50	0		FFAARM
CCn1c(NCCCn2ccnc2C(C)C)nc2cc(C(=O)[O-])cnc21	ZINC001506403578	1059496424	/nfs/dbraw/zinc/49/64/24/1059496424.db2.gz	NBHVUMCUWWZWDQ-UHFFFAOYSA-N	-1	0	356.430	2.972	50	0		FFAARM
CN(Cc1cc(-c2ccncc2)no1)C(=O)c1[n-]c(=O)nc2ccccc21	ZINC001506405178	1059497036	/nfs/dbraw/zinc/49/70/36/1059497036.db2.gz	LQPZPFCNCCKMGD-UHFFFAOYSA-N	-1	0	361.361	2.658	50	0		FFAARM
CCCC(CCC)C(=O)Nc1ccc2c(c1)C(=O)N(CCC(=O)[O-])C2=O	ZINC000000692856	210262370	/nfs/dbraw/zinc/26/23/70/210262370.db2.gz	PTMWYYNBHGSLKC-UHFFFAOYSA-N	-1	0	360.410	2.912	50	0		FFAARM
C[C@H]1Cc2cccc3c2n1c(=O)c(C(=O)NCc1ccc(F)cc1)c3[O-]	ZINC000170624679	222609129	/nfs/dbraw/zinc/60/91/29/222609129.db2.gz	RMTOXLCFDKCNMA-NSHDSACASA-N	-1	0	352.365	2.893	50	0		FFAARM
Cc1n[nH]c(C)c1/C=C\c1nc2ccccc2c(=O)n1CCCC(=O)[O-]	ZINC000096179249	210238532	/nfs/dbraw/zinc/23/85/32/210238532.db2.gz	XUJPRFTVFKMIHQ-KTKRTIGZSA-N	-1	0	352.394	2.772	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)c1ccc(N2CCCC2=O)cc1)c1ccc(F)cc1	ZINC000013257576	210141464	/nfs/dbraw/zinc/14/14/64/210141464.db2.gz	QQANTBZZVSFGPH-KRWDZBQOSA-N	-1	0	370.380	2.898	50	0		FFAARM
Cc1nc(C(=O)N2CCCC[C@@H]2C(=O)[O-])nn1-c1ccccc1C(C)C	ZINC000136488325	210093828	/nfs/dbraw/zinc/09/38/28/210093828.db2.gz	WAVHYECXLQTGPN-MRXNPFEDSA-N	-1	0	356.426	2.778	50	0		FFAARM
O=C([O-])[C@H](C(=O)NCc1ccccc1CN1CCCC1=O)C1CCCCC1	ZINC000299781089	210025366	/nfs/dbraw/zinc/02/53/66/210025366.db2.gz	VKNMGPUCGJVZJI-IBGZPJMESA-N	-1	0	372.465	2.706	50	0		FFAARM
O=C([O-])C1[C@@H](c2ccccc2)C(C(=O)N2CCOCC2)[C@@H]1c1ccccc1	ZINC000000897614	219338134	/nfs/dbraw/zinc/33/81/34/219338134.db2.gz	FMUMEDHFYUKQRJ-VCAKUFKGSA-N	-1	0	365.429	2.743	50	0		FFAARM
O=C(COc1ccc(Cl)cc1Cl)[N-]S(=O)(=O)c1ccccc1	ZINC000000941031	219343531	/nfs/dbraw/zinc/34/35/31/219343531.db2.gz	PRLARXWVIITPAD-UHFFFAOYSA-N	-1	0	360.218	2.877	50	0		FFAARM
COc1ccc(Br)cc1CCC(=O)NC1(C(=O)[O-])CCC1	ZINC000237122403	222905846	/nfs/dbraw/zinc/90/58/46/222905846.db2.gz	XEUUOBIVVVJIJC-UHFFFAOYSA-N	-1	0	356.216	2.514	50	0		FFAARM
O=C([O-])CC[C@H]1CCCN(C(=O)c2cccc(Nc3cnccn3)c2)C1	ZINC000238020888	222912233	/nfs/dbraw/zinc/91/22/33/222912233.db2.gz	SKAYXALSMLAHFA-CQSZACIVSA-N	-1	0	354.410	2.937	50	0		FFAARM
C[C@@]1(C(=O)[O-])CCN(C(=O)c2c[nH]c3cccc(Br)c32)C1	ZINC000237653839	222909313	/nfs/dbraw/zinc/90/93/13/222909313.db2.gz	ZZUUEBRSORXVMM-OAHLLOKOSA-N	-1	0	351.200	2.867	50	0		FFAARM
COc1ccc(C(=O)Nc2ccc(-c3nc(=O)o[n-]3)cc2)c(OC)c1OC	ZINC000060348192	212019542	/nfs/dbraw/zinc/01/95/42/212019542.db2.gz	PEUALAPZLICHHC-UHFFFAOYSA-N	-1	0	371.349	2.720	50	0		FFAARM
Cc1cc(S(=O)(=O)N2c3ccccc3C[C@H]2C)ccc1OCC(=O)[O-]	ZINC000058377047	212008291	/nfs/dbraw/zinc/00/82/91/212008291.db2.gz	CFSDXXWVNMBWRA-CYBMUJFWSA-N	-1	0	361.419	2.598	50	0		FFAARM
CC[C@H](C)[C@@H](NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)C)C(=O)[O-]	ZINC000013464326	220068740	/nfs/dbraw/zinc/06/87/40/220068740.db2.gz	WRWKLZMOFAMVPZ-CWRNSKLLSA-N	-1	0	364.442	2.553	50	0		FFAARM
O=C([O-])c1cccc(CNC(=O)CC[C@@H]2Cc3ccccc3NC2=O)c1	ZINC000299743729	211824144	/nfs/dbraw/zinc/82/41/44/211824144.db2.gz	LZHFKPCXXYPPSF-OAHLLOKOSA-N	-1	0	352.390	2.592	50	0		FFAARM
Cc1oc(CN(C)C(=O)[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1C(=O)[O-]	ZINC000299747021	211826025	/nfs/dbraw/zinc/82/60/25/211826025.db2.gz	BWBNKRJEJNCVHU-INIZCTEOSA-N	-1	0	370.405	2.606	50	0		FFAARM
O=C([O-])[C@@H]1c2ccccc2C(=O)N(C2CC2)[C@@H]1c1ccc2c(c1)OCO2	ZINC000045923021	211825330	/nfs/dbraw/zinc/82/53/30/211825330.db2.gz	JHRFIVIKSLXTHD-QZTJIDSGSA-N	-1	0	351.358	2.943	50	0		FFAARM
C[C@H](CC(=O)N1CCO[C@H](CC(=O)[O-])C1)c1ccccc1Br	ZINC000299742343	211821797	/nfs/dbraw/zinc/82/17/97/211821797.db2.gz	BFRRLAPYLVLXCX-VXGBXAGGSA-N	-1	0	370.243	2.645	50	0		FFAARM
CC[C@H](O)[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)[O-]	ZINC000038528957	211699870	/nfs/dbraw/zinc/69/98/70/211699870.db2.gz	VSKJOSVYDOHRGI-ZWKOTPCHSA-N	-1	0	355.390	2.749	50	0		FFAARM
C[C@H](NC(=O)Cn1ccc2cc(OCc3ccccc3)ccc21)C(=O)[O-]	ZINC000036358349	211663076	/nfs/dbraw/zinc/66/30/76/211663076.db2.gz	MDVPJWOGVNSEAW-AWEZNQCLSA-N	-1	0	352.390	2.810	50	0		FFAARM
COc1ccc(-n2cnnc2SCC(=O)[N-]OCc2ccccc2)cc1	ZINC000025286765	211427746	/nfs/dbraw/zinc/42/77/46/211427746.db2.gz	XNSMYNBQTLILTG-UHFFFAOYSA-N	-1	0	370.434	2.616	50	0		FFAARM
CCOC(=O)N1CCN([C@H](C(=O)[O-])c2c[nH]c3cccc(Cl)c32)CC1	ZINC000020737466	211294726	/nfs/dbraw/zinc/29/47/26/211294726.db2.gz	HXZDWYDMSAJLGE-HNNXBMFYSA-N	-1	0	365.817	2.721	50	0		FFAARM
COc1cc2c(cc1OC)C([O-])=C(S(=O)(=O)c1ccc(Cl)cc1)C2	ZINC000020717404	211293708	/nfs/dbraw/zinc/29/37/08/211293708.db2.gz	KRUOSFBTRHPLTG-INIZCTEOSA-N	-1	0	366.822	2.939	50	0		FFAARM
CCOC(=O)c1c(C)[nH]c(C)c1S(=O)(=O)[N-]c1cccc(C(C)=O)c1	ZINC000020574903	211288132	/nfs/dbraw/zinc/28/81/32/211288132.db2.gz	KCFDJFRSKXBALQ-UHFFFAOYSA-N	-1	0	364.423	2.812	50	0		FFAARM
Cn1c(=O)c2ccc(C(=O)NC34CC5CC(CC(C5)C3)C4)cc2[n-]c1=S	ZINC000017305487	211182668	/nfs/dbraw/zinc/18/26/68/211182668.db2.gz	BSPKPDKXLSUAJF-UHFFFAOYSA-N	-1	0	369.490	2.921	50	0		FFAARM
COc1ccc(CCNC(=O)[C@]2(C)CC[C@H](C(=O)[O-])C2(C)C)cc1OC	ZINC000018191973	211194454	/nfs/dbraw/zinc/19/44/54/211194454.db2.gz	SFNLISZDERIUTH-VLIAUNLRSA-N	-1	0	363.454	2.890	50	0		FFAARM
C[C@H](CC(=O)[O-])CC(=O)Nc1sc2c(c1C(=O)NC1CC1)CCCC2	ZINC000017074928	211178221	/nfs/dbraw/zinc/17/82/21/211178221.db2.gz	UPKFUGPJNOVYEC-JTQLQIEISA-N	-1	0	364.467	2.959	50	0		FFAARM
Cc1ccc(NC(=O)Cn2cc(/C=C3\NC(=O)[N-]C3=O)c3ccccc32)cc1	ZINC000013940537	211064790	/nfs/dbraw/zinc/06/47/90/211064790.db2.gz	XQIXSCBJOBOYLE-YVLHZVERSA-N	-1	0	374.400	2.769	50	0		FFAARM
COc1ccc([C@H](CC(=O)[O-])NC(=O)CCOc2ccccc2)cc1OC	ZINC000013183291	211028884	/nfs/dbraw/zinc/02/88/84/211028884.db2.gz	JYYJQXCHPXRSTQ-INIZCTEOSA-N	-1	0	373.405	2.805	50	0		FFAARM
O=C([O-])c1ccc(NC2=C(Cl)C(=O)O[C@H]2OC(=O)c2ccccc2)cc1	ZINC000008659763	210794001	/nfs/dbraw/zinc/79/40/01/210794001.db2.gz	FPDPSVOXOMCQOT-GOSISDBHSA-N	-1	0	373.748	2.987	50	0		FFAARM
O=C([O-])c1ccc(CNS(=O)(=O)c2cccc(C(F)(F)F)c2)cc1	ZINC000004671286	210549492	/nfs/dbraw/zinc/54/94/92/210549492.db2.gz	YULRKVYOEFOBSH-UHFFFAOYSA-N	-1	0	359.325	2.882	50	0		FFAARM
CCOC(=O)c1c(NC(=O)CCC(=O)[O-])sc2c1CC(C)(C)OC2	ZINC000004662562	210548858	/nfs/dbraw/zinc/54/88/58/210548858.db2.gz	DHINEZNPGDAXRD-UHFFFAOYSA-N	-1	0	355.412	2.579	50	0		FFAARM
Cc1nc(=O)c(-c2ccccc2)c(C)n1-c1ccc(OCC(=O)[O-])cc1	ZINC000004476942	210530907	/nfs/dbraw/zinc/53/09/07/210530907.db2.gz	YFEOKXMJSYSTNP-UHFFFAOYSA-N	-1	0	350.374	2.980	50	0		FFAARM
C[C@@H]1CCc2c(sc(NC(=O)[C@H]3CC=CC[C@@H]3C(=O)[O-])c2C(N)=O)C1	ZINC000004173450	210514771	/nfs/dbraw/zinc/51/47/71/210514771.db2.gz	MOAACRFRNIIRHU-VWYCJHECSA-N	-1	0	362.451	2.577	50	0		FFAARM
COc1ccc(Br)cc1C[C@@H](NC(=O)OC(C)(C)C)C(=O)[O-]	ZINC000002379454	210394967	/nfs/dbraw/zinc/39/49/67/210394967.db2.gz	YRKQEACMEPBJKP-LLVKDONJSA-N	-1	0	374.231	2.978	50	0		FFAARM
COc1ccc(Cn2c(=O)c3cc(OC)c(OC)cc3[n-]c2=S)cc1	ZINC000003043366	210351915	/nfs/dbraw/zinc/35/19/15/210351915.db2.gz	DFUMSTZRGWEMLS-UHFFFAOYSA-N	-1	0	358.419	2.759	50	0		FFAARM
CC(C)(C)n1ncc2c1ncn([N-]C(=O)c1c(F)cccc1Cl)c2=O	ZINC000010250814	210344297	/nfs/dbraw/zinc/34/42/97/210344297.db2.gz	AQRXBYCKSOAYAY-UHFFFAOYSA-N	-1	0	363.780	2.524	50	0		FFAARM
CCOc1ccccc1N1C[C@H](C(=O)Nc2ccc(C(=O)[O-])cc2)CC1=O	ZINC000001072515	210312829	/nfs/dbraw/zinc/31/28/29/210312829.db2.gz	LFWDBBNGSYCHAV-CQSZACIVSA-N	-1	0	368.389	2.775	50	0		FFAARM
Cc1cccc(OCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)[O-])c1	ZINC000000941366	210292098	/nfs/dbraw/zinc/29/20/98/210292098.db2.gz	MTRYURFOLOXIIT-SFHVURJKSA-N	-1	0	352.390	2.667	50	0		FFAARM
O=C([O-])[C@@H](Cc1ccccc1)NS(=O)(=O)c1ccc2ccccc2c1	ZINC000000850357	210280973	/nfs/dbraw/zinc/28/09/73/210280973.db2.gz	RRSYAACXBJFWRS-GOSISDBHSA-N	-1	0	355.415	2.814	50	0		FFAARM
COc1ccc(-c2cc(C(=O)N3CCC[C@H]3C(=O)[O-])c(C)o2)cc1OC	ZINC000000811801	210274403	/nfs/dbraw/zinc/27/44/03/210274403.db2.gz	PAFBZCCPXRQOJW-AWEZNQCLSA-N	-1	0	359.378	2.961	50	0		FFAARM
CCOC(=O)c1cccc(NC(=O)Cc2c(C(=O)[O-])c(C)cn2CC)c1	ZINC000064980710	221161635	/nfs/dbraw/zinc/16/16/35/221161635.db2.gz	VOICWJBDEMCPPL-UHFFFAOYSA-N	-1	0	358.394	2.873	50	0		FFAARM
O=C([O-])c1nnn(-c2cccc(OC(F)(F)F)c2)c1-c1cccnc1	ZINC000065288253	221195873	/nfs/dbraw/zinc/19/58/73/221195873.db2.gz	ZQQOTWAPGLDBCG-UHFFFAOYSA-N	-1	0	350.256	2.926	50	0		FFAARM
Cc1cc(Br)c([O-])c(C(=O)N2CCC(n3cncn3)CC2)c1	ZINC000065476184	221223808	/nfs/dbraw/zinc/22/38/08/221223808.db2.gz	UFXUGDDKSIYHNN-UHFFFAOYSA-N	-1	0	365.231	2.532	50	0		FFAARM
Cc1c(C(=O)[O-])sc2ncnc(NCc3noc([C@@H]4CCCO4)n3)c12	ZINC000067654149	221266850	/nfs/dbraw/zinc/26/68/50/221266850.db2.gz	AQLCZZLKZXVMFN-QMMMGPOBSA-N	-1	0	361.383	2.545	50	0		FFAARM
Cc1c(C(=O)[O-])sc2ncnc(NCc3noc([C@H]4CCCO4)n3)c12	ZINC000067654150	221267098	/nfs/dbraw/zinc/26/70/98/221267098.db2.gz	AQLCZZLKZXVMFN-MRVPVSSYSA-N	-1	0	361.383	2.545	50	0		FFAARM
Cc1n[nH]c(C)c1CCc1nnc(SCC(=O)[O-])n1-c1ccccc1	ZINC000067783783	221284511	/nfs/dbraw/zinc/28/45/11/221284511.db2.gz	ZWUPDNQACLJIOZ-UHFFFAOYSA-N	-1	0	357.439	2.569	50	0		FFAARM
CC(C)C(=O)Nc1ccc(NC(=O)c2nccnc2C(=O)[O-])cc1Cl	ZINC000071284195	221339661	/nfs/dbraw/zinc/33/96/61/221339661.db2.gz	LWFKMXIPDIDABY-UHFFFAOYSA-N	-1	0	362.773	2.675	50	0		FFAARM
O=C([O-])c1ccccc1CC(=O)Nc1cnn(Cc2cccc(F)c2)c1	ZINC000072401027	221494518	/nfs/dbraw/zinc/49/45/18/221494518.db2.gz	MKXOAYCDZSCLFR-UHFFFAOYSA-N	-1	0	353.353	2.950	50	0		FFAARM
C[C@@H](CNc1nccc(-c2cc(C(=O)[O-])ccn2)n1)Oc1cccnc1	ZINC000072418280	221505700	/nfs/dbraw/zinc/50/57/00/221505700.db2.gz	HJMWEDHSASRESR-LBPRGKRZSA-N	-1	0	351.366	2.511	50	0		FFAARM
Cc1cc(C)n(CCCNc2nccc(-c3cc(C(=O)[O-])ccn3)n2)n1	ZINC000072433303	221525626	/nfs/dbraw/zinc/52/56/26/221525626.db2.gz	NSZVCOSPOWZJSK-UHFFFAOYSA-N	-1	0	352.398	2.552	50	0		FFAARM
COCCC[C@@H]1CCCN(c2nccc(-c3cc(C(=O)[O-])ccn3)n2)C1	ZINC000077380029	132182619	/nfs/dbraw/zinc/18/26/19/132182619.db2.gz	JHIRBRASBRXLEL-AWEZNQCLSA-N	-1	0	356.426	2.880	50	0		FFAARM
CCSc1ccc([C@H](C(=O)[O-])N2CCN(c3cnccn3)CC2)cc1	ZINC000095385878	132210132	/nfs/dbraw/zinc/21/01/32/132210132.db2.gz	LLLJAXQFGZJRDR-QGZVFWFLSA-N	-1	0	358.467	2.537	50	0		FFAARM
O=C([O-])c1cccc(CNC(=O)C2CCN(c3ccc(Cl)cn3)CC2)c1	ZINC000238214120	132248979	/nfs/dbraw/zinc/24/89/79/132248979.db2.gz	SSPFVQKKGDDEOG-UHFFFAOYSA-N	-1	0	373.840	2.966	50	0		FFAARM
CCn1cc(C)c(C(=O)[O-])c1CC(=O)N1CCN(c2ccccc2F)CC1	ZINC000064980651	136134248	/nfs/dbraw/zinc/13/42/48/136134248.db2.gz	VIXFRJSWFOXDHO-UHFFFAOYSA-N	-1	0	373.428	2.545	50	0		FFAARM
O=C([O-])C1(Cc2ccccc2Cl)CCN(c2ncnc3nc[nH]c32)CC1	ZINC000071415745	136139128	/nfs/dbraw/zinc/13/91/28/136139128.db2.gz	RMVLOXDSFLJJPQ-UHFFFAOYSA-N	-1	0	371.828	2.920	50	0		FFAARM
CCOc1ccc(-c2ccnc(N3CCc4n[nH]cc4C3)n2)cc1C(=O)[O-]	ZINC000072426536	136146413	/nfs/dbraw/zinc/14/64/13/136146413.db2.gz	WVPVOFFJCZWUGQ-UHFFFAOYSA-N	-1	0	365.393	2.526	50	0		FFAARM
CS[C@@H](C)C(=O)N1CCC(Oc2cc(C)ccc2F)(C(=O)[O-])CC1	ZINC000072475252	221547071	/nfs/dbraw/zinc/54/70/71/221547071.db2.gz	ZGENGNKFALFIIU-LBPRGKRZSA-N	-1	0	355.431	2.710	50	0		FFAARM
CCCN1CCn2cc(S(=O)(=O)[N-]c3cccc(CC)c3)cc2C1=O	ZINC000096102052	222024185	/nfs/dbraw/zinc/02/41/85/222024185.db2.gz	MONDOOBKALBKDL-UHFFFAOYSA-N	-1	0	361.467	2.717	50	0		FFAARM
COc1cc(OC)c(CN2CCc3[nH]nc(C4CC4)c3C2)c(C(=O)[O-])c1	ZINC000097600936	222196423	/nfs/dbraw/zinc/19/64/23/222196423.db2.gz	CIMBSBMMKDADSQ-UHFFFAOYSA-N	-1	0	357.410	2.561	50	0		FFAARM
C[C@H]1CCc2cc(F)cc3c([O-])c(C(=O)NCc4ccccn4)c(=O)n1c23	ZINC000100630057	222247936	/nfs/dbraw/zinc/24/79/36/222247936.db2.gz	UKGPVLKYKZWJSU-NSHDSACASA-N	-1	0	367.380	2.678	50	0		FFAARM
COc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccccc4)c=3c2=O)cc1Cl	ZINC000101168561	222265210	/nfs/dbraw/zinc/26/52/10/222265210.db2.gz	TVLMVWSDOOYSDP-JKSUJKDBSA-N	-1	0	370.796	2.842	50	0		FFAARM
CC(=O)Nc1nc(C(F)(F)F)nn1C([O-])=CC(=O)c1ccc(C)cc1	ZINC000101441271	222274323	/nfs/dbraw/zinc/27/43/23/222274323.db2.gz	YEPRHNOZEBPCAJ-XFFZJAGNSA-N	-1	0	354.288	2.803	50	0		FFAARM
CCOc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccc(C)cc4)c=3c2=O)cc1	ZINC000101417761	222274645	/nfs/dbraw/zinc/27/46/45/222274645.db2.gz	VKSHFEONZXWLGA-MSOLQXFVSA-N	-1	0	364.405	2.887	50	0		FFAARM
Cc1ccc(Cc2c(C)nc3[n-]c(CN4CCCCC4)nn3c2=O)cc1	ZINC000101802881	222285260	/nfs/dbraw/zinc/28/52/60/222285260.db2.gz	NHUZEVJKOYEWOE-UHFFFAOYSA-N	-1	0	351.454	2.611	50	0		FFAARM
COc1ccc2c(c1)CCC[C@@H]2CC(=O)NCc1nc(C(=O)[O-])cs1	ZINC000124131141	222528120	/nfs/dbraw/zinc/52/81/20/222528120.db2.gz	SWNFUJBDFSQGNC-GFCCVEGCSA-N	-1	0	360.435	2.976	50	0		FFAARM
Cc1ccc(CCC(=O)N2CCC[C@@H](c3ccn(CC(=O)[O-])n3)C2)cc1	ZINC000426373561	263567935	/nfs/dbraw/zinc/56/79/35/263567935.db2.gz	BVSNNBIRDMILGH-QGZVFWFLSA-N	-1	0	355.438	2.615	50	0		FFAARM
Cc1cc(NC(=O)CSc2nnc(-c3ccc(C)cc3)c(=O)[n-]2)no1	ZINC000032778611	506294124	/nfs/dbraw/zinc/29/41/24/506294124.db2.gz	UEOKDNNLDJNKTH-UHFFFAOYSA-N	-1	0	357.395	2.580	50	0		FFAARM
O=C([O-])c1sccc1S(=O)(=O)NCc1coc(-c2cccs2)n1	ZINC000032885535	506305062	/nfs/dbraw/zinc/30/50/62/506305062.db2.gz	IHHMEYJQLCLZJH-UHFFFAOYSA-N	-1	0	370.433	2.641	50	0		FFAARM
CCCCNC(=O)c1ccc2c(c1)[n-]c(=S)n(CCCOCC)c2=O	ZINC000002972146	506305910	/nfs/dbraw/zinc/30/59/10/506305910.db2.gz	MLLIMLCCUBHIDR-UHFFFAOYSA-N	-1	0	363.483	2.642	50	0		FFAARM
CN([N-]S(=O)(=O)C(F)(F)F)c1ncc(C(F)(F)F)cc1Cl	ZINC000003125341	506311019	/nfs/dbraw/zinc/31/10/19/506311019.db2.gz	JMWAEJVGVOZOSJ-UHFFFAOYSA-N	-1	0	357.663	2.544	50	0		FFAARM
O=C(Nc1ccc(S(=O)(=O)[N-]c2ncccn2)cc1)c1cccc(F)c1	ZINC000003402919	506327528	/nfs/dbraw/zinc/32/75/28/506327528.db2.gz	TZANHCUGGQHQBK-UHFFFAOYSA-N	-1	0	372.381	2.669	50	0		FFAARM
CCCN1C(=O)c2ccc(C(=O)Nc3ccc(C(=O)[O-])cc3)cc2C1=O	ZINC000003667955	506350050	/nfs/dbraw/zinc/35/00/50/506350050.db2.gz	BQICONNVHSZBIM-UHFFFAOYSA-N	-1	0	352.346	2.643	50	0		FFAARM
COc1ccc(OC)c2c1cc(C(=O)N[C@@H](C(=O)[O-])c1ccccc1)n2C	ZINC000004000243	506353170	/nfs/dbraw/zinc/35/31/70/506353170.db2.gz	SGTHUBAJRGQKAA-QGZVFWFLSA-N	-1	0	368.389	2.751	50	0	biogenic	FFAARM
COc1ccc(OC)c(CNC(=O)Cc2c3ccccc3[nH]c2C(=O)[O-])c1	ZINC000003906774	506353286	/nfs/dbraw/zinc/35/32/86/506353286.db2.gz	YKHGYABGIGXSLB-UHFFFAOYSA-N	-1	0	368.389	2.742	50	0		FFAARM
NC(=O)c1sc(-c2ccc(Cl)cc2)cc1NC(=O)/C=C\C(=O)[O-]	ZINC000033382178	506356486	/nfs/dbraw/zinc/35/64/86/506356486.db2.gz	BABSHXLTCZFKHW-WAYWQWQTSA-N	-1	0	350.783	2.747	50	0		FFAARM
CC[C@@H](C)[C@@H](C(=O)[O-])N1C(=O)N2CCc3c4ccccc4[nH]c3[C@@]2(C)C1=O	ZINC000004081534	506357313	/nfs/dbraw/zinc/35/73/13/506357313.db2.gz	VMYWFCHFKKXGGP-SZELWCTASA-N	-1	0	369.421	2.703	50	0	biogenic	FFAARM
O=C(CSC1=Nc2ccccc2S(=O)(=O)[N-]1)Nc1cccc(F)c1	ZINC000004306497	506370368	/nfs/dbraw/zinc/37/03/68/506370368.db2.gz	USOBOBCWLWJLDA-UHFFFAOYSA-N	-1	0	365.411	2.668	50	0		FFAARM
O=C([O-])[C@@H](Cc1ccc(F)cc1)NS(=O)(=O)c1ccc(Cl)s1	ZINC000004718040	506390292	/nfs/dbraw/zinc/39/02/92/506390292.db2.gz	CJPHWVSMONIVLR-SNVBAGLBSA-N	-1	0	363.819	2.515	50	0		FFAARM
COc1ccc2[nH]c(C(=O)N[C@H](C(=O)[O-])c3ccccc3)cc2c1OC	ZINC000035686332	506390495	/nfs/dbraw/zinc/39/04/95/506390495.db2.gz	IPHKFUFWTCLZCS-INIZCTEOSA-N	-1	0	354.362	2.741	50	0		FFAARM
Cc1ccc(N2C(=O)[N-]C(=O)C(=CNc3ccc(Cl)cn3)C2=O)cc1	ZINC000004852153	506399042	/nfs/dbraw/zinc/39/90/42/506399042.db2.gz	LPQUTPZXZRXJJM-UKTHLTGXSA-N	-1	0	356.769	2.622	50	0		FFAARM
O=C([O-])c1cccc(NC(=O)CSc2ncn(-c3ccccc3)n2)c1	ZINC000004843062	506399240	/nfs/dbraw/zinc/39/92/40/506399240.db2.gz	XRBMXJYGYVYVDP-UHFFFAOYSA-N	-1	0	354.391	2.696	50	0		FFAARM
O=C([O-])c1ccccc1C(=O)Nc1ccccc1C(=O)NC[C@H]1CCCO1	ZINC000005044057	506417510	/nfs/dbraw/zinc/41/75/10/506417510.db2.gz	UVMIWOBFCWOAMC-CYBMUJFWSA-N	-1	0	368.389	2.546	50	0		FFAARM
O=C([O-])c1ccc(Br)c(N2C(=O)[C@H]3CCCC[C@@H]3C2=O)c1	ZINC000005749403	506455795	/nfs/dbraw/zinc/45/57/95/506455795.db2.gz	DZJIVAZJTPUGRZ-UWVGGRQHSA-N	-1	0	352.184	2.827	50	0		FFAARM
O=C(Nc1nncs1)c1ccccc1[N-]S(=O)(=O)c1cccs1	ZINC000006147032	506469141	/nfs/dbraw/zinc/46/91/41/506469141.db2.gz	LXXXUNMQRTUNCZ-UHFFFAOYSA-N	-1	0	366.449	2.653	50	0		FFAARM
O=S(=O)([N-]c1ccc2c(c1)OCO2)c1ccccc1Br	ZINC000006368836	506479925	/nfs/dbraw/zinc/47/99/25/506479925.db2.gz	QYJVMZCHOKDKLB-UHFFFAOYSA-N	-1	0	356.197	2.979	50	0		FFAARM
COc1cc(-c2oc3cc([O-])cc(O)c3c(=O)c2O)cc(OC)c1OC	ZINC000006483700	506484498	/nfs/dbraw/zinc/48/44/98/506484498.db2.gz	LHNLHJJGLDWGFS-UHFFFAOYSA-N	-1	0	360.318	2.603	50	0		FFAARM
O=C([O-])[C@H]1C2CCC(CC2)[C@@H]1C(=O)N1CCN(CCc2ccccc2)CC1	ZINC000006742627	506502675	/nfs/dbraw/zinc/50/26/75/506502675.db2.gz	XIVKBHMAJIFYJK-GUMHCPJTSA-N	-1	0	370.493	2.510	50	0		FFAARM
COc1ccc(-c2cn3nc(N4CCC[C@@H](C(=O)[O-])C4)sc3n2)cc1	ZINC000006750924	506503910	/nfs/dbraw/zinc/50/39/10/506503910.db2.gz	SJWSVKJRBJJLTA-GFCCVEGCSA-N	-1	0	358.423	2.767	50	0		FFAARM
O=S(=O)([N-]c1ccc(S(=O)(=O)C(F)F)cc1)c1cccs1	ZINC000007052852	506528463	/nfs/dbraw/zinc/52/84/63/506528463.db2.gz	OBACNBQTWOESBY-UHFFFAOYSA-N	-1	0	353.393	2.545	50	0		FFAARM
CC(C)c1c(C(=O)/N=c2\[n-]nc3ccccn32)cnn1-c1ccc(F)cc1	ZINC000041837433	506558802	/nfs/dbraw/zinc/55/88/02/506558802.db2.gz	XTKFPGBMCHUFIS-UHFFFAOYSA-N	-1	0	364.384	3.430	50	0		FFAARM
CCOc1ccc(C(=O)[N-]S(=O)(=O)c2ccc(C)s2)cc1OCC	ZINC000042318099	506617953	/nfs/dbraw/zinc/61/79/53/506617953.db2.gz	CKXKMUMEULKLMB-UHFFFAOYSA-N	-1	0	369.464	2.973	50	0		FFAARM
CCC(NN1CCCCCC1)=C1C(=O)[N-]C(=O)N(c2ccc(C)cc2)C1=O	ZINC000009088067	506681909	/nfs/dbraw/zinc/68/19/09/506681909.db2.gz	SKFKYMHLTYHXGV-WUKNDPDISA-N	-1	0	370.453	2.827	50	0		FFAARM
CC[C@H](C)[C@@H](C(=O)[O-])N1C(=O)N2CCc3c4ccccc4[nH]c3[C@@]2(C)C1=O	ZINC000011692336	506789130	/nfs/dbraw/zinc/78/91/30/506789130.db2.gz	VMYWFCHFKKXGGP-ORBZYBPHSA-N	-1	0	369.421	2.703	50	0	biogenic	FFAARM
O=C([O-])c1ccccc1SCC(=O)N1CCN(c2ccccc2)CC1	ZINC000012606552	506883954	/nfs/dbraw/zinc/88/39/54/506883954.db2.gz	UGZUVOOHCGULBO-UHFFFAOYSA-N	-1	0	356.447	2.826	50	0		FFAARM
Cc1cc(C)c(S(=O)(=O)Nc2ccc3c(c2)OCCO3)cc1C(=O)[O-]	ZINC000045946386	507050306	/nfs/dbraw/zinc/05/03/06/507050306.db2.gz	VPLGUHAVCMOSSV-UHFFFAOYSA-N	-1	0	363.391	2.574	50	0		FFAARM
COc1cccc(C[C@@H](C(=O)Nc2cccc(C)c2C)c2nnn[n-]2)c1	ZINC000057524714	507284518	/nfs/dbraw/zinc/28/45/18/507284518.db2.gz	QCERGXFYEKWNLB-MRXNPFEDSA-N	-1	0	351.410	2.790	50	0		FFAARM
C[C@H](C[N-]S(=O)(=O)c1c(F)cccc1F)N1CCc2ccccc2C1	ZINC000028322801	507718825	/nfs/dbraw/zinc/71/88/25/507718825.db2.gz	ODUZGIXZDKQIRS-CYBMUJFWSA-N	-1	0	366.433	2.690	50	0		FFAARM
O=C(CSc1nc(=O)c2sccc2[n-]1)Nc1cc(F)ccc1F	ZINC000051317219	507761879	/nfs/dbraw/zinc/76/18/79/507761879.db2.gz	PXKRNGSBKMUZQG-UHFFFAOYSA-N	-1	0	353.375	2.994	50	0		FFAARM
Cc1cccn2c(CC(=O)N3CC[C@H](c4ccccc4C(=O)[O-])C3)cnc12	ZINC000072160966	507764142	/nfs/dbraw/zinc/76/41/42/507764142.db2.gz	VWXBWIFYZKRKSV-HNNXBMFYSA-N	-1	0	363.417	2.900	50	0		FFAARM
O=C([O-])CCc1cc2n(n1)CCN(Cc1ccc([C@@H]3CCCO3)s1)C2	ZINC000072168123	507767723	/nfs/dbraw/zinc/76/77/23/507767723.db2.gz	AIGQQUHMWLTCRA-INIZCTEOSA-N	-1	0	361.467	2.829	50	0		FFAARM
COc1ccc(NS(=O)(=O)c2cccc(C(=O)[O-])c2)cc1OC(F)F	ZINC000029326163	507774006	/nfs/dbraw/zinc/77/40/06/507774006.db2.gz	WSUIGYMOHFCMNQ-UHFFFAOYSA-N	-1	0	373.333	2.796	50	0		FFAARM
CC(C)Cn1cncc1CNc1nccc(-c2cc(C(=O)[O-])ccn2)n1	ZINC000072411861	507786122	/nfs/dbraw/zinc/78/61/22/507786122.db2.gz	MMFPHPMAZKRYIB-UHFFFAOYSA-N	-1	0	352.398	2.701	50	0		FFAARM
CCC[C@@H](Nc1nccc(-c2cc(C(=O)[O-])ccn2)n1)c1nccn1C	ZINC000072428124	507789216	/nfs/dbraw/zinc/78/92/16/507789216.db2.gz	RHXDETSCJQDERM-CQSZACIVSA-N	-1	0	352.398	2.924	50	0		FFAARM
O=C([O-])C[C@H]1COCCN1C(=O)c1ccc(Cn2ccc3ccccc32)o1	ZINC000072435011	507791110	/nfs/dbraw/zinc/79/11/10/507791110.db2.gz	RJTPKVXATVLPTO-HNNXBMFYSA-N	-1	0	368.389	2.598	50	0		FFAARM
O=C(CCNC(=O)c1ccc([O-])c(Cl)c1)N1CCc2sccc2C1	ZINC000052220785	507802797	/nfs/dbraw/zinc/80/27/97/507802797.db2.gz	QXAYVZRGMSGXDF-UHFFFAOYSA-N	-1	0	364.854	2.812	50	0		FFAARM
O=C([O-])[C@@]1(CC2CC2)CCCN(C(=O)c2ccc(-n3ccnc3)cc2)C1	ZINC000091445170	507986856	/nfs/dbraw/zinc/98/68/56/507986856.db2.gz	XBLDOIORRLEXFI-HXUWFJFHSA-N	-1	0	353.422	2.979	50	0		FFAARM
CCc1nc(C)ccc1OCC(=O)N1C[C@@H](c2ccccc2)[C@H](C(=O)[O-])C1	ZINC000091915364	508024478	/nfs/dbraw/zinc/02/44/78/508024478.db2.gz	XFQLSIXVTFAKKH-DLBZAZTESA-N	-1	0	368.433	2.658	50	0		FFAARM
CCC[C@]1(C(=O)[O-])CCCN(C(=O)c2c(C)nn3c2nc(C)cc3C)C1	ZINC000092037496	508035542	/nfs/dbraw/zinc/03/55/42/508035542.db2.gz	WXLXMXSXHMMIDW-IBGZPJMESA-N	-1	0	358.442	2.762	50	0		FFAARM
COc1ccccc1[C@@H]1CN(C(=O)c2ccccc2N(C)C)C[C@H]1C(=O)[O-]	ZINC000092061923	508038541	/nfs/dbraw/zinc/03/85/41/508038541.db2.gz	XWQBWDUOXUDQES-DLBZAZTESA-N	-1	0	368.433	2.702	50	0		FFAARM
CCOc1ccccc1[N-]S(=O)(=O)c1c[nH]c(-c2nnc(CC)o2)c1	ZINC000075428073	508106457	/nfs/dbraw/zinc/10/64/57/508106457.db2.gz	UYHVRTLEPSELSS-UHFFFAOYSA-N	-1	0	362.411	2.827	50	0		FFAARM
CC1CCN(C(=O)c2cccc([C@@H](C(=O)[O-])N3CCSCC3)c2)CC1	ZINC000095362248	508176279	/nfs/dbraw/zinc/17/62/79/508176279.db2.gz	FMCXXXDNFJHLHD-KRWDZBQOSA-N	-1	0	362.495	2.733	50	0		FFAARM
CN1C(=O)C[C@@H](C(=O)[O-])C12CCN(Cc1ccc(Cl)c(Cl)c1)CC2	ZINC000095387931	508183023	/nfs/dbraw/zinc/18/30/23/508183023.db2.gz	JRNUCXHJAKAASM-LBPRGKRZSA-N	-1	0	371.264	2.891	50	0		FFAARM
COc1cc(C(=O)NC(C)(C)c2ccc(F)cc2)ccc1OCC(=O)[O-]	ZINC000095464119	508187305	/nfs/dbraw/zinc/18/73/05/508187305.db2.gz	GHKBRSBENFJBIL-UHFFFAOYSA-N	-1	0	361.369	2.963	50	0		FFAARM
O=S(=O)([N-]c1ccc(S(=O)(=O)C2CCCC2)cc1)c1cccnc1	ZINC000095466331	508187499	/nfs/dbraw/zinc/18/74/99/508187499.db2.gz	LOQDVPVQOLCARE-UHFFFAOYSA-N	-1	0	366.464	2.599	50	0		FFAARM
C[C@H](Cc1cccc(F)c1)C(=O)N1CCC[C@@H](n2cc(C(=O)[O-])cn2)C1	ZINC000153230776	508561300	/nfs/dbraw/zinc/56/13/00/508561300.db2.gz	ACNZSOQUDRAGFD-CXAGYDPISA-N	-1	0	359.401	2.763	50	0		FFAARM
COc1ccc(Br)cc1CCC(=O)N1CC[C@@](C)(C(=O)[O-])C1	ZINC000237121927	509575529	/nfs/dbraw/zinc/57/55/29/509575529.db2.gz	LWRZIVFKZASQEQ-MRXNPFEDSA-N	-1	0	370.243	2.714	50	0		FFAARM
O=C(COC(=O)c1cc(F)c([O-])c(Cl)c1)NCc1ccccc1F	ZINC000170616570	509681293	/nfs/dbraw/zinc/68/12/93/509681293.db2.gz	GTZSPLSBTMBGTG-UHFFFAOYSA-N	-1	0	355.724	2.797	50	0		FFAARM
COC(=O)c1sc2[n-]c([C@H]3COc4ccccc4O3)nc(=O)c2c1C	ZINC000170616539	509681932	/nfs/dbraw/zinc/68/19/32/509681932.db2.gz	PLHYDQNHVSEWES-LLVKDONJSA-N	-1	0	358.375	2.592	50	0		FFAARM
Cc1nn(C)c(Cl)c1S(=O)(=O)[N-]c1cccc(-n2cccc2)c1	ZINC000170620122	509683259	/nfs/dbraw/zinc/68/32/59/509683259.db2.gz	FUZFAQAISMALRX-UHFFFAOYSA-N	-1	0	350.831	2.973	50	0		FFAARM
CCS(=O)(=O)[N-]C(=O)c1csc(-c2ccc(OC(C)C)cc2)n1	ZINC000170625758	509685502	/nfs/dbraw/zinc/68/55/02/509685502.db2.gz	CQFCGOWVOIBELV-UHFFFAOYSA-N	-1	0	354.453	2.677	50	0		FFAARM
Cn1c(C(=O)N(CCC(=O)[O-])C[C@H]2CCCO2)ccc1-c1ccccc1	ZINC000237709984	509718008	/nfs/dbraw/zinc/71/80/08/509718008.db2.gz	DPUJAINLURFTAQ-MRXNPFEDSA-N	-1	0	356.422	2.788	50	0		FFAARM
Cc1ccc(-c2nc(C(=O)N3CCO[C@H](CC(=O)[O-])C3)cs2)c(C)c1	ZINC000237748309	509725993	/nfs/dbraw/zinc/72/59/93/509725993.db2.gz	DPYYCJXQSQSYSY-CYBMUJFWSA-N	-1	0	360.435	2.743	50	0		FFAARM
O=C([O-])CC[C@H]1CCCN(C(=O)/C=C/c2ccc(N3CCCC3=O)cc2)C1	ZINC000238016192	509799155	/nfs/dbraw/zinc/79/91/55/509799155.db2.gz	SQMFFWBQRWCGBI-VDZSZVPASA-N	-1	0	370.449	2.930	50	0		FFAARM
O=C([O-])c1ccc(CCNC(=O)CC[C@@H]2Cc3ccccc3NC2=O)cc1	ZINC000238081283	509815723	/nfs/dbraw/zinc/81/57/23/509815723.db2.gz	AAGBLUNQXAQUEN-QGZVFWFLSA-N	-1	0	366.417	2.635	50	0		FFAARM
O=C([O-])CN(C(=O)[C@H]1C[C@@H]1c1c(F)cccc1Cl)C1CCOCC1	ZINC000238104598	509821530	/nfs/dbraw/zinc/82/15/30/509821530.db2.gz	LPGSFIMUFIMLKY-RYUDHWBXSA-N	-1	0	355.793	2.675	50	0		FFAARM
CC[C@](C)(NC(=O)c1cccc(C(=O)N(C)c2ccccc2)c1)C(=O)[O-]	ZINC000262506290	510302846	/nfs/dbraw/zinc/30/28/46/510302846.db2.gz	ZYQGNZCRMXBVBX-FQEVSTJZSA-N	-1	0	354.406	2.946	50	0		FFAARM
Cc1nn(-c2ccc(F)cc2F)c(C)c1C(=O)N1CC[C@](C)(C(=O)[O-])C1	ZINC000299745793	511668335	/nfs/dbraw/zinc/66/83/35/511668335.db2.gz	SKWVWGWNAVTHBW-SFHVURJKSA-N	-1	0	363.364	2.704	50	0		FFAARM
CCOc1ccc2c(c1)C[C@@H](C(=O)N(C)Cc1cc(C(=O)[O-])c(C)o1)CO2	ZINC000299748646	511668514	/nfs/dbraw/zinc/66/85/14/511668514.db2.gz	HTYBIMSPDCMSCK-CQSZACIVSA-N	-1	0	373.405	2.895	50	0		FFAARM
O=C([O-])[C@H]1COCCN1C(=O)c1cn(Cc2ccccc2)c2ccccc12	ZINC000299753575	511668600	/nfs/dbraw/zinc/66/86/00/511668600.db2.gz	YRRSHQGPZDBKAN-LJQANCHMSA-N	-1	0	364.401	2.615	50	0		FFAARM
O=C([O-])[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc2c(c1)CCO2	ZINC000299739742	511669150	/nfs/dbraw/zinc/66/91/50/511669150.db2.gz	ANOYKCGLURIVKB-QGZVFWFLSA-N	-1	0	350.374	2.529	50	0		FFAARM
C[C@@H]1Sc2ccc(C(=O)NCCc3ccc(C(=O)[O-])cc3)cc2NC1=O	ZINC000521402333	517714109	/nfs/dbraw/zinc/71/41/09/517714109.db2.gz	MNZOSAFPALHILC-NSHDSACASA-N	-1	0	370.430	2.790	50	0		FFAARM
Cc1cccc2c1[nH]c(C)c(CC[C@@H](C)NCc1n[n-]c(=N)s1)c2=O	ZINC000534664702	517990054	/nfs/dbraw/zinc/99/00/54/517990054.db2.gz	IWBLXXTUGMMGTH-LLVKDONJSA-N	-1	0	357.483	2.690	50	0		FFAARM
C[C@H]1CN(Cc2ccccc2NC(=O)c2ccc(C(=O)[O-])nc2)C[C@H](C)O1	ZINC000612566416	520025031	/nfs/dbraw/zinc/02/50/31/520025031.db2.gz	KRGMRPTUAGJCFB-KBPBESRZSA-N	-1	0	369.421	2.641	50	0		FFAARM
C[C@@H]1C[C@H](C(=O)NCc2ccnc(Oc3ccc(F)cc3)c2)O[C@H]1C(=O)[O-]	ZINC000630164312	522666927	/nfs/dbraw/zinc/66/69/27/522666927.db2.gz	DUMDWBMXVNCZOX-RGYTYGDFSA-N	-1	0	374.368	2.507	50	0		FFAARM
O=C([O-])[C@H](CNC(=O)c1ccncc1Br)C1CCCCC1	ZINC000630265101	522749561	/nfs/dbraw/zinc/74/95/61/522749561.db2.gz	LOHDMVWJGREUEF-GFCCVEGCSA-N	-1	0	355.232	2.855	50	0		FFAARM
CSCC[C@H](NC(=O)Cc1csc(-c2ccccc2)n1)C(=O)[O-]	ZINC000020727476	525589179	/nfs/dbraw/zinc/58/91/79/525589179.db2.gz	ILKLLRNHSPUTKF-ZDUSSCGKSA-N	-1	0	350.465	2.675	50	0		FFAARM
O=C([O-])c1ccc(CCNC(=O)[C@H]2C[C@@H]2c2ccc3c(c2)OCCO3)cc1	ZINC000299748764	526364598	/nfs/dbraw/zinc/36/45/98/526364598.db2.gz	ICEBUTZXBQDAQE-SJORKVTESA-N	-1	0	367.401	2.618	50	0		FFAARM
O=C([O-])c1ccc(N2CCC(c3nccn3Cc3ccccn3)CC2)nc1	ZINC000091551475	526373383	/nfs/dbraw/zinc/37/33/83/526373383.db2.gz	SHSHMJFLKMUNDG-UHFFFAOYSA-N	-1	0	363.421	2.804	50	0		FFAARM
O=C([N-]O[C@H]1CCCCO1)[C@H]1CC(=O)N(c2cccc3ccccc32)C1	ZINC000065513498	526852499	/nfs/dbraw/zinc/85/24/99/526852499.db2.gz	WEFSUUPGKYLXGH-KXBFYZLASA-N	-1	0	354.406	2.767	50	0		FFAARM
O=C([O-])C[C@H]1CN(C(=O)c2cccc(COc3cccc(F)c3)c2)CCO1	ZINC000262466613	527636721	/nfs/dbraw/zinc/63/67/21/527636721.db2.gz	YENKPSFUHCCIQU-SFHVURJKSA-N	-1	0	373.380	2.720	50	0		FFAARM
Cc1cc(C(=O)N2[C@@H]3CCCC[C@@H]3C[C@H]2C(=O)[O-])ccc1N1CCOCC1	ZINC000647730866	568065824	/nfs/dbraw/zinc/06/58/24/568065824.db2.gz	ZMNZYPNDXHRJEM-LZQZEXGQSA-N	-1	0	372.465	2.690	50	0		FFAARM
O=C([O-])C[C@H]1CN(C(=O)c2csc(-c3cccc(Cl)c3)n2)CCO1	ZINC000238061992	570855894	/nfs/dbraw/zinc/85/58/94/570855894.db2.gz	WWDYDXPVBAPECM-LBPRGKRZSA-N	-1	0	366.826	2.779	50	0		FFAARM
CCOC(=O)CN(C)c1ccc(NC(=O)c2ccc(C)cc2)cc1C(=O)[O-]	ZINC000046053499	570922177	/nfs/dbraw/zinc/92/21/77/570922177.db2.gz	PINSRUSWOWIEEJ-UHFFFAOYSA-N	-1	0	370.405	2.945	50	0		FFAARM
Cc1c(C(=O)NC2(CC(=O)[O-])CCOCC2)sc2nc(C)cc(C)c12	ZINC000119468881	571106312	/nfs/dbraw/zinc/10/63/12/571106312.db2.gz	BNMHPSXXOPESGL-UHFFFAOYSA-N	-1	0	362.451	2.975	50	0		FFAARM
CCN(Cc1cccc(F)c1)S(=O)(=O)c1ccc(C(=O)[O-])cc1F	ZINC000170011952	571260458	/nfs/dbraw/zinc/26/04/58/571260458.db2.gz	JNVHYVFETJDKND-UHFFFAOYSA-N	-1	0	355.362	2.874	50	0		FFAARM
O=C([O-])CCC1CCN(S(=O)(=O)c2cccc3c2N=S=N3)CC1	ZINC000321416092	571335078	/nfs/dbraw/zinc/33/50/78/571335078.db2.gz	JVZOKVDMJHYJPZ-UHFFFAOYSA-N	-1	0	355.441	2.679	50	0		FFAARM
CC(C)(C(=O)[O-])n1ccc(NC(=O)c2csc(Br)c2)n1	ZINC000659203785	731950596	/nfs/dbraw/zinc/95/05/96/731950596.db2.gz	IKEFHEYIQJDPAF-UHFFFAOYSA-N	-1	0	358.217	2.779	50	0		FFAARM
Cc1ccc(-n2[n-]c(C(=O)N[C@H]3CCC[C@@H](OC(F)F)C3)cc2=O)cc1	ZINC000888092742	976545841	/nfs/dbraw/zinc/54/58/41/976545841.db2.gz	ZIKCQLJSMSFYDV-GXTWGEPZSA-N	-1	0	365.380	2.754	50	0		FFAARM
CCO[C@H]1C[C@H](O)C12CCN(C(=O)c1ccc3[n-]c(=S)oc3c1)CC2	ZINC000175191521	222614665	/nfs/dbraw/zinc/61/46/65/222614665.db2.gz	PNBQRYVVBYUBDN-GJZGRUSLSA-N	-1	0	362.451	2.509	50	0		FFAARM
O=S(=O)(NC[C@@H]1CCCO1)c1cc(Cl)ccc1Br	ZINC000000758102	219319017	/nfs/dbraw/zinc/31/90/17/219319017.db2.gz	AOHGQCPMEHMVAK-VIFPVBQESA-N	-1	0	354.653	2.560	50	0		FFAARM
COc1ccc(NC(=O)c2cccc(NC(=O)CCC(=O)[O-])c2)c(OC)c1	ZINC000000991837	219350871	/nfs/dbraw/zinc/35/08/71/219350871.db2.gz	RLBGPXYBYYAOPZ-UHFFFAOYSA-N	-1	0	372.377	2.759	50	0		FFAARM
CC(C)c1cc(C(=O)N(CCC(=O)[O-])C2CCOCC2)nn1C(C)(C)C	ZINC000236881261	222903729	/nfs/dbraw/zinc/90/37/29/222903729.db2.gz	NTXWFMJHNHLYBH-UHFFFAOYSA-N	-1	0	365.474	2.857	50	0		FFAARM
CCOC(=O)Cc1sc(NC(=O)CCC(=O)[O-])nc1-c1ccccc1	ZINC000003363390	219504839	/nfs/dbraw/zinc/50/48/39/219504839.db2.gz	WDVLHBHMSKAGQT-UHFFFAOYSA-N	-1	0	362.407	2.719	50	0		FFAARM
C/C(=C\C(=O)Nc1sc2c(c1C(N)=O)CC[C@H](C(C)(C)C)C2)C(=O)[O-]	ZINC000005516738	219686902	/nfs/dbraw/zinc/68/69/02/219686902.db2.gz	PVDNLIOZJYZEOE-PCYYEKQGSA-N	-1	0	364.467	2.967	50	0		FFAARM
O=C([O-])c1c(NC(=O)N(CCO)Cc2ccccc2)sc2c1CCC2	ZINC000006669314	219744610	/nfs/dbraw/zinc/74/46/10/219744610.db2.gz	KKPSNNODLSBTBT-UHFFFAOYSA-N	-1	0	360.435	2.961	50	0		FFAARM
COc1ccc(OC)c2[nH]c(C(=O)N[C@H](C(=O)[O-])c3ccccc3)cc21	ZINC000008879506	219871383	/nfs/dbraw/zinc/87/13/83/219871383.db2.gz	IWFKXMXHKHTPHT-INIZCTEOSA-N	-1	0	354.362	2.741	50	0	biogenic	FFAARM
CCc1c([O-])nc(SCC(=O)NC(C)(C)C)n(-c2ccccc2)c1=O	ZINC000009183603	219875764	/nfs/dbraw/zinc/87/57/64/219875764.db2.gz	ZLRJUXLZDJKLIQ-UHFFFAOYSA-N	-1	0	361.467	2.507	50	0		FFAARM
CCOc1cc2c(cc1[N-]S(=O)(=O)c1c(C)noc1C)O[C@H](C)C2	ZINC000012508254	220002241	/nfs/dbraw/zinc/00/22/41/220002241.db2.gz	OHSUKSZIASNGFV-SECBINFHSA-N	-1	0	352.412	2.814	50	0		FFAARM
CS(=O)(=O)[N-]c1ccccc1C(=O)NCc1nc2ccccc2s1	ZINC000012790765	220030045	/nfs/dbraw/zinc/03/00/45/220030045.db2.gz	CTBCIIYKCXKNSZ-UHFFFAOYSA-N	-1	0	361.448	2.598	50	0		FFAARM
O=C([O-])COc1ccccc1/C=C1\N=C(c2ccc(F)cc2F)OC1=O	ZINC000012799904	220031560	/nfs/dbraw/zinc/03/15/60/220031560.db2.gz	GHJTXARQAMTFHI-AUWJEWJLSA-N	-1	0	359.284	2.773	50	0		FFAARM
O=C([O-])c1ccc(CNC(=O)CSc2nnc(C3CC3)n2C2CC2)cc1	ZINC000013035911	220054915	/nfs/dbraw/zinc/05/49/15/220054915.db2.gz	ZEJJAQLJXVAACY-UHFFFAOYSA-N	-1	0	372.450	2.597	50	0		FFAARM
O=C([O-])C1CCN(C(=O)CCCOc2ccc(Br)cc2)CC1	ZINC000013167205	220061633	/nfs/dbraw/zinc/06/16/33/220061633.db2.gz	WIRQSVSFUJLLTC-UHFFFAOYSA-N	-1	0	370.243	2.931	50	0		FFAARM
O=C([O-])C1CCN(S(=O)(=O)c2ccc(Cl)cc2C(F)(F)F)CC1	ZINC000013262582	220062178	/nfs/dbraw/zinc/06/21/78/220062178.db2.gz	OMJSGLCWCDHBQA-UHFFFAOYSA-N	-1	0	371.764	2.844	50	0		FFAARM
CCN(Cc1ccncc1)S(=O)(=O)c1ccc(Cl)c(C(=O)[O-])c1	ZINC000013250753	220062200	/nfs/dbraw/zinc/06/22/00/220062200.db2.gz	FTZWGYRELMEKPU-UHFFFAOYSA-N	-1	0	354.815	2.644	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)c1ccc2c(c1)OCCCO2)c1ccc(F)cc1	ZINC000013257945	220062600	/nfs/dbraw/zinc/06/26/00/220062600.db2.gz	HKIUGLKXOFFTGE-OAHLLOKOSA-N	-1	0	359.353	2.933	50	0		FFAARM
CN(Cc1nc(=O)c2sccc2[n-]1)C(=O)c1cc(-c2ccccc2)n[nH]1	ZINC000014372193	220123326	/nfs/dbraw/zinc/12/33/26/220123326.db2.gz	BZTKKHHTADWGGA-UHFFFAOYSA-N	-1	0	365.418	2.647	50	0		FFAARM
CCCCCC(=O)Nn1c(=O)c2c(C)c(C(=O)[O-])sc2[nH]c1=S	ZINC000017073472	220201821	/nfs/dbraw/zinc/20/18/21/220201821.db2.gz	JSUDFAJPYQIRQK-UHFFFAOYSA-N	-1	0	355.441	2.778	50	0		FFAARM
Cn1ncc(C(=O)[O-])c1C(=O)Nc1nc(-c2ccc(F)cc2F)cs1	ZINC000020614507	220336513	/nfs/dbraw/zinc/33/65/13/220336513.db2.gz	NOJOTPZTERHFFF-UHFFFAOYSA-N	-1	0	364.333	2.772	50	0		FFAARM
O=C([O-])CCNC(=O)Cc1csc(-c2cccc(Br)c2)n1	ZINC000020732903	220340782	/nfs/dbraw/zinc/34/07/82/220340782.db2.gz	SXNCRMLWNSHMBO-UHFFFAOYSA-N	-1	0	369.240	2.706	50	0		FFAARM
CCc1cccc([N-]S(=O)(=O)c2ccc(-c3ccc(=O)[nH]n3)s2)c1	ZINC000021531505	220359669	/nfs/dbraw/zinc/35/96/69/220359669.db2.gz	BNPAJFLOSCFTSV-UHFFFAOYSA-N	-1	0	361.448	2.862	50	0		FFAARM
Cc1cc(C(=O)[O-])cc(S(=O)(=O)Nc2ccc(-n3cccn3)cc2)c1C	ZINC000024577641	220453598	/nfs/dbraw/zinc/45/35/98/220453598.db2.gz	LRUBFMJGGGOVAV-UHFFFAOYSA-N	-1	0	371.418	2.988	50	0		FFAARM
O=C(Nc1ccc([N-]S(=O)(=O)c2cccs2)cc1)[C@@H]1CCCO1	ZINC000030531675	220620128	/nfs/dbraw/zinc/62/01/28/220620128.db2.gz	ZAHLBLOTFRWLBN-ZDUSSCGKSA-N	-1	0	352.437	2.666	50	0		FFAARM
CC[C@@H](C)NC(=O)CCc1nnc(-c2cccc(OCC3CC3)c2)[n-]c1=O	ZINC000034765414	220762007	/nfs/dbraw/zinc/76/20/07/220762007.db2.gz	CXWJBJABXBDYNL-CYBMUJFWSA-N	-1	0	370.453	2.880	50	0		FFAARM
CC(C)CCn1c2ccc(C(=O)[O-])cc2n(CCC(=O)N2CCCC2)c1=O	ZINC000055413798	221069409	/nfs/dbraw/zinc/06/94/09/221069409.db2.gz	SLLMTHGGIDGIJJ-UHFFFAOYSA-N	-1	0	373.453	2.560	50	0		FFAARM
Cc1nnc(-c2ccc(S(=O)(=O)[N-]c3ccc4c(c3)OCO4)s2)o1	ZINC000064920045	221156176	/nfs/dbraw/zinc/15/61/76/221156176.db2.gz	ZCZCPDNGIUNOEI-UHFFFAOYSA-N	-1	0	365.392	2.636	50	0		FFAARM
COc1ccc2c(c1)S[C@@H](CC(=O)Nc1ccc(C(=O)[O-])cc1)C(=O)N2	ZINC000061720352	221136085	/nfs/dbraw/zinc/13/60/85/221136085.db2.gz	AQVIJQWBQXNBSQ-HNNXBMFYSA-N	-1	0	372.402	2.835	50	0		FFAARM
Cc1cccc([N-]S(=O)(=O)c2cc(-c3ccc(=O)[nH]n3)cs2)c1C	ZINC000065119291	221170746	/nfs/dbraw/zinc/17/07/46/221170746.db2.gz	JCAWVWKTPMLUMV-UHFFFAOYSA-N	-1	0	361.448	2.916	50	0		FFAARM
COC(=O)c1ccccc1S(=O)(=O)[N-]c1cc(-c2ccsc2)no1	ZINC000065153439	221173803	/nfs/dbraw/zinc/17/38/03/221173803.db2.gz	ZEKMILZGSXRZLR-UHFFFAOYSA-N	-1	0	364.404	2.991	50	0		FFAARM
COc1cc(C)c(S(=O)(=O)Nc2cccc(F)c2C(=O)[O-])cc1C	ZINC000065502844	221226729	/nfs/dbraw/zinc/22/67/29/221226729.db2.gz	RCAJCVMXNWDYQU-UHFFFAOYSA-N	-1	0	353.371	2.950	50	0		FFAARM
O=C([O-])Cc1cc(C2CCN(C(=O)C/C=C/c3ccccc3)CC2)[nH]n1	ZINC000067867796	221296988	/nfs/dbraw/zinc/29/69/88/221296988.db2.gz	KCBGGACVSZVFJE-QPJJXVBHSA-N	-1	0	353.422	2.846	50	0		FFAARM
Cc1c(C(=O)[O-])sc2ncnc(NCCC(=O)NC3CCCCC3)c12	ZINC000067934341	221306334	/nfs/dbraw/zinc/30/63/34/221306334.db2.gz	SKSPLHRKALBQTJ-UHFFFAOYSA-N	-1	0	362.455	2.949	50	0		FFAARM
CCOC(=O)c1[nH]c2ccc(OC)cc2c1NC(=O)[C@@H]1[C@H](C(=O)[O-])C1(C)C	ZINC000071279451	221336999	/nfs/dbraw/zinc/33/69/99/221336999.db2.gz	UQYQULXLCVFVSY-QWHCGFSZSA-N	-1	0	374.393	2.649	50	0		FFAARM
COc1ccc(NC(=O)c2ccco2)cc1NC(=O)[C@@H]1[C@H](C(=O)[O-])C1(C)C	ZINC000071280252	221337535	/nfs/dbraw/zinc/33/75/35/221337535.db2.gz	GAPPSYFMDMHCDV-LSDHHAIUSA-N	-1	0	372.377	2.836	50	0		FFAARM
CCOC(=O)Cn1nc(C)c2c1NC(=O)C[C@H]2c1ccc(C(=O)[O-])cc1	ZINC000071281823	221338505	/nfs/dbraw/zinc/33/85/05/221338505.db2.gz	OZIXABBKLRBNJV-ZDUSSCGKSA-N	-1	0	357.366	2.576	50	0		FFAARM
CC1(C)[C@H](C(=O)[O-])[C@H]1C(=O)Nc1cc(Cl)ccc1C(=O)N1CCCC1	ZINC000071285649	221339531	/nfs/dbraw/zinc/33/95/31/221339531.db2.gz	NUVHWRWGGRJMPG-KBPBESRZSA-N	-1	0	364.829	2.871	50	0		FFAARM
O=C([O-])c1ccccc1CC(=O)Nc1cc(Cl)ccc1-n1cncn1	ZINC000071287104	221340646	/nfs/dbraw/zinc/34/06/46/221340646.db2.gz	KFOBLMKMTGTDLC-UHFFFAOYSA-N	-1	0	356.769	2.800	50	0		FFAARM
CCn1c(SCC(=O)[O-])nnc1[C@H](C)NC(=O)c1ccc(Cl)cc1	ZINC000072328105	221467499	/nfs/dbraw/zinc/46/74/99/221467499.db2.gz	PMFCQSXMWLKCCF-VIFPVBQESA-N	-1	0	368.846	2.619	50	0		FFAARM
O=c1c([O-])cc(-c2ccccc2Cl)nn1-c1ncnc2ccccc21	ZINC000101644365	132234247	/nfs/dbraw/zinc/23/42/47/132234247.db2.gz	PLKUKHRFCVAQHQ-UHFFFAOYSA-N	-1	0	350.765	2.993	50	0		FFAARM
O=C([O-])Cn1cc(-c2ccccc2)c2ncnc(N3CCSCC3)c21	ZINC000057524244	136129481	/nfs/dbraw/zinc/12/94/81/136129481.db2.gz	HPVRIVPBHSBXCI-UHFFFAOYSA-N	-1	0	354.435	2.736	50	0		FFAARM
O=C([O-])c1ccc(Cl)c(S(=O)(=O)N2CCOc3ccccc32)c1	ZINC000071804308	136141080	/nfs/dbraw/zinc/14/10/80/136141080.db2.gz	FHKJUMCVRDVLLF-UHFFFAOYSA-N	-1	0	353.783	2.626	50	0		FFAARM
CC(=O)c1ccc(N2CCC(C(=O)[O-])(n3ccc(C(C)(C)C)n3)CC2)nc1	ZINC000072462834	136148860	/nfs/dbraw/zinc/14/88/60/136148860.db2.gz	GRXKCEJBJKGKNB-UHFFFAOYSA-N	-1	0	370.453	2.859	50	0		FFAARM
COc1ccccc1[C@@H]1CN(C(=O)c2sc(C)nc2C)C[C@H]1C(=O)[O-]	ZINC000091657131	221779798	/nfs/dbraw/zinc/77/97/98/221779798.db2.gz	GOJBPVVOEKYSMZ-UONOGXRCSA-N	-1	0	360.435	2.709	50	0		FFAARM
COc1ccc(/C=C\C(=O)[O-])cc1S(=O)(=O)N(C)c1cccc(C)c1	ZINC000096298099	222113478	/nfs/dbraw/zinc/11/34/78/222113478.db2.gz	ONDYUOOFRTYLFO-NTMALXAHSA-N	-1	0	361.419	2.927	50	0		FFAARM
CC(C)[C@H]1c2[nH]c3ccccc3c2CCN1C(=O)c1[nH]cnc1C(=O)[O-]	ZINC000097759334	222211856	/nfs/dbraw/zinc/21/18/56/222211856.db2.gz	RIPPRVBPSSYPIC-KRWDZBQOSA-N	-1	0	352.394	2.985	50	0		FFAARM
CC(C)Cc1nnc(NC(=O)c2c([O-])c3ccccc3n(C)c2=O)s1	ZINC000100502100	222245581	/nfs/dbraw/zinc/24/55/81/222245581.db2.gz	WCOZJMYCSHNYNB-UHFFFAOYSA-N	-1	0	358.423	2.546	50	0		FFAARM
CCC(Nc1ccccc1N)=C1C(=O)[N-]C(=O)N(Cc2ccccc2)C1=O	ZINC000100638796	222248204	/nfs/dbraw/zinc/24/82/04/222248204.db2.gz	FKODBKALEYIALO-BMRADRMJSA-N	-1	0	364.405	2.623	50	0		FFAARM
COCC1(CNC(=O)c2ccc(-c3cc(C(=O)[O-])ccn3)cc2)CCC1	ZINC000426491616	263606574	/nfs/dbraw/zinc/60/65/74/263606574.db2.gz	YTUIROZTFFDLPW-UHFFFAOYSA-N	-1	0	354.406	2.993	50	0		FFAARM
COc1cccc(C(=O)NC(=S)Nc2cc(C(=O)[O-])ccc2OC)c1	ZINC000001159164	506251822	/nfs/dbraw/zinc/25/18/22/506251822.db2.gz	LQKBBNQDJUWGJD-UHFFFAOYSA-N	-1	0	360.391	2.529	50	0		FFAARM
Cc1cc(OCC(=O)Nc2cnn(CCCC(=O)[O-])c2)ccc1Cl	ZINC000001429195	506262959	/nfs/dbraw/zinc/26/29/59/506262959.db2.gz	AJYIBZSGQNHDDB-UHFFFAOYSA-N	-1	0	351.790	2.727	50	0		FFAARM
Cc1ccc(S(=O)(=O)Nc2ccc(-n3cccn3)cc2)cc1C(=O)[O-]	ZINC000032595407	506267744	/nfs/dbraw/zinc/26/77/44/506267744.db2.gz	UWTXPINXUWTLBK-UHFFFAOYSA-N	-1	0	357.391	2.680	50	0		FFAARM
CCc1cc(=O)oc2c(C)c(O[C@@H](C)C(=O)N3CCC[C@H]3C(=O)[O-])ccc12	ZINC000002105066	506271836	/nfs/dbraw/zinc/27/18/36/506271836.db2.gz	HIQXOQJXNWRHBJ-WFASDCNBSA-N	-1	0	373.405	2.507	50	0		FFAARM
COC(=O)c1[nH]c2ccccc2c1[N-]S(=O)(=O)c1ccc(OC)cc1	ZINC000002432289	506280524	/nfs/dbraw/zinc/28/05/24/506280524.db2.gz	YHCBHNSNFGZTDN-UHFFFAOYSA-N	-1	0	360.391	2.764	50	0		FFAARM
O=C([O-])[C@H]1C[C@@H](O)CCN1C(=O)OCC1c2ccccc2-c2ccccc21	ZINC000002526804	506281806	/nfs/dbraw/zinc/28/18/06/506281806.db2.gz	CJGSLUBWMLBOFZ-ORAYPTAESA-N	-1	0	367.401	2.845	50	0		FFAARM
O=C([O-])[C@H]1CCCC[C@H]1C(=O)N1CCN(C/C=C/c2ccccc2)CC1	ZINC000002566728	506283159	/nfs/dbraw/zinc/28/31/59/506283159.db2.gz	JQBIIYXKEFVGST-APTSRADASA-N	-1	0	356.466	2.735	50	0		FFAARM
O=C([O-])c1ccccc1C(=O)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000002809158	506296652	/nfs/dbraw/zinc/29/66/52/506296652.db2.gz	HZHZZHLAFMHGMV-UHFFFAOYSA-N	-1	0	358.825	2.996	50	0		FFAARM
O=C([O-])c1ccccc1S[C@H]1CC(=O)N(CCc2ccccc2)C1=O	ZINC000002890052	506300615	/nfs/dbraw/zinc/30/06/15/506300615.db2.gz	GTRIENYMHDKNML-INIZCTEOSA-N	-1	0	355.415	2.847	50	0		FFAARM
CSCC[C@H](NC(=O)c1ccccc1NC(=O)C(C)(C)C)C(=O)[O-]	ZINC000003164165	506310508	/nfs/dbraw/zinc/31/05/08/506310508.db2.gz	XSHMIRINUGXBOW-ZDUSSCGKSA-N	-1	0	352.456	2.607	50	0		FFAARM
Cc1cccc(NC(=O)c2sc3[nH]c(=O)c(C(=O)[O-])cc3c2N)c1C	ZINC000003894943	506352325	/nfs/dbraw/zinc/35/23/25/506352325.db2.gz	SVDFUWQYALFYFD-UHFFFAOYSA-N	-1	0	357.391	2.739	50	0		FFAARM
O=C(/C=C/c1cccs1)Nc1ccc(N2CCOCC2)c(C(=O)[O-])c1	ZINC000004244888	506366214	/nfs/dbraw/zinc/36/62/14/506366214.db2.gz	MLJFDQCKFJEWQS-GQCTYLIASA-N	-1	0	358.419	2.935	50	0		FFAARM
NC(=O)c1sc(-c2ccc(Cl)cc2)cc1NC(=O)CCC(=O)[O-]	ZINC000004242301	506366235	/nfs/dbraw/zinc/36/62/35/506366235.db2.gz	AKEGBXSYBBSAOX-UHFFFAOYSA-N	-1	0	352.799	2.971	50	0		FFAARM
CCCNC(=O)C(=C([O-])c1ccc(F)cc1)n1cc(Cl)ccc1=O	ZINC000004435567	506376405	/nfs/dbraw/zinc/37/64/05/506376405.db2.gz	OFWJDMTWPAHYJN-OAHLLOKOSA-N	-1	0	350.777	2.591	50	0		FFAARM
CCOc1ccc(Cn2[nH][n-]c3c(=O)n(-c4ccc(F)cc4)c(=O)c2=3)cc1	ZINC000004483675	506378127	/nfs/dbraw/zinc/37/81/27/506378127.db2.gz	HNBNATATXINMOD-SJORKVTESA-N	-1	0	368.368	2.718	50	0		FFAARM
CCc1ccc(NC(=O)[C@@H](Cc2ccccc2OC)c2nnn[n-]2)cc1	ZINC000004576137	506383343	/nfs/dbraw/zinc/38/33/43/506383343.db2.gz	PQPYPHBSZNPMHV-INIZCTEOSA-N	-1	0	351.410	2.736	50	0		FFAARM
Cc1ccc(S(=O)(=O)[N-]c2ccccc2C(F)(F)F)cc1C(N)=O	ZINC000004742781	506391288	/nfs/dbraw/zinc/39/12/88/506391288.db2.gz	QIMQFKZOAYURDV-UHFFFAOYSA-N	-1	0	358.341	2.914	50	0		FFAARM
COc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(C)c(C(N)=O)c1	ZINC000004778344	506393239	/nfs/dbraw/zinc/39/32/39/506393239.db2.gz	BIJMSBDCSWOLPO-UHFFFAOYSA-N	-1	0	354.815	2.557	50	0		FFAARM
COC(=O)c1ccccc1[N-]S(=O)(=O)c1ccc(OC)c2ncccc12	ZINC000004784164	506395556	/nfs/dbraw/zinc/39/55/56/506395556.db2.gz	YVJMCYGEOIGUFK-UHFFFAOYSA-N	-1	0	372.402	2.831	50	0		FFAARM
Cc1cc(C(=O)[O-])cc(S(=O)(=O)Nc2ccc3c(c2)OCCO3)c1C	ZINC000005132921	506424407	/nfs/dbraw/zinc/42/44/07/506424407.db2.gz	MLXVCAHWHBUXGI-UHFFFAOYSA-N	-1	0	363.391	2.574	50	0		FFAARM
CCOc1ccc(Cc2nnc(Nc3ccccc3OC)[n-]c2=O)cc1	ZINC000005154335	506425505	/nfs/dbraw/zinc/42/55/05/506425505.db2.gz	KDQSOASJZSVJTM-UHFFFAOYSA-N	-1	0	352.394	2.907	50	0		FFAARM
COc1cc(/C=C2/N=C(c3ccc(C)cc3)OC2=O)ccc1OCC(=O)[O-]	ZINC000005698680	506455177	/nfs/dbraw/zinc/45/51/77/506455177.db2.gz	HAYUFTDHPYIYHT-OQLLNIDSSA-N	-1	0	367.357	2.812	50	0		FFAARM
CC(NCCc1ccccc1)=C1C(=O)[N-]C(=O)N(C2CCCCC2)C1=O	ZINC000006184953	506471649	/nfs/dbraw/zinc/47/16/49/506471649.db2.gz	FBEOCYQDWQJQSG-VKAVYKQESA-N	-1	0	355.438	2.504	50	0		FFAARM
Cn1ccnc1[C@@H](NC(=O)Cc1ccccc1C(=O)[O-])c1ccc(F)cc1	ZINC000040158779	506477705	/nfs/dbraw/zinc/47/77/05/506477705.db2.gz	PJROEYNGAMOLKM-SFHVURJKSA-N	-1	0	367.380	2.706	50	0		FFAARM
CC(NCc1ccco1)=C1C(=O)[N-]C(=O)N(c2ccc(Cl)cc2)C1=O	ZINC000006360626	506479114	/nfs/dbraw/zinc/47/91/14/506479114.db2.gz	QXLAUADDDHHPQG-UVTDQMKNSA-N	-1	0	359.769	2.580	50	0		FFAARM
Cc1ccccc1CN1CCN(C(=O)[C@H]2C3CCC(CC3)[C@@H]2C(=O)[O-])CC1	ZINC000006742235	506502167	/nfs/dbraw/zinc/50/21/67/506502167.db2.gz	PMDQKGUKRVSLDM-WXDAQCLHSA-N	-1	0	370.493	2.776	50	0		FFAARM
O=S(=O)([N-]c1ccc(-n2cnnn2)cc1)c1cccc(Cl)c1Cl	ZINC000007051836	506528946	/nfs/dbraw/zinc/52/89/46/506528946.db2.gz	HYSNDNGCHGJIED-UHFFFAOYSA-N	-1	0	370.221	2.770	50	0		FFAARM
COc1cc(/C=C2\N=C(c3cccc(F)c3)OC2=O)ccc1OCC(=O)[O-]	ZINC000007925344	506601968	/nfs/dbraw/zinc/60/19/68/506601968.db2.gz	STMULLWLXLVUAT-AUWJEWJLSA-N	-1	0	371.320	2.642	50	0		FFAARM
O=C(CCC1CCCCC1)[N-]S(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000042268635	506613693	/nfs/dbraw/zinc/61/36/93/506613693.db2.gz	YKXYCGXMXQCMBY-UHFFFAOYSA-N	-1	0	353.440	2.623	50	0		FFAARM
CCOC(=O)c1ccc([N-]S(=O)(=O)c2ccsc2C(=O)OC)cc1	ZINC000009002270	506678383	/nfs/dbraw/zinc/67/83/83/506678383.db2.gz	WOLMDJQHUGJHFU-UHFFFAOYSA-N	-1	0	369.420	2.512	50	0		FFAARM
CC1(C)COc2cc([N-]S(=O)(=O)c3ccccc3F)ccc2NC1=O	ZINC000009168655	506685798	/nfs/dbraw/zinc/68/57/98/506685798.db2.gz	DTMAKVPZLJNURP-UHFFFAOYSA-N	-1	0	364.398	2.984	50	0		FFAARM
COc1cc(S(=O)(=O)Nc2cc(C)ccc2F)cc(C(=O)[O-])c1OC	ZINC000045946905	507050119	/nfs/dbraw/zinc/05/01/19/507050119.db2.gz	BNZVMKBRIQUMJU-UHFFFAOYSA-N	-1	0	369.370	2.650	50	0		FFAARM
COc1ccc([N-]S(=O)(=O)c2ccc(F)cc2F)cc1NC(C)=O	ZINC000024437106	507412117	/nfs/dbraw/zinc/41/21/17/507412117.db2.gz	JWSIRPLQQSSIAE-UHFFFAOYSA-N	-1	0	356.350	2.733	50	0		FFAARM
Cc1cc(-c2ccc(S(=O)(=O)N(C)CC(=O)[O-])cc2)nc2ccccc12	ZINC000024988382	507456104	/nfs/dbraw/zinc/45/61/04/507456104.db2.gz	YNOPYWPWIWSFAJ-UHFFFAOYSA-N	-1	0	370.430	2.915	50	0		FFAARM
COc1ccc(Cl)cc1N1C(=O)C[C@H](Nc2ccc(C(=O)[O-])cc2)C1=O	ZINC000025608160	507515937	/nfs/dbraw/zinc/51/59/37/507515937.db2.gz	CSRBRWCFIGJASX-ZDUSSCGKSA-N	-1	0	374.780	2.791	50	0		FFAARM
O=C([O-])c1ccnc(-c2ccnc(N3CC(Oc4ccccc4F)C3)n2)c1	ZINC000072407389	507784070	/nfs/dbraw/zinc/78/40/70/507784070.db2.gz	FGWPWTQTHHCNNT-UHFFFAOYSA-N	-1	0	366.352	2.644	50	0		FFAARM
Cc1ncccc1OC1(C(=O)[O-])CCN(Cc2coc(C(C)C)n2)CC1	ZINC000072410021	507785812	/nfs/dbraw/zinc/78/58/12/507785812.db2.gz	GYXNTPBYHYPJPV-UHFFFAOYSA-N	-1	0	359.426	3.000	50	0		FFAARM
CCOc1ccc(CN2CCc3nc[nH]c3[C@H]2C(=O)[O-])c(OCC)c1C	ZINC000072434560	507791134	/nfs/dbraw/zinc/79/11/34/507791134.db2.gz	GIMVLETYTSWOOZ-KRWDZBQOSA-N	-1	0	359.426	2.700	50	0		FFAARM
CCCCCc1ccc([N-]S(=O)(=O)c2cc(C(=O)NC)n(C)c2)cc1	ZINC000031667106	507820960	/nfs/dbraw/zinc/82/09/60/507820960.db2.gz	RTHUZIATHZZVFA-UHFFFAOYSA-N	-1	0	363.483	2.918	50	0		FFAARM
O=C([O-])c1cc(S(=O)(=O)N2CCCc3cc(F)c(F)cc32)ccc1F	ZINC000031669731	507821043	/nfs/dbraw/zinc/82/10/43/507821043.db2.gz	OGYMASQUDXWTFS-UHFFFAOYSA-N	-1	0	371.336	2.944	50	0		FFAARM
CN(Cc1ccc2nonc2c1)[C@H](C(=O)[O-])c1ccc(-c2cc[nH]n2)cc1	ZINC000095360599	508175873	/nfs/dbraw/zinc/17/58/73/508175873.db2.gz	XQUHGIWRMPVSQF-SFHVURJKSA-N	-1	0	363.377	2.871	50	0		FFAARM
O=C([O-])[C@H](c1ccc(F)c(CO)c1)N1CCc2[nH]c3ccccc3c2C1	ZINC000095518754	508194131	/nfs/dbraw/zinc/19/41/31/508194131.db2.gz	IMNWKHUDGYKUDL-IBGZPJMESA-N	-1	0	354.381	2.983	50	0		FFAARM
O=C([O-])[C@]1(NC(=O)c2nc3ccccn3c2F)CCCc2ccccc21	ZINC000095527633	508196278	/nfs/dbraw/zinc/19/62/78/508196278.db2.gz	AECXGPJNJQMBHT-IBGZPJMESA-N	-1	0	353.353	2.520	50	0		FFAARM
Cc1ccc(C(=O)N(C)c2ccc(OS(=O)(=O)c3cnc[n-]3)cc2)cc1	ZINC000121559607	509178506	/nfs/dbraw/zinc/17/85/06/509178506.db2.gz	JGFATZRKKCZCKO-UHFFFAOYSA-N	-1	0	371.418	2.762	50	0		FFAARM
O=S(=O)([N-]c1nncn1-c1ccccc1)c1cc(F)ccc1Cl	ZINC000225531960	509376183	/nfs/dbraw/zinc/37/61/83/509376183.db2.gz	NUUZRMQAWKERCT-UHFFFAOYSA-N	-1	0	352.778	2.861	50	0		FFAARM
C[C@@H](OC1CCCCCC1)C(=O)[N-]S(=O)(=O)Cc1ccc(Cl)nc1	ZINC000163752024	509418832	/nfs/dbraw/zinc/41/88/32/509418832.db2.gz	ZKVPMQMTJQUUEC-GFCCVEGCSA-N	-1	0	374.890	2.809	50	0		FFAARM
CC(=O)N[C@H](CC(=O)N1CCC[C@@H](CCC(=O)[O-])C1)c1ccc(C)cc1	ZINC000236717734	509489383	/nfs/dbraw/zinc/48/93/83/509489383.db2.gz	KYGPMXZNLGZWOR-FUHWJXTLSA-N	-1	0	360.454	2.666	50	0		FFAARM
C[C@@H](OCC(F)(F)F)C(=O)N1CCC(C(=O)[O-])(c2ccccc2)CC1	ZINC000237398612	509639178	/nfs/dbraw/zinc/63/91/78/509639178.db2.gz	CGRPTVROMWADMH-GFCCVEGCSA-N	-1	0	359.344	2.599	50	0		FFAARM
C[C@@H](Oc1ccccc1Br)C(=O)N1CC[C@@](C)(C(=O)[O-])C1	ZINC000237539498	509672692	/nfs/dbraw/zinc/67/26/92/509672692.db2.gz	VYEQTOFVQRVMEL-MEBBXXQBSA-N	-1	0	356.216	2.540	50	0		FFAARM
CCc1ccc(CCC(=O)Nc2ccc(CC(=O)NCC(=O)[O-])cc2)cc1	ZINC000170596828	509673769	/nfs/dbraw/zinc/67/37/69/509673769.db2.gz	BKPTXAWDDUPWGV-UHFFFAOYSA-N	-1	0	368.433	2.564	50	0		FFAARM
COC(=O)c1sc2[n-]c([C@@H]3COc4ccccc4O3)nc(=O)c2c1C	ZINC000170616538	509680971	/nfs/dbraw/zinc/68/09/71/509680971.db2.gz	PLHYDQNHVSEWES-NSHDSACASA-N	-1	0	358.375	2.592	50	0		FFAARM
CSc1ccc(S(=O)(=O)[N-]c2cncc(N3CCCC3)n2)cc1	ZINC000170617409	509681109	/nfs/dbraw/zinc/68/11/09/509681109.db2.gz	VTPPMXPQHFGIAQ-UHFFFAOYSA-N	-1	0	350.469	2.600	50	0		FFAARM
C[C@]1(C(=O)[O-])CCN(C(=O)c2[nH]c3ccccc3c2Br)C1	ZINC000237655158	509702869	/nfs/dbraw/zinc/70/28/69/509702869.db2.gz	CVMIPMCYEKAWBP-HNNXBMFYSA-N	-1	0	351.200	2.867	50	0		FFAARM
Cc1nc(-c2cccc(C(=O)N3[C@H](C(=O)[O-])C[C@H]4CCCC[C@@H]43)c2)no1	ZINC000237697945	509713643	/nfs/dbraw/zinc/71/36/43/509713643.db2.gz	NFJURMYHIGVHLG-KCXAZCMYSA-N	-1	0	355.394	2.903	50	0		FFAARM
Cc1ccc([C@@H](NC(=O)CN2CCC[C@@H]2C(=O)[O-])c2cccs2)cc1	ZINC000237889460	509763661	/nfs/dbraw/zinc/76/36/61/509763661.db2.gz	LGFHXZKWTBIYGD-CRAIPNDOSA-N	-1	0	358.463	2.811	50	0		FFAARM
O=C([O-])CC[C@@H]1CCCCN1C(=O)c1cccc(CN2CCCC2=O)c1	ZINC000237941849	509779698	/nfs/dbraw/zinc/77/96/98/509779698.db2.gz	SYRVUPCVJSRDLK-KRWDZBQOSA-N	-1	0	358.438	2.669	50	0		FFAARM
O=C([O-])[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)CCc1nc(C2CCCC2)no1	ZINC000237969239	509787320	/nfs/dbraw/zinc/78/73/20/509787320.db2.gz	PHFMUJDIPFZISY-KKUMJFAQSA-N	-1	0	361.442	2.904	50	0		FFAARM
O=C([O-])CC[C@H]1CCCN(C(=O)C2(c3ccc(F)cc3)CCOCC2)C1	ZINC000238006143	509796447	/nfs/dbraw/zinc/79/64/47/509796447.db2.gz	REZSKHYSWVEUOC-OAHLLOKOSA-N	-1	0	363.429	2.977	50	0		FFAARM
O=C([O-])CN1CCC[C@H]1c1nc(Cc2ccc(Br)cc2)no1	ZINC000238157962	509829519	/nfs/dbraw/zinc/82/95/19/509829519.db2.gz	YSBSFTQUQLVNPH-LBPRGKRZSA-N	-1	0	366.215	2.644	50	0		FFAARM
COc1ccc(S(=O)(=O)[N-]c2cccc(C(=O)NC3CC3)c2)c(F)c1	ZINC000241371312	509842892	/nfs/dbraw/zinc/84/28/92/509842892.db2.gz	MMKDQQUBKWSEOM-UHFFFAOYSA-N	-1	0	364.398	2.527	50	0		FFAARM
CC[C@H](C)[C@H](NC(=O)CCc1nc(-c2ccc3cc[nH]c3c2)no1)C(=O)[O-]	ZINC000252552023	509852670	/nfs/dbraw/zinc/85/26/70/509852670.db2.gz	ULUVSAUIWNKOPX-GTNSWQLSSA-N	-1	0	370.409	2.766	50	0		FFAARM
O=C([O-])c1cnn2cc(CN3CC=C(c4ccc(F)cc4)CC3)cnc12	ZINC000244715979	509865873	/nfs/dbraw/zinc/86/58/73/509865873.db2.gz	LGFOJEQTZSIJAC-UHFFFAOYSA-N	-1	0	352.369	2.856	50	0		FFAARM
O=C([O-])[C@@H]1CCN(C(=O)/C=C\c2ccc(OCc3cccnc3)cc2)C1	ZINC000255031647	509916335	/nfs/dbraw/zinc/91/63/35/509916335.db2.gz	VKWYOBJJOGBOIO-CTEOGUNLSA-N	-1	0	352.390	2.607	50	0		FFAARM
O=C([O-])c1cccc(CC(=O)NC[C@@H]2CCO[C@H]2c2ccc(F)cc2)c1	ZINC000262822021	510426562	/nfs/dbraw/zinc/42/65/62/510426562.db2.gz	PUZZMWYCYQNUHN-LPHOPBHVSA-N	-1	0	357.381	2.960	50	0		FFAARM
Cc1cc(-c2cc(C(=O)NC3(C(=O)[O-])CC3)c3c(C)noc3n2)c(C)o1	ZINC000191075304	510493024	/nfs/dbraw/zinc/49/30/24/510493024.db2.gz	RQOZTFVQBNNPJB-UHFFFAOYSA-N	-1	0	355.350	2.755	50	0		FFAARM
COc1ccc(C2(C(=O)NCc3ccc(C(=O)[O-])cc3)CCOCC2)cc1	ZINC000545995341	517478684	/nfs/dbraw/zinc/47/86/84/517478684.db2.gz	MADNFVBCNWJBOV-UHFFFAOYSA-N	-1	0	369.417	2.758	50	0		FFAARM
O=c1c2c(-c3ccccc3Cl)csc2ncn1CCCc1nnn[n-]1	ZINC000584899204	518529581	/nfs/dbraw/zinc/52/95/81/518529581.db2.gz	VUNURPDDPSYWSB-UHFFFAOYSA-N	-1	0	372.841	2.924	50	0		FFAARM
CC(C)c1ccc(-c2nc(C(=O)N3CCOC[C@H]3C(=O)[O-])cs2)cc1	ZINC000268963790	519833830	/nfs/dbraw/zinc/83/38/30/519833830.db2.gz	BFNBICMGSXRFBT-HNNXBMFYSA-N	-1	0	360.435	2.859	50	0		FFAARM
Cc1oc(CNC(=O)[C@@H](c2ccccc2)N2CCCCC2=O)cc1C(=O)[O-]	ZINC000299742293	534545487	/nfs/dbraw/zinc/54/54/87/534545487.db2.gz	AZAIQAAGXGROSX-GOSISDBHSA-N	-1	0	370.405	2.656	50	0		FFAARM
COC[C@H](C)N(C(=O)c1cccc(C(=O)[O-])n1)[C@H]1CCc2ccccc21	ZINC000630305942	522780171	/nfs/dbraw/zinc/78/01/71/522780171.db2.gz	UJSOJPDBCRAUCR-UGSOOPFHSA-N	-1	0	354.406	2.944	50	0		FFAARM
C[C@H](c1ccccc1)N1C[C@H](C(=O)N[C@H]2CCCCC[C@H]2C(=O)[O-])CC1=O	ZINC000252515786	526100940	/nfs/dbraw/zinc/10/09/40/526100940.db2.gz	NMCNKJXDSDPABR-DDBAPUKQSA-N	-1	0	372.465	2.746	50	0		FFAARM
O=C([O-])[C@@H]1C[C@H]1C(=O)NCC1(c2cccc(C(F)(F)F)c2)CCOCC1	ZINC000268921643	526291457	/nfs/dbraw/zinc/29/14/57/526291457.db2.gz	SUXJCUQIGAYGPQ-ZIAGYGMSSA-N	-1	0	371.355	2.591	50	0		FFAARM
O=C([O-])/C=C/C(=O)Nc1ccc2c(c1)CCCN2C(=O)c1ccccc1	ZINC000000545667	527544484	/nfs/dbraw/zinc/54/44/84/527544484.db2.gz	HTCTXEKNVTYRDD-ZHACJKMWSA-N	-1	0	350.374	2.859	50	0		FFAARM
CCOC(=O)CN(C)c1ccc(NC(=O)c2ccccc2C)cc1C(=O)[O-]	ZINC000046053503	570921849	/nfs/dbraw/zinc/92/18/49/570921849.db2.gz	TUZDRVIAKWOEJW-UHFFFAOYSA-N	-1	0	370.405	2.945	50	0		FFAARM
Cc1cccnc1CNS(=O)(=O)c1cc(C)c(Cl)c(C(=O)[O-])c1	ZINC000184976116	729338627	/nfs/dbraw/zinc/33/86/27/729338627.db2.gz	IRENFZISINKXRF-UHFFFAOYSA-N	-1	0	354.815	2.529	50	0		FFAARM
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCC[C@@H](CCC(=O)[O-])C1	ZINC000263098279	729679277	/nfs/dbraw/zinc/67/92/77/729679277.db2.gz	ILXGTQCKTUQOMD-STQMWFEESA-N	-1	0	366.845	2.562	50	0		FFAARM
CO[C@](C)(C(=O)[O-])C(=O)N[C@@H]1CCC[C@H]1c1ccccc1C(F)(F)F	ZINC000663046319	732376122	/nfs/dbraw/zinc/37/61/22/732376122.db2.gz	SMJQMFIVYOBALE-GHJWDPDVSA-N	-1	0	359.344	2.947	50	0		FFAARM
O=c1c2cnc3nc(-c4ccccc4)nn3c2cc([O-])n1Cc1ccccc1	ZINC000675018944	971493750	/nfs/dbraw/zinc/49/37/50/971493750.db2.gz	GUMRBPLJZUGKPX-UHFFFAOYSA-N	-1	0	369.384	2.860	50	0		FFAARM
O=C([O-])[C@H]1CCCN1C(=O)/C(=C/c1ccccc1)NC(=O)c1ccccc1	ZINC000022590704	964556681	/nfs/dbraw/zinc/55/66/81/964556681.db2.gz	NSPQTJMKTBCIGD-HGLWPWQMSA-N	-1	0	364.401	2.533	50	0		FFAARM
CC[C@]1(C(=O)[O-])CCCN(C(=O)CCCc2nc(-c3cccnc3)no2)C1	ZINC000091782320	965342938	/nfs/dbraw/zinc/34/29/38/965342938.db2.gz	SJRVVZIJAUULQX-IBGZPJMESA-N	-1	0	372.425	2.558	50	0		FFAARM
O=C([O-])CC[C@@H]1CCCCN1C(=O)[C@@H]1C[C@@H]1c1ccc2c(c1)OCCO2	ZINC000262205369	969087664	/nfs/dbraw/zinc/08/76/64/969087664.db2.gz	VXMHLZPVHRKDTC-ARFHVFGLSA-N	-1	0	359.422	2.807	50	0		FFAARM
COc1ccc(-c2c(-c3ccccc3)ncn2[C@H](CO)C(=O)[O-])cc1O	ZINC000091416897	1026751219	/nfs/dbraw/zinc/75/12/19/1026751219.db2.gz	YMDURANLZPFSCR-CQSZACIVSA-N	-1	0	354.362	2.549	50	0		FFAARM
O=C([O-])c1ccc2c(c1)C(=O)N(CCCC(=O)OCc1ccccc1)C2=O	ZINC000000632429	219306943	/nfs/dbraw/zinc/30/69/43/219306943.db2.gz	HQTXISKAXLFWHI-UHFFFAOYSA-N	-1	0	367.357	2.504	50	0		FFAARM
COc1ccc(C2=NN(C(=O)CCC(=O)[O-])[C@H](c3ccco3)C2)cc1OC	ZINC000000801908	219323634	/nfs/dbraw/zinc/32/36/34/219323634.db2.gz	GYPCFJFAUSVPMV-AWEZNQCLSA-N	-1	0	372.377	2.839	50	0		FFAARM
Cc1noc([N-]S(=O)(=O)c2ccc(NC(=O)C(F)(F)F)cc2)c1C	ZINC000000839161	219328848	/nfs/dbraw/zinc/32/88/48/219328848.db2.gz	KJEYNWQWLMDFIW-UHFFFAOYSA-N	-1	0	363.317	2.593	50	0		FFAARM
O=C([O-])c1cc(I)ccc1I	ZINC000004014501	219533928	/nfs/dbraw/zinc/53/39/28/219533928.db2.gz	NSKPFWAAYDFCFS-UHFFFAOYSA-N	-1	0	373.915	2.594	50	0		FFAARM
COc1ccc2c(c1)[C@@]1(C)CCCc3c1n-2c(=O)c1c([O-])cc(=O)oc31	ZINC000005433533	219678198	/nfs/dbraw/zinc/67/81/98/219678198.db2.gz	STGAIJDJYXRWJV-HXUWFJFHSA-N	-1	0	351.358	2.614	50	0		FFAARM
Cc1ccc([C@H](CC(=O)[O-])NS(=O)(=O)c2ccc(F)cc2F)cc1	ZINC000007990194	219840028	/nfs/dbraw/zinc/84/00/28/219840028.db2.gz	PFMWVTLWVBJNGL-AWEZNQCLSA-N	-1	0	355.362	2.768	50	0		FFAARM
CS(=O)(=O)c1ccc(C(=O)Nc2cc(C(=O)[O-])ccc2Cl)cc1	ZINC000008429578	219862395	/nfs/dbraw/zinc/86/23/95/219862395.db2.gz	FPVKLXKBBWLQPO-UHFFFAOYSA-N	-1	0	353.783	2.694	50	0		FFAARM
Cc1cc(S(=O)(=O)[N-]c2n[nH]cc2Br)c(F)cc1F	ZINC000328594071	223116274	/nfs/dbraw/zinc/11/62/74/223116274.db2.gz	NPZNRYOYIIBKOD-UHFFFAOYSA-N	-1	0	352.160	2.560	50	0		FFAARM
O=C([O-])CCC(=O)N1N=C(c2ccc[nH]2)C[C@H]1c1ccc2nccnc2c1	ZINC000012390116	219988976	/nfs/dbraw/zinc/98/89/76/219988976.db2.gz	GGZKPQUEIREBDT-KRWDZBQOSA-N	-1	0	363.377	2.500	50	0		FFAARM
O=C([O-])c1ccc(S(=O)(=O)Nc2ccc3c(c2)OC(F)(F)O3)cc1	ZINC000013032189	220054965	/nfs/dbraw/zinc/05/49/65/220054965.db2.gz	JRIVPGATCKPSBK-UHFFFAOYSA-N	-1	0	357.290	2.507	50	0		FFAARM
COc1ccc(CNC(=O)c2cc3c(C)nn(C)c3s2)cc1C(=O)[O-]	ZINC000013393262	220067429	/nfs/dbraw/zinc/06/74/29/220067429.db2.gz	TVDKGPSVWPJOID-UHFFFAOYSA-N	-1	0	359.407	2.580	50	0		FFAARM
O=C([O-])[C@H]1CC=CC[C@@H]1C(=O)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000013737111	220092196	/nfs/dbraw/zinc/09/21/96/220092196.db2.gz	MKUFWNNCCCXWQI-IRXDYDNUSA-N	-1	0	362.857	2.651	50	0		FFAARM
Cc1cccc(C)c1-n1nnnc1C1(N(CC(=O)[O-])N=O)CCCCC1	ZINC000015414092	220153883	/nfs/dbraw/zinc/15/38/83/220153883.db2.gz	OEPQVTZGMAFFFH-UHFFFAOYSA-N	-1	0	358.402	2.507	50	0		FFAARM
C[C@H]1CCc2c(sc3[n-]c(=S)n(CCN4CCOCC4)c(=O)c32)C1	ZINC000017075152	220203532	/nfs/dbraw/zinc/20/35/32/220203532.db2.gz	HPCJIISZJDJHQL-NSHDSACASA-N	-1	0	365.524	2.578	50	0		FFAARM
O=C([O-])c1ccc(N2C(=S)N=NC2c2cc(-c3ccco3)n[nH]2)cc1	ZINC000020170800	220317787	/nfs/dbraw/zinc/31/77/87/220317787.db2.gz	IEPBFGDXTHAEIK-UHFFFAOYSA-N	-1	0	353.363	2.904	50	0		FFAARM
CC[C@@H](C)[C@H](NC(=O)Cc1csc(-c2cccc(OC)c2)n1)C(=O)[O-]	ZINC000020722158	220339593	/nfs/dbraw/zinc/33/95/93/220339593.db2.gz	MXBZDJYAFAKPQJ-BZNIZROVSA-N	-1	0	362.451	2.977	50	0		FFAARM
Cc1cn2c(nc(C)c(S(=O)(=O)[N-]c3cccc(C)c3C)c2=O)s1	ZINC000020921976	220345754	/nfs/dbraw/zinc/34/57/54/220345754.db2.gz	UXMRKDGKFHWALS-UHFFFAOYSA-N	-1	0	363.464	2.790	50	0		FFAARM
O=C(Nc1ccc(S(=O)(=O)[N-]c2ncccn2)cc1)[C@H]1CC=CCC1	ZINC000021335112	220356068	/nfs/dbraw/zinc/35/60/68/220356068.db2.gz	DDVFLQANUFRGLX-ZDUSSCGKSA-N	-1	0	358.423	2.572	50	0		FFAARM
O=C(CC1(C(=O)[O-])CCCCC1)Nc1ccccc1C(=O)N1CCOCC1	ZINC000024941791	220466772	/nfs/dbraw/zinc/46/67/72/220466772.db2.gz	JIONFMDUWIUYDN-UHFFFAOYSA-N	-1	0	374.437	2.523	50	0		FFAARM
COc1cc(C(=O)[N-]S(C)(=O)=O)ccc1OCc1ccc(Cl)cc1	ZINC000042278757	220937211	/nfs/dbraw/zinc/93/72/11/220937211.db2.gz	KNZVUMCRHPPGSQ-UHFFFAOYSA-N	-1	0	369.826	2.617	50	0		FFAARM
O=C(Cn1cc(NC(=O)c2ccc([O-])c(Cl)c2)cn1)NC1CCCC1	ZINC000058208427	221107287	/nfs/dbraw/zinc/10/72/87/221107287.db2.gz	IDHDKZPOYSKJMU-UHFFFAOYSA-N	-1	0	362.817	2.553	50	0		FFAARM
O=C([O-])c1ccc2c(c1)S[C@H](CC(=O)Nc1ccc(F)cc1)C(=O)N2	ZINC000061719394	221134395	/nfs/dbraw/zinc/13/43/95/221134395.db2.gz	OGRQVHBNSRHVGL-CQSZACIVSA-N	-1	0	360.366	2.966	50	0		FFAARM
COc1ccccc1[C@@H]([N-]C(=O)C(F)(F)Br)c1nccn1C	ZINC000058293398	221113992	/nfs/dbraw/zinc/11/39/92/221113992.db2.gz	RTCOOLXJWTVQQZ-LLVKDONJSA-N	-1	0	374.185	2.622	50	0		FFAARM
CCn1ncc2ccc(NS(=O)(=O)c3cc(C(=O)[O-])ccc3C)cc21	ZINC000058366603	221116250	/nfs/dbraw/zinc/11/62/50/221116250.db2.gz	ILGWUAKWORYPBG-UHFFFAOYSA-N	-1	0	359.407	2.864	50	0		FFAARM
Cc1cc(S(=O)(=O)Nc2ccc(F)c(F)c2)ccc1OCC(=O)[O-]	ZINC000063476305	221141462	/nfs/dbraw/zinc/14/14/62/221141462.db2.gz	CDUUPFJCUIBTTA-UHFFFAOYSA-N	-1	0	357.334	2.537	50	0		FFAARM
Cc1cccc([N-]S(=O)(=O)c2cc3c(cc2Cl)n(C)c(=O)n3C)c1	ZINC000064976634	221160913	/nfs/dbraw/zinc/16/09/13/221160913.db2.gz	WPJFJVAPZXXXPR-UHFFFAOYSA-N	-1	0	365.842	2.640	50	0		FFAARM
O=C(CSc1nc2[nH]c(=O)cc([O-])c2s1)Nc1ccc(F)c(F)c1	ZINC000065361846	221202207	/nfs/dbraw/zinc/20/22/07/221202207.db2.gz	RLIFLJDAYYUJDZ-UHFFFAOYSA-N	-1	0	369.374	2.699	50	0		FFAARM
C[C@@H](c1nnc(SCC(=O)[O-])n1-c1ccc(F)cc1F)n1cccn1	ZINC000065398424	221212504	/nfs/dbraw/zinc/21/25/04/221212504.db2.gz	MEJSCZZKSZGXSS-VIFPVBQESA-N	-1	0	365.365	2.528	50	0		FFAARM
Cc1nc(C(=O)NCC(=O)[O-])c(O)c2ccc(Oc3ccccc3)cc12	ZINC000071257465	221337027	/nfs/dbraw/zinc/33/70/27/221337027.db2.gz	YOZBGTLTNGAVFU-UHFFFAOYSA-N	-1	0	352.346	2.856	50	0	investigational	FFAARM
CCn1ccnc1[C@H]1CCCN(c2c3c(C)nn(C)c3ncc2C(=O)[O-])C1	ZINC000091587454	132202297	/nfs/dbraw/zinc/20/22/97/132202297.db2.gz	JATSLSCHVKTKGJ-ZDUSSCGKSA-N	-1	0	368.441	2.575	50	0		FFAARM
O=C([O-])[C@]1(CCc2ccccc2)CCCN(c2ncnc3nc[nH]c32)C1	ZINC000071758860	136140578	/nfs/dbraw/zinc/14/05/78/136140578.db2.gz	QCEXUVBOIUSQHI-IBGZPJMESA-N	-1	0	351.410	2.657	50	0		FFAARM
CC(C)=CC[C@]1(C(=O)[O-])CCCN(C(=O)c2cc3c([nH]c2=O)CCCC3)C1	ZINC000092062166	221832805	/nfs/dbraw/zinc/83/28/05/221832805.db2.gz	OCSMLIINLOUSJM-OAQYLSRUSA-N	-1	0	372.465	2.917	50	0		FFAARM
CN(Cc1ccccc1)S(=O)(=O)[N-]C(=O)/C=C\c1cccc(Cl)c1	ZINC000096291528	222110881	/nfs/dbraw/zinc/11/08/81/222110881.db2.gz	BNVYLUMNVMBDOZ-KHPPLWFESA-N	-1	0	364.854	2.846	50	0		FFAARM
Cc1ccc(-c2nc(CN3CCCC3=O)n(-c3ccccc3C(=O)[O-])n2)o1	ZINC000096137883	222041176	/nfs/dbraw/zinc/04/11/76/222041176.db2.gz	NFPXTDVQNGOXBH-UHFFFAOYSA-N	-1	0	366.377	2.656	50	0		FFAARM
O=S(=O)(Cc1ccc(Oc2ccccc2F)c(F)c1)c1cnn[n-]1	ZINC000097020421	222152292	/nfs/dbraw/zinc/15/22/92/222152292.db2.gz	KXJHNJPQSRZDME-UHFFFAOYSA-N	-1	0	351.334	2.849	50	0		FFAARM
CC(C)CCn1c(CN2Cc3nc[nH]c3C[C@H]2C(=O)[O-])nc2ccccc21	ZINC000097463495	222181448	/nfs/dbraw/zinc/18/14/48/222181448.db2.gz	YCILBZKRCUOZTQ-SFHVURJKSA-N	-1	0	367.453	2.817	50	0		FFAARM
O=C(NCc1ccccc1Cl)c1c([O-])c2cccc3c2n(c1=O)CC3	ZINC000100621229	222248177	/nfs/dbraw/zinc/24/81/77/222248177.db2.gz	CAMVHGCUNQOPMM-UHFFFAOYSA-N	-1	0	354.793	2.847	50	0		FFAARM
Cc1ccccc1Cn1[nH][n-]c2c(=O)n(-c3ccc(F)c(F)c3)c(=O)c1=2	ZINC000101418100	222274231	/nfs/dbraw/zinc/27/42/31/222274231.db2.gz	WPCAHZSGHCNMNV-HOTGVXAUSA-N	-1	0	356.332	2.767	50	0		FFAARM
CCc1ccc(-n2c(=O)c3[n-][nH]n(Cc4cccc(F)c4)c=3c2=O)cc1	ZINC000101418359	222274257	/nfs/dbraw/zinc/27/42/57/222274257.db2.gz	MUUSZAKUFURIBS-SJORKVTESA-N	-1	0	352.369	2.882	50	0		FFAARM
O=C([O-])[C@@H]1CC=CC[C@H]1C(=O)Nc1ccc(I)cc1	ZINC000004610424	263335155	/nfs/dbraw/zinc/33/51/55/263335155.db2.gz	CNBCFMDYNFYBIT-VXGBXAGGSA-N	-1	0	371.174	2.897	50	0		FFAARM
COC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(OC)cc2OC)cc1	ZINC000001472302	506263709	/nfs/dbraw/zinc/26/37/09/506263709.db2.gz	XRXWJWRDTZGUMH-UHFFFAOYSA-N	-1	0	366.395	2.683	50	0		FFAARM
COc1ccc(Br)cc1[C@H]1SC[C@@H](C(=O)[O-])N1C(C)=O	ZINC000002763440	506290090	/nfs/dbraw/zinc/29/00/90/506290090.db2.gz	UZGPXPRWSYHLDM-CMPLNLGQSA-N	-1	0	360.229	2.505	50	0		FFAARM
Cc1cccc(N2C(=O)C[C@H](Sc3ncccc3C(=O)[O-])C2=O)c1C	ZINC000002890042	506299670	/nfs/dbraw/zinc/29/96/70/506299670.db2.gz	KADMOYNRMBJCLS-AWEZNQCLSA-N	-1	0	356.403	2.821	50	0		FFAARM
COc1ccc(OC)c(NC(=O)C[C@@H](Cc2ccccc2OC)C(=O)[O-])c1	ZINC000004099578	506358707	/nfs/dbraw/zinc/35/87/07/506358707.db2.gz	TVYNRPAAXFWNCS-CQSZACIVSA-N	-1	0	373.405	2.985	50	0		FFAARM
CC[C@@H](Sc1ccc2nnc(-c3ccc(OC)c(OC)c3)n2n1)C(=O)[O-]	ZINC000004142177	506362478	/nfs/dbraw/zinc/36/24/78/506362478.db2.gz	NJBMKKDRESGPFS-CYBMUJFWSA-N	-1	0	374.422	2.764	50	0		FFAARM
COc1cc2c(cc1OC)[C@@H](C(=O)[O-])[C@@H](c1ccccc1OC)N(C)C2=O	ZINC000004563441	506383415	/nfs/dbraw/zinc/38/34/15/506383415.db2.gz	RTULEOKBRLRJCC-QZTJIDSGSA-N	-1	0	371.389	2.708	50	0		FFAARM
COc1ccc(Cl)cc1NC(=O)c1ccccc1[N-]S(C)(=O)=O	ZINC000004756875	506393183	/nfs/dbraw/zinc/39/31/83/506393183.db2.gz	CPOZCNRUDHCISV-UHFFFAOYSA-N	-1	0	354.815	2.972	50	0		FFAARM
O=C([O-])c1cc(S(=O)(=O)Nc2ccccc2)ccc1Br	ZINC000004842645	506399571	/nfs/dbraw/zinc/39/95/71/506399571.db2.gz	DXRFHYVGYOVSSX-UHFFFAOYSA-N	-1	0	356.197	2.948	50	0		FFAARM
O=C(Nc1cccc(Cn2cccnc2=O)c1)c1c([O-])cc(F)cc1F	ZINC000066047502	506415820	/nfs/dbraw/zinc/41/58/20/506415820.db2.gz	QEJUBWHRLABSMO-UHFFFAOYSA-N	-1	0	357.316	2.528	50	0		FFAARM
O=C([O-])c1cnn2c1N[C@H](c1ccc3c(c1)OCO3)C[C@@H]2C(F)(F)F	ZINC000005027164	506415971	/nfs/dbraw/zinc/41/59/71/506415971.db2.gz	BLNNAPTWPAAZLE-JOYOIKCWSA-N	-1	0	355.272	2.970	50	0		FFAARM
O=C1CCc2cc([N-]S(=O)(=O)c3cc(F)ccc3F)cc3c2N1CC3	ZINC000005153418	506425589	/nfs/dbraw/zinc/42/55/89/506425589.db2.gz	KRNGQRZKKJLGAR-UHFFFAOYSA-N	-1	0	364.373	2.601	50	0		FFAARM
Cc1c2cc(Cl)c([O-])cc2oc(=O)c1CC(=O)NCc1ccccn1	ZINC000005243698	506429935	/nfs/dbraw/zinc/42/99/35/506429935.db2.gz	PEQNDQPYKPGMKB-UHFFFAOYSA-N	-1	0	358.781	2.714	50	0		FFAARM
O=C1CCCN1c1ccc([N-]S(=O)(=O)c2ccc(F)cc2F)cc1	ZINC000005329228	506435365	/nfs/dbraw/zinc/43/53/65/506435365.db2.gz	OTERHCADIFMXCH-UHFFFAOYSA-N	-1	0	352.362	2.892	50	0		FFAARM
Cc1coc2c1c(C)cc1oc(=O)c(CC(=O)NCCC(=O)[O-])c(C)c21	ZINC000006624199	506492537	/nfs/dbraw/zinc/49/25/37/506492537.db2.gz	NDEPPJVONOMDBW-UHFFFAOYSA-N	-1	0	357.362	2.598	50	0	biogenic	FFAARM
CCCSc1ncc(Cl)c(C(=O)N[C@H](CCSC)C(=O)[O-])n1	ZINC000041156841	506495742	/nfs/dbraw/zinc/49/57/42/506495742.db2.gz	VAGPNQDPQGOAHA-SECBINFHSA-N	-1	0	363.892	2.568	50	0		FFAARM
COC(=O)c1ccccc1[N-]S(=O)(=O)c1ccc(OC)c(Cl)c1	ZINC000006672385	506497028	/nfs/dbraw/zinc/49/70/28/506497028.db2.gz	SEKJDTGWLAYWFS-UHFFFAOYSA-N	-1	0	355.799	2.936	50	0		FFAARM
O=C([O-])[C@@H]1CCCC[C@H]1C(=O)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000006742287	506501771	/nfs/dbraw/zinc/50/17/71/506501771.db2.gz	BBIVYBWGMMORSX-IAGOWNOFSA-N	-1	0	364.873	2.875	50	0		FFAARM
COc1ccc(C(=O)[O-])cc1S(=O)(=O)NCCc1ccc(Cl)cc1	ZINC000006848478	506512115	/nfs/dbraw/zinc/51/21/15/506512115.db2.gz	XLPOIDZMZSBWDS-UHFFFAOYSA-N	-1	0	369.826	2.568	50	0		FFAARM
COC(=O)c1sccc1NC(=O)CSc1ccccc1C(=O)[O-]	ZINC000008716972	506664612	/nfs/dbraw/zinc/66/46/12/506664612.db2.gz	RQRFLMBHCBOTTN-UHFFFAOYSA-N	-1	0	351.405	2.964	50	0		FFAARM
O=C(NCc1ccccn1)c1ccc([N-]S(=O)(=O)c2cccs2)cc1	ZINC000009364469	506692991	/nfs/dbraw/zinc/69/29/91/506692991.db2.gz	BDIUXNQCEPOHHY-UHFFFAOYSA-N	-1	0	373.459	2.874	50	0		FFAARM
Cc1cc([N-]S(=O)(=O)c2ccc(F)cc2F)n(-c2ccccn2)n1	ZINC000009421767	506695302	/nfs/dbraw/zinc/69/53/02/506695302.db2.gz	PEOXWPYJOYJRTE-UHFFFAOYSA-N	-1	0	350.350	2.655	50	0		FFAARM
CCOc1cc(C)c(Cl)cc1S(=O)(=O)N1CCC(C(=O)[O-])CC1	ZINC000011566072	506781328	/nfs/dbraw/zinc/78/13/28/506781328.db2.gz	QGHDLGCMFRKHTO-UHFFFAOYSA-N	-1	0	361.847	2.532	50	0		FFAARM
CCCN(Cc1nc(=O)c2sccc2[n-]1)C(=O)Cc1ccccc1OC	ZINC000012225999	506840016	/nfs/dbraw/zinc/84/00/16/506840016.db2.gz	KDTVKXLBCOWLOM-UHFFFAOYSA-N	-1	0	371.462	2.975	50	0		FFAARM
O=C([O-])c1cc(C2CC2)nc2c1c(C1CC1)nn2CC(=O)NC1CCCC1	ZINC000012396375	506859752	/nfs/dbraw/zinc/85/97/52/506859752.db2.gz	KCDAWYCVXJOGBC-UHFFFAOYSA-N	-1	0	368.437	2.943	50	0		FFAARM
COc1cc(/C=C/C(=O)N2CCC[C@@H](C(=O)[O-])C2)cc(Cl)c1OC	ZINC000013170991	506931140	/nfs/dbraw/zinc/93/11/40/506931140.db2.gz	UKFZZSKNQUWDRW-BTDICHCPSA-N	-1	0	353.802	2.694	50	0		FFAARM
Cc1ccc(S(=O)(=O)Nc2cccc(-n3cccn3)c2)cc1C(=O)[O-]	ZINC000045774220	507016398	/nfs/dbraw/zinc/01/63/98/507016398.db2.gz	DJJNCPWFBGWYJI-UHFFFAOYSA-N	-1	0	357.391	2.680	50	0		FFAARM
Cc1ccc(C2C(=O)C(=O)N(c3nnn[n-]3)[C@H]2c2ccccc2F)cc1	ZINC000045928569	507045795	/nfs/dbraw/zinc/04/57/95/507045795.db2.gz	NCQHNMQFTSSIQL-HNNXBMFYSA-N	-1	0	351.341	2.704	50	0		FFAARM
CCc1ccc(C(=O)[O-])cc1S(=O)(=O)Nc1ccc2c(c1)OCCO2	ZINC000045945782	507050387	/nfs/dbraw/zinc/05/03/87/507050387.db2.gz	WJSFQWSEHQPGHX-UHFFFAOYSA-N	-1	0	363.391	2.519	50	0		FFAARM
COc1cccc(-n2[nH][n-]c3c(=O)n(-c4cccc(Cl)c4)c(=O)c2=3)c1	ZINC000023125733	507332265	/nfs/dbraw/zinc/33/22/65/507332265.db2.gz	AMYYMFYWQPIHJW-HUUCEWRRSA-N	-1	0	356.769	2.846	50	0		FFAARM
C[C@@H](C(=O)N1CCCc2ccccc21)S(=O)(=O)c1nc2ccccc2[n-]1	ZINC000047939948	507419767	/nfs/dbraw/zinc/41/97/67/507419767.db2.gz	PGZPOTZPXBTKJJ-ZDUSSCGKSA-N	-1	0	369.446	2.705	50	0		FFAARM
O=C([O-])Cc1ccc(N[C@@H]2CC(=O)N(c3ccc(Cl)cc3)C2=O)cc1	ZINC000025608191	507515539	/nfs/dbraw/zinc/51/55/39/507515539.db2.gz	FWIGVQKFOMJGLJ-OAHLLOKOSA-N	-1	0	358.781	2.711	50	0		FFAARM
COc1ccc(F)cc1-c1cc(C(=O)[O-])cc(S(=O)(=O)NC(C)C)c1	ZINC000072159332	507764007	/nfs/dbraw/zinc/76/40/07/507764007.db2.gz	HNMHUFCQIBFDLH-UHFFFAOYSA-N	-1	0	367.398	2.886	50	0		FFAARM
O=C([O-])c1ccc([C@@H]2CCN(C(=O)c3cccc(-n4cnnc4)c3)C2)cc1	ZINC000072162629	507765315	/nfs/dbraw/zinc/76/53/15/507765315.db2.gz	PSTUYBZIRBFLQB-QGZVFWFLSA-N	-1	0	362.389	2.595	50	0		FFAARM
COCc1ccc(C(=O)N2CCC(Oc3ccccc3)(C(=O)[O-])CC2)o1	ZINC000072468411	507794458	/nfs/dbraw/zinc/79/44/58/507794458.db2.gz	SDLKUXQHOGUEST-UHFFFAOYSA-N	-1	0	359.378	2.564	50	0		FFAARM
CS[C@H](C)C(=O)N1CCC(Oc2cc(C)ccc2F)(C(=O)[O-])CC1	ZINC000072475251	507795055	/nfs/dbraw/zinc/79/50/55/507795055.db2.gz	ZGENGNKFALFIIU-GFCCVEGCSA-N	-1	0	355.431	2.710	50	0		FFAARM
Cc1ccccc1CC(=O)N1C[C@@H](c2ccc3c(c2)OCO3)[C@H](C(=O)[O-])C1	ZINC000091849265	508018663	/nfs/dbraw/zinc/01/86/63/508018663.db2.gz	AOCRBRFLCMODAZ-DLBZAZTESA-N	-1	0	367.401	2.593	50	0		FFAARM
CC(=O)N1CCCc2cc(S(=O)(=O)[N-]c3sc(C)nc3C)ccc21	ZINC000075106950	508083439	/nfs/dbraw/zinc/08/34/39/508083439.db2.gz	NGHRJPABFFECLB-UHFFFAOYSA-N	-1	0	365.480	2.860	50	0		FFAARM
O=C(Nc1ccccc1)c1c[nH]nc1S(=O)(=O)[N-]c1ccc(F)cc1	ZINC000075476411	508109967	/nfs/dbraw/zinc/10/99/67/508109967.db2.gz	PKJUKUVTEBGADB-UHFFFAOYSA-N	-1	0	360.370	2.602	50	0		FFAARM
COc1cccc([N-]S(=O)(=O)c2c(C)[nH]c(C)c2-c2nnc(C)o2)c1	ZINC000075504859	508111922	/nfs/dbraw/zinc/11/19/22/508111922.db2.gz	WJYXNOLKUUAQJG-UHFFFAOYSA-N	-1	0	362.411	2.799	50	0		FFAARM
COc1cc(C)cc(OC)c1[C@H](C(=O)[O-])N(C)Cc1c(C)nn(C)c1C	ZINC000095357534	508175385	/nfs/dbraw/zinc/17/53/85/508175385.db2.gz	WSBWQTBLBYPWSY-GOSISDBHSA-N	-1	0	361.442	2.620	50	0		FFAARM
CC1=C(C(=O)N2CCC[C@@H](c3cccc(C(=O)[O-])c3)C2)SC2=NCCN12	ZINC000095367305	508177575	/nfs/dbraw/zinc/17/75/75/508177575.db2.gz	ISUCGDGAPOPFQP-OAHLLOKOSA-N	-1	0	371.462	2.741	50	0		FFAARM
CN(CC(=O)N1CCC[C@H](c2ccc(C(=O)[O-])cc2)C1)Cc1ccccn1	ZINC000095386753	508183057	/nfs/dbraw/zinc/18/30/57/508183057.db2.gz	UJIGNSVBTUZORO-SFHVURJKSA-N	-1	0	367.449	2.618	50	0		FFAARM
Cc1cc(CC(=O)N[C@H](CC(=O)[O-])c2ccc(Br)cc2)no1	ZINC000095463871	508187015	/nfs/dbraw/zinc/18/70/15/508187015.db2.gz	ZRNGHOHXYDGDOT-CYBMUJFWSA-N	-1	0	367.199	2.620	50	0		FFAARM
O=C([O-])c1cccc(CNC(=O)CCc2ccc3c(c2)OCCCO3)c1	ZINC000095970423	508199776	/nfs/dbraw/zinc/19/97/76/508199776.db2.gz	KCFPQXVDPUSEPL-UHFFFAOYSA-N	-1	0	355.390	2.795	50	0		FFAARM
Cc1cnc([N-]S(=O)(=O)c2cc(F)c(Br)cc2F)s1	ZINC000095976387	508200021	/nfs/dbraw/zinc/20/00/21/508200021.db2.gz	JYHGRTJDRVDOAT-UHFFFAOYSA-N	-1	0	369.212	3.293	50	0		FFAARM
CCCn1ccnc1CN1CCC(Oc2ccccc2OC)(C(=O)[O-])CC1	ZINC000082097318	508225421	/nfs/dbraw/zinc/22/54/21/508225421.db2.gz	AOOJXENEEUEEIG-UHFFFAOYSA-N	-1	0	373.453	2.800	50	0		FFAARM
COc1ccccc1[C@H](C1=C([O-])COC1=O)c1cc2c(cc1O)OCO2	ZINC000106381076	508399914	/nfs/dbraw/zinc/39/99/14/508399914.db2.gz	MPOBHAWPVCZVFX-KRWDZBQOSA-N	-1	0	356.330	2.630	50	0		FFAARM
COc1ccc(OC2(C(=O)[O-])CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000205360704	509235514	/nfs/dbraw/zinc/23/55/14/509235514.db2.gz	ZRKVQTSGYOPCFX-UHFFFAOYSA-N	-1	0	351.399	2.928	50	0		FFAARM
CC(C)[C@@H](O)[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)[O-]	ZINC000214511646	509242380	/nfs/dbraw/zinc/24/23/80/509242380.db2.gz	LYRGLIQVUMAZJU-RTBURBONSA-N	-1	0	369.417	2.995	50	0		FFAARM
O=C([O-])c1ccc(CNC(=O)CCSc2ccc3c(c2)OCCO3)o1	ZINC000219679008	509289776	/nfs/dbraw/zinc/28/97/76/509289776.db2.gz	ALBTXBMGBXKMDY-UHFFFAOYSA-N	-1	0	363.391	2.548	50	0		FFAARM
CN(Cc1ccccc1Cl)C(=O)CC[C@@]1(CCC(=O)[O-])CCC(=O)N1	ZINC000223095935	509329723	/nfs/dbraw/zinc/32/97/23/509329723.db2.gz	FRAOCRBCDOCDBI-GOSISDBHSA-N	-1	0	366.845	2.592	50	0		FFAARM
CC1(C)C(C(=O)N[C@@H]2CCOC[C@H]2Oc2ccc(C(=O)[O-])cc2)C1(C)C	ZINC000223893733	509349131	/nfs/dbraw/zinc/34/91/31/509349131.db2.gz	KUNPEBOVJZLAKF-HUUCEWRRSA-N	-1	0	361.438	2.720	50	0		FFAARM
Cc1ccc(S(=O)(=O)[N-]c2cc(Cl)ccc2C(=O)N(C)C)cn1	ZINC000225698501	509383864	/nfs/dbraw/zinc/38/38/64/509383864.db2.gz	FIRMYWCHIFBYBZ-UHFFFAOYSA-N	-1	0	353.831	2.546	50	0		FFAARM
COCc1ccccc1CNC(=O)CC1(C(=O)[O-])Cc2ccccc2C1	ZINC000237171576	509587308	/nfs/dbraw/zinc/58/73/08/509587308.db2.gz	WGIJMQCVTHQPPK-UHFFFAOYSA-N	-1	0	353.418	2.709	50	0		FFAARM
COc1cccc([C@@H]2C[C@H]2C(=O)N2Cc3ccccc3C[C@@H]2C(=O)[O-])c1	ZINC000237543579	509674254	/nfs/dbraw/zinc/67/42/54/509674254.db2.gz	ULZMIHVMFPFTQD-IPMKNSEASA-N	-1	0	351.402	2.837	50	0		FFAARM
C[C@H](Oc1ccccc1Br)C(=O)N1CC[C@@](C)(C(=O)[O-])C1	ZINC000237676559	509708184	/nfs/dbraw/zinc/70/81/84/509708184.db2.gz	VYEQTOFVQRVMEL-ZUZCIYMTSA-N	-1	0	356.216	2.540	50	0		FFAARM
Cc1nc(-c2ccc(Cl)s2)sc1C(=O)N1CCO[C@@H](C(=O)[O-])C1	ZINC000237682666	509710413	/nfs/dbraw/zinc/71/04/13/509710413.db2.gz	IXBBBSVCQJTZPJ-MRVPVSSYSA-N	-1	0	372.855	2.759	50	0		FFAARM
Cc1cccc(C[C@H](CNC(=O)[C@@H]2CCOc3ccccc32)C(=O)[O-])c1	ZINC000237692369	509712204	/nfs/dbraw/zinc/71/22/04/509712204.db2.gz	IHHLYDFQIAYDJX-SJLPKXTDSA-N	-1	0	353.418	2.921	50	0		FFAARM
Cc1nc2cc(F)ccc2cc1C(=O)N(CCC(=O)[O-])C[C@@H]1CCCO1	ZINC000237744964	509725069	/nfs/dbraw/zinc/72/50/69/509725069.db2.gz	VQTFVHHODDPARJ-HNNXBMFYSA-N	-1	0	360.385	2.778	50	0		FFAARM
Cn1cc(/C=C/C(=O)N(CCC(=O)[O-])C2CCOCC2)c2ccccc21	ZINC000237751666	509726988	/nfs/dbraw/zinc/72/69/88/509726988.db2.gz	QSGPTIIGIJPUOK-VOTSOKGWSA-N	-1	0	356.422	2.674	50	0		FFAARM
O=C([O-])CCN(C(=O)c1ccccc1Br)C1CCOCC1	ZINC000238075844	509816176	/nfs/dbraw/zinc/81/61/76/509816176.db2.gz	PFOAVIHNHFPWAR-UHFFFAOYSA-N	-1	0	356.216	2.545	50	0		FFAARM
Cc1csc(CNS(=O)(=O)c2cc(C(F)(F)F)ccc2[O-])n1	ZINC000253431630	509882797	/nfs/dbraw/zinc/88/27/97/509882797.db2.gz	WNEAQEQBCUKGAC-UHFFFAOYSA-N	-1	0	352.359	2.654	50	0		FFAARM
COc1ccc(NC(=O)C(C#N)=NNc2cccc(C(=O)[O-])c2)cc1Cl	ZINC000254590075	509907685	/nfs/dbraw/zinc/90/76/85/509907685.db2.gz	IHIVOBHQPXZLLU-UHFFFAOYSA-N	-1	0	372.768	2.977	50	0		FFAARM
Cc1ccccc1C1N=NC(=S)N1N=Cc1ccccc1OCC(=O)[O-]	ZINC000254698405	509908614	/nfs/dbraw/zinc/90/86/14/509908614.db2.gz	YWRIEODBSMLEPC-UHFFFAOYSA-N	-1	0	368.418	2.888	50	0		FFAARM
O=C([O-])C1CCC(NC(=O)Cc2cn3cc(Cl)cc(Cl)c3n2)CC1	ZINC000261999998	510143768	/nfs/dbraw/zinc/14/37/68/510143768.db2.gz	GBMRQKLFKXJAKY-UHFFFAOYSA-N	-1	0	370.236	2.943	50	0		FFAARM
CCOc1ccccc1Oc1ccccc1C(=O)N1CCO[C@@H](C(=O)[O-])C1	ZINC000262113989	510182303	/nfs/dbraw/zinc/18/23/03/510182303.db2.gz	OQCCTUQRLYYWQX-GOSISDBHSA-N	-1	0	371.389	2.803	50	0		FFAARM
Cn1cc(CCC(=O)N2CCC(Cc3ccccc3C(=O)[O-])CC2)cn1	ZINC000263157483	510590313	/nfs/dbraw/zinc/59/03/13/510590313.db2.gz	XVQDEXDGFJIITF-UHFFFAOYSA-N	-1	0	355.438	2.532	50	0		FFAARM
COc1ccc(-c2nnc(S(=O)(=O)Cc3ccc(C)cc3)[n-]2)c(OC)c1	ZINC000195188600	510707118	/nfs/dbraw/zinc/70/71/18/510707118.db2.gz	SLCSPOZBPYFQPM-UHFFFAOYSA-N	-1	0	373.434	2.771	50	0		FFAARM
CSc1ccccc1C(=O)N1CCC[C@@H](c2ccn(CC(=O)[O-])n2)C1	ZINC000426434820	513940202	/nfs/dbraw/zinc/94/02/02/513940202.db2.gz	HQBNLFWRNUWZRU-CYBMUJFWSA-N	-1	0	359.451	2.709	50	0		FFAARM
Cc1cnn(CC(=O)N[C@](C)(C(=O)[O-])c2ccc(Cl)c(Cl)c2)c1	ZINC000455906349	514825550	/nfs/dbraw/zinc/82/55/50/514825550.db2.gz	RXFDFSYPTXRNRJ-HNNXBMFYSA-N	-1	0	356.209	2.615	50	0		FFAARM
CC(C)(C(=O)N=c1nc(C2(C)CC2)[n-]s1)c1ccc2c(c1)OCCO2	ZINC000529705001	517296879	/nfs/dbraw/zinc/29/68/79/517296879.db2.gz	VGSXOPUKXBKKAD-UHFFFAOYSA-N	-1	0	359.451	2.699	50	0		FFAARM
CC(C)(C)c1ccc(CCC(=O)[N-]S(=O)(=O)c2ncccc2F)cc1	ZINC000241588540	517392313	/nfs/dbraw/zinc/39/23/13/517392313.db2.gz	PDXLFOQZKNLBQK-UHFFFAOYSA-N	-1	0	364.442	2.956	50	0		FFAARM
C[C@H](NC(=O)C1(C(=O)[O-])CCC1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000567969161	518805978	/nfs/dbraw/zinc/80/59/78/518805978.db2.gz	POIUUHPKHMYAFX-ZDUSSCGKSA-N	-1	0	367.405	2.766	50	0		FFAARM
CC(C)c1ccc(-c2nc(C(=O)N3CCOC[C@@H]3C(=O)[O-])cs2)cc1	ZINC000268963791	519833847	/nfs/dbraw/zinc/83/38/47/519833847.db2.gz	BFNBICMGSXRFBT-OAHLLOKOSA-N	-1	0	360.435	2.859	50	0		FFAARM
COc1ccc(/C=C\C(=O)N2Cc3ccccc3C[C@H]2C(=O)[O-])cc1OC	ZINC000606441139	521068142	/nfs/dbraw/zinc/06/81/42/521068142.db2.gz	HPTHGFNMTDIXDO-PXAMLJHWSA-N	-1	0	367.401	2.755	50	0		FFAARM
COc1ccc(/C=C\C(=O)N2Cc3ccccc3C[C@@H]2C(=O)[O-])cc1OC	ZINC000606441160	521069147	/nfs/dbraw/zinc/06/91/47/521069147.db2.gz	HPTHGFNMTDIXDO-SECOEOQKSA-N	-1	0	367.401	2.755	50	0		FFAARM
C[C@@H](NC(=O)Nc1ccccc1C[S@@](C)=O)[C@@H]1C[C@H](C(=O)[O-])C1(C)C	ZINC000593963189	521318914	/nfs/dbraw/zinc/31/89/14/521318914.db2.gz	ZBZOVJHDYMQMPT-NVUGWRQVSA-N	-1	0	366.483	2.822	50	0		FFAARM
COc1cccc([C@H](CC(=O)[O-])NC(=O)[C@@H]2[C@@H]3Cc4ccccc4[C@@H]32)c1	ZINC000630123354	522635254	/nfs/dbraw/zinc/63/52/54/522635254.db2.gz	AHOITYNWCLIRRD-LCLWPZTBSA-N	-1	0	351.402	2.913	50	0		FFAARM
COC1CC(C(=O)N[C@@H](CC(=O)[O-])c2ccc(Br)cc2)C1	ZINC000630123558	522635542	/nfs/dbraw/zinc/63/55/42/522635542.db2.gz	CUAGJUFQBPLLNP-GDKBPFBDSA-N	-1	0	356.216	2.506	50	0		FFAARM
Cc1nn(CCC(=O)[O-])c(C)c1NC(=O)[C@H]1C[C@H]1c1ccc(F)c(F)c1	ZINC000630331949	522795631	/nfs/dbraw/zinc/79/56/31/522795631.db2.gz	RMZPZWJNSVLQNB-STQMWFEESA-N	-1	0	363.364	2.995	50	0		FFAARM
O=S(=O)([N-]c1c[nH]nc1C1CC1)c1ccnn1CCc1ccccc1	ZINC000622040177	523232477	/nfs/dbraw/zinc/23/24/77/523232477.db2.gz	ITDFLQDSTTUHNI-UHFFFAOYSA-N	-1	0	357.439	2.527	50	0		FFAARM
Cc1cc(C(=O)N2CCOC[C@@H]2C(=O)[O-])c(C)n1[C@H](C)c1ccccc1	ZINC000262560623	526255279	/nfs/dbraw/zinc/25/52/79/526255279.db2.gz	YHYBMNGDIOMSJZ-RDTXWAMCSA-N	-1	0	356.422	2.640	50	0		FFAARM
O=C([O-])[C@H]1CCCC[C@H]1C(=O)N1CCN(c2cccc(Cl)c2)CC1	ZINC000000178899	526321341	/nfs/dbraw/zinc/32/13/41/526321341.db2.gz	NNVAEGDGLIJWFI-CVEARBPZSA-N	-1	0	350.846	2.880	50	0		FFAARM
COc1ccc(S(=O)(=O)N(C)c2cc(C)cc(C)c2)cc1CC(=O)[O-]	ZINC000095459932	537706180	/nfs/dbraw/zinc/70/61/80/537706180.db2.gz	CKHLCDLRCGIZJN-UHFFFAOYSA-N	-1	0	363.435	2.764	50	0		FFAARM
Cc1cc(C)c(S(=O)(=O)N(CC#N)c2cccc(F)c2)cc1C(=O)[O-]	ZINC000084076991	570771355	/nfs/dbraw/zinc/77/13/55/570771355.db2.gz	FRHSREUZNMBVCC-UHFFFAOYSA-N	-1	0	362.382	2.860	50	0		FFAARM
Cc1cc(Cl)ccc1NC(=O)N1CCc2nc3cc[n-]n3c(=O)c2C1	ZINC000102990696	570842636	/nfs/dbraw/zinc/84/26/36/570842636.db2.gz	WAFQLZQHICPBBB-UHFFFAOYSA-N	-1	0	357.801	2.575	50	0		FFAARM
O=C([O-])C1(NC(=O)C2CCN(c3ccc(Cl)cn3)CC2)CCCCC1	ZINC000084428943	571085763	/nfs/dbraw/zinc/08/57/63/571085763.db2.gz	SMPICXADAXVKQO-UHFFFAOYSA-N	-1	0	365.861	2.855	50	0		FFAARM
Nc1nc(C(=O)N2C[C@@H]3C[C@@H](c4ccccc4)CC[C@]3(C(=O)[O-])C2)cs1	ZINC000426387005	571138607	/nfs/dbraw/zinc/13/86/07/571138607.db2.gz	CAJBIPVOCPZQBY-NJSLBKSFSA-N	-1	0	371.462	2.836	50	0		FFAARM
CCc1cc(CC)c(S(=O)(=O)[N-]C(=O)Cc2cscn2)c(CC)c1	ZINC000853129801	750013888	/nfs/dbraw/zinc/01/38/88/750013888.db2.gz	RQWFBEVBUJYDJN-UHFFFAOYSA-N	-1	0	366.508	2.878	50	0		FFAARM
Cc1cnn(C2(C(=O)[O-])CCN(C(=O)c3sccc3Cl)CC2)c1	ZINC000072427102	845555486	/nfs/dbraw/zinc/55/54/86/845555486.db2.gz	ZSHHBNPVFICIFI-UHFFFAOYSA-N	-1	0	353.831	2.623	50	0		FFAARM
Cc1oc(CNC(=O)CCc2ccc3c(c2)OCCCO3)cc1C(=O)[O-]	ZINC000888092619	976535811	/nfs/dbraw/zinc/53/58/11/976535811.db2.gz	KDJPVPBUYPAKGH-UHFFFAOYSA-N	-1	0	359.378	2.697	50	0		FFAARM
COc1cc(CNCc2n[nH]c(=O)[n-]2)ccc1OCc1cccc(F)c1	ZINC000952873527	1011005055	/nfs/dbraw/zinc/00/50/55/1011005055.db2.gz	LGBPVSZJGABWFI-UHFFFAOYSA-N	-1	0	358.373	2.527	50	0		FFAARM
COc1cccc(C)c1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)[O-]	ZINC000952980693	1011026705	/nfs/dbraw/zinc/02/67/05/1011026705.db2.gz	RSJASEWFTILXSA-INIZCTEOSA-N	-1	0	352.390	2.911	50	0		FFAARM
O=C(N[C@@H]1CCCN(CC(F)(F)F)C1=O)c1ccc2ccccc2c1O	ZINC000155595711	1022267803	/nfs/dbraw/zinc/26/78/03/1022267803.db2.gz	HNQPRRLGEJAMCY-CQSZACIVSA-N	-1	0	366.339	2.829	50	0		FFAARM
CC[C@@H](C)Oc1ccccc1/C=C/C(=O)N(CC(=O)[O-])C1CCOCC1	ZINC000328594782	529387356	/nfs/dbraw/zinc/38/73/56/529387356.db2.gz	BLVUDWQARLAJAO-XVJNWHFHSA-N	-1	0	361.438	2.969	50	0		FFAARM
CN(Cc1cc(-c2ccccc2)n[nH]1)C(=O)c1cc(=O)n(-c2ccccc2)[n-]1	ZINC000216042437	222658399	/nfs/dbraw/zinc/65/83/99/222658399.db2.gz	XIWWLJNSTCITCR-UHFFFAOYSA-N	-1	0	373.416	2.828	50	0		FFAARM
COc1ccccc1N1C(=O)C[C@H](Sc2ccccc2C(=O)[O-])C1=O	ZINC000000628999	219306678	/nfs/dbraw/zinc/30/66/78/219306678.db2.gz	DTHHLIHNAMJJEY-HNNXBMFYSA-N	-1	0	357.387	2.818	50	0		FFAARM
CN(C)c1ccc(N2C(=O)C[C@H](Sc3ccccc3C(=O)[O-])C2=O)cc1	ZINC000000917018	219340445	/nfs/dbraw/zinc/34/04/45/219340445.db2.gz	HFWIBNGPTDQELD-INIZCTEOSA-N	-1	0	370.430	2.875	50	0		FFAARM
O=C([O-])CCC(=O)Nc1ccc(C(=O)OCC(=O)c2ccccc2)cc1	ZINC000000993361	219351416	/nfs/dbraw/zinc/35/14/16/219351416.db2.gz	VDERCHMQASPMIF-UHFFFAOYSA-N	-1	0	355.346	2.530	50	0		FFAARM
CC(C)(C)c1ccc(S(=O)(=O)N[C@H](Cc2ccccc2)C(=O)[O-])cc1	ZINC000000952961	219346905	/nfs/dbraw/zinc/34/69/05/219346905.db2.gz	AJHUCLCRIWTQMB-QGZVFWFLSA-N	-1	0	361.463	2.958	50	0		FFAARM
Cc1c2cc3c(cc2oc(=O)c1CC(=O)NCC(=O)[O-])occ3C(C)(C)C	ZINC000002118875	219426921	/nfs/dbraw/zinc/42/69/21/219426921.db2.gz	WQTQOVFESNWRSA-UHFFFAOYSA-N	-1	0	371.389	2.888	50	0	biogenic	FFAARM
O=C([O-])CC1(CC(=O)N[C@@H]2CCN(c3ncccc3F)C2)CCCCC1	ZINC000238091377	222913746	/nfs/dbraw/zinc/91/37/46/222913746.db2.gz	XQUFSWMAJBEIJX-CQSZACIVSA-N	-1	0	363.433	2.731	50	0		FFAARM
O=C([O-])CCN(C(=O)Cc1c[nH]c2cc(Cl)ccc12)C1CCOCC1	ZINC000238065102	222913902	/nfs/dbraw/zinc/91/39/02/222913902.db2.gz	LMUVIAWPSVWVLI-UHFFFAOYSA-N	-1	0	364.829	2.846	50	0		FFAARM
O=C([O-])CCN(C(=O)c1cc(F)ccc1Br)C1CCOCC1	ZINC000238074065	222913977	/nfs/dbraw/zinc/91/39/77/222913977.db2.gz	GRNCILITRSBYBE-UHFFFAOYSA-N	-1	0	374.206	2.684	50	0		FFAARM
COc1ccc(-n2ccc(C(=O)N3CCC[C@H](CCC(=O)[O-])C3)n2)cc1	ZINC000237511579	222908218	/nfs/dbraw/zinc/90/82/18/222908218.db2.gz	WNTLMYWCWWZJAI-CQSZACIVSA-N	-1	0	357.410	2.598	50	0		FFAARM
Cc1nc(-c2cnn(C)c2)sc1C(=O)N1[C@H](C(=O)[O-])C[C@H]2CCCC[C@@H]21	ZINC000237734239	222909153	/nfs/dbraw/zinc/90/91/53/222909153.db2.gz	VEMNUFPAMQLTQM-XBFCOCLRSA-N	-1	0	374.466	2.710	50	0		FFAARM
COC(=O)C[C@H](NC(=O)[C@@H]1CCCC[C@@H]1C(=O)[O-])c1cc(C)ccc1C	ZINC000004590170	219590194	/nfs/dbraw/zinc/59/01/94/219590194.db2.gz	UIZSNGWYNLFTHM-VYDXJSESSA-N	-1	0	361.438	2.915	50	0		FFAARM
C[C@@H](NC(=O)/C(=C\c1ccc(Cl)cc1)NC(=O)c1ccccc1)C(=O)[O-]	ZINC000005092235	219649465	/nfs/dbraw/zinc/64/94/65/219649465.db2.gz	BCGZSUJANOSRFW-PILJQMSFSA-N	-1	0	372.808	2.700	50	0		FFAARM
O=C1CCCN1c1ccc(S(=O)(=O)[N-]c2noc3ccccc32)cc1	ZINC000007363548	219801951	/nfs/dbraw/zinc/80/19/51/219801951.db2.gz	GYWODKCGNWGUOM-UHFFFAOYSA-N	-1	0	357.391	2.755	50	0		FFAARM
O=C([O-])[C@@H]1Cc2ccccc2CN1C(=O)C[C@@H]1CCOc2ccccc21	ZINC000299749915	223080884	/nfs/dbraw/zinc/08/08/84/223080884.db2.gz	MAAPOKSEWXCILR-YJBOKZPZSA-N	-1	0	351.402	2.981	50	0		FFAARM
COc1cc(/C=C2\N=C(c3ccc(C)cc3)OC2=O)ccc1OCC(=O)[O-]	ZINC000012901264	220040265	/nfs/dbraw/zinc/04/02/65/220040265.db2.gz	HAYUFTDHPYIYHT-DHDCSXOGSA-N	-1	0	367.357	2.812	50	0		FFAARM
COC(=O)c1cccc(NS(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)c1	ZINC000013079044	220057237	/nfs/dbraw/zinc/05/72/37/220057237.db2.gz	VTEVQWJROMNECO-UHFFFAOYSA-N	-1	0	363.391	2.589	50	0		FFAARM
COc1ccc(C(=O)[O-])cc1S(=O)(=O)Nc1ccc(Cl)cc1F	ZINC000013358857	220064975	/nfs/dbraw/zinc/06/49/75/220064975.db2.gz	PAYZKXFIWCNFMN-UHFFFAOYSA-N	-1	0	359.762	2.987	50	0		FFAARM
CCOc1cc(C(=O)N2CCC[C@@H](C(=O)[O-])C2)cc(OCC)c1OCC	ZINC000013170237	220060678	/nfs/dbraw/zinc/06/06/78/220060678.db2.gz	KOMGPYNSVIBDAA-CYBMUJFWSA-N	-1	0	365.426	2.820	50	0		FFAARM
COc1ccc(CCC(=O)N[C@H](CC(=O)[O-])c2ccccc2)cc1OC	ZINC000013224563	220060943	/nfs/dbraw/zinc/06/09/43/220060943.db2.gz	LXZNZKFVHGGHFW-MRXNPFEDSA-N	-1	0	357.406	2.969	50	0		FFAARM
Cc1c2cc(F)ccc2oc1C(=O)[N-]N1C(=O)N[C@](C)(c2ccco2)C1=O	ZINC000014094479	220106055	/nfs/dbraw/zinc/10/60/55/220106055.db2.gz	HDPFBBURIXNHEV-GOSISDBHSA-N	-1	0	371.324	2.585	50	0		FFAARM
COc1c2c(c(CNc3ccccc3C(=O)[O-])c(OC)c1OC)C(=O)OC2	ZINC000015083680	220147585	/nfs/dbraw/zinc/14/75/85/220147585.db2.gz	XGPRBYXZSJCGTI-UHFFFAOYSA-N	-1	0	373.361	2.693	50	0		FFAARM
COc1ccccc1[N-]S(=O)(=O)c1ccc2c(c1)NC(=O)CCS2	ZINC000015728442	220161941	/nfs/dbraw/zinc/16/19/41/220161941.db2.gz	SIMAVBFIEMQMIV-UHFFFAOYSA-N	-1	0	364.448	2.930	50	0		FFAARM
CC[C@H]1CCc2c(sc(NC(=O)CCC(=O)[O-])c2C(=O)NC2CC2)C1	ZINC000017074925	220204163	/nfs/dbraw/zinc/20/41/63/220204163.db2.gz	ZOEYPJUIASTGSK-JTQLQIEISA-N	-1	0	364.467	2.959	50	0		FFAARM
O=C([O-])CCCCCNC(=O)c1ccc(I)cc1	ZINC000020304914	249326601	/nfs/dbraw/zinc/32/66/01/249326601.db2.gz	KMGUYKHNXAQQKM-UHFFFAOYSA-N	-1	0	361.179	2.666	50	0		FFAARM
COC(=O)c1cc(S(=O)(=O)[N-]c2ccc(OC(F)(F)F)cc2)c[nH]1	ZINC000020510484	220330646	/nfs/dbraw/zinc/33/06/46/220330646.db2.gz	QAKXTYJMMGQDGY-UHFFFAOYSA-N	-1	0	364.301	2.501	50	0		FFAARM
CCOC(=O)N1CCN([C@@H](C(=O)[O-])c2c[nH]c3cccc(Cl)c32)CC1	ZINC000020737462	220339902	/nfs/dbraw/zinc/33/99/02/220339902.db2.gz	HXZDWYDMSAJLGE-OAHLLOKOSA-N	-1	0	365.817	2.721	50	0		FFAARM
Cc1cn2c(nc(C)c(S(=O)(=O)[N-]c3ccccc3Cl)c2=O)s1	ZINC000020921861	220346638	/nfs/dbraw/zinc/34/66/38/220346638.db2.gz	HMAORKIPAVNTII-UHFFFAOYSA-N	-1	0	369.855	2.827	50	0		FFAARM
COc1cc(/C=C2\CCn3c2nc2cc(C(=O)[O-])ccc2c3=O)ccc1O	ZINC000021314211	220356618	/nfs/dbraw/zinc/35/66/18/220356618.db2.gz	JJLLVJPEHGMSKH-XYOKQWHBSA-N	-1	0	364.357	2.753	50	0		FFAARM
CCc1ccc([C@H](O)COc2ccc(C[C@@H]3SC(=O)[N-]C3=O)cc2)nc1	ZINC000021981313	220372319	/nfs/dbraw/zinc/37/23/19/220372319.db2.gz	RMTFRGFLVHAYCI-SJORKVTESA-N	-1	0	372.446	2.651	50	0	in-vitro	FFAARM
CCOc1ccc(Br)cc1S(=O)(=O)[N-]c1cnn(CC)c1	ZINC000024577085	220453057	/nfs/dbraw/zinc/45/30/57/220453057.db2.gz	DOLACECTPDHHFY-UHFFFAOYSA-N	-1	0	374.260	2.865	50	0		FFAARM
COc1cc2c(cc1OC)[C@H](CC(=O)[O-])N(C(=O)[C@@H]1CC=CCC1)CC2	ZINC000299742044	533171693	/nfs/dbraw/zinc/17/16/93/533171693.db2.gz	GMYDEYVOPCBYEE-CJNGLKHVSA-N	-1	0	359.422	2.961	50	0		FFAARM
COc1cccc(-c2cc(C(F)(F)F)n3nc(CCC(=O)[O-])nc3n2)c1	ZINC000035655586	220791474	/nfs/dbraw/zinc/79/14/74/220791474.db2.gz	UTYNSVRUYHWNBD-UHFFFAOYSA-N	-1	0	366.299	2.836	50	0		FFAARM
CCNC(=O)c1ccc(Cl)cc1NC(=O)[C@H]1CC=CC[C@@H]1C(=O)[O-]	ZINC000055150235	221060302	/nfs/dbraw/zinc/06/03/02/221060302.db2.gz	SAKJFVXUXIJFAP-RYUDHWBXSA-N	-1	0	350.802	2.695	50	0		FFAARM
O=C([O-])c1cn(C[C@@H](O)Cc2ccccc2)cc(Oc2ccccc2)c1=O	ZINC000055245283	221063661	/nfs/dbraw/zinc/06/36/61/221063661.db2.gz	QEVAOQZNLXGNBO-INIZCTEOSA-N	-1	0	365.385	2.942	50	0		FFAARM
O=C([O-])c1cc2c(c(S(=O)(=O)Nc3ccc(F)c(F)c3)c1)CCC2	ZINC000055555388	221071215	/nfs/dbraw/zinc/07/12/15/221071215.db2.gz	XRUBHRUNBDJVQM-UHFFFAOYSA-N	-1	0	353.346	2.953	50	0		FFAARM
O=C([O-])c1cc(S(=O)(=O)N2CCc3ccc(Cl)cc32)ccc1F	ZINC000058496009	221120202	/nfs/dbraw/zinc/12/02/02/221120202.db2.gz	MNFURCMNNDEVFN-UHFFFAOYSA-N	-1	0	355.774	2.929	50	0		FFAARM
COc1ccc2c(c1)CCN2S(=O)(=O)c1cc(C(=O)[O-])ccc1Cl	ZINC000058494943	221120360	/nfs/dbraw/zinc/12/03/60/221120360.db2.gz	FKJSTUXEEHAADP-UHFFFAOYSA-N	-1	0	367.810	2.798	50	0		FFAARM
Cn1c2ccc(NC(=O)CC3(C(=O)[O-])CCCCCC3)cc2n(C)c1=O	ZINC000064611610	221149086	/nfs/dbraw/zinc/14/90/86/221149086.db2.gz	YGHFWIUABVUNLW-UHFFFAOYSA-N	-1	0	359.426	2.631	50	0		FFAARM
CCc1nn2c(nc(C)c2S(=O)(=O)[N-]c2cccc(F)c2C)s1	ZINC000065183796	221176239	/nfs/dbraw/zinc/17/62/39/221176239.db2.gz	QAWLPKCZLCZCPF-UHFFFAOYSA-N	-1	0	354.432	2.910	50	0		FFAARM
Cc1ccc(F)c([N-]S(=O)(=O)c2cc(-c3ccc(=O)[nH]n3)cs2)c1	ZINC000065129077	221170837	/nfs/dbraw/zinc/17/08/37/221170837.db2.gz	DCZGDAJQWSBTHQ-UHFFFAOYSA-N	-1	0	365.411	2.747	50	0		FFAARM
O=C(CSc1nc2[nH]c(=O)cc([O-])c2s1)Nc1cccc(F)c1	ZINC000065361878	221202465	/nfs/dbraw/zinc/20/24/65/221202465.db2.gz	FBCPRMHHPQQMGZ-UHFFFAOYSA-N	-1	0	351.384	2.560	50	0		FFAARM
O=C([O-])c1cc([C@H]2CC(=O)Nc3cc(N4CCOC4=O)ccc32)ccc1O	ZINC000065380792	221206285	/nfs/dbraw/zinc/20/62/85/221206285.db2.gz	VWMUSVYUBJSAQP-CYBMUJFWSA-N	-1	0	368.345	2.521	50	0		FFAARM
O=C([O-])c1nn(Cc2ccc(F)cc2)c2c1CN(C(=O)CCC1CC1)CC2	ZINC000067741550	221278571	/nfs/dbraw/zinc/27/85/71/221278571.db2.gz	PZJJABATSZBLFK-UHFFFAOYSA-N	-1	0	371.412	2.844	50	0		FFAARM
COc1cccc(CC2(CO)CCN(c3nc(C)ccc3C(=O)[O-])CC2)c1	ZINC000067755338	221280950	/nfs/dbraw/zinc/28/09/50/221280950.db2.gz	FCGQIOPZDVSCQG-UHFFFAOYSA-N	-1	0	370.449	2.918	50	0		FFAARM
CC(=O)c1cccc(-n2c(SCC(=O)[O-])nnc2-c2coc(C)n2)c1	ZINC000067783950	221285004	/nfs/dbraw/zinc/28/50/04/221285004.db2.gz	NLZRUIYBFDCMLQ-UHFFFAOYSA-N	-1	0	358.379	2.610	50	0		FFAARM
CN(C)Cc1nnc(SCC(=O)[O-])n1-c1ccccc1C(F)(F)F	ZINC000067981629	221311928	/nfs/dbraw/zinc/31/19/28/221311928.db2.gz	NXVRBBMQJPXIKO-UHFFFAOYSA-N	-1	0	360.361	2.524	50	0		FFAARM
COC(=O)C[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)[O-]	ZINC000071606128	221351227	/nfs/dbraw/zinc/35/12/27/221351227.db2.gz	HSOKCYGOTGVDHL-QGZVFWFLSA-N	-1	0	369.373	2.541	50	0		FFAARM
Cc1ccc(OC2(C(=O)[O-])CCN(C(=O)CCn3cccc3)CC2)cc1	ZINC000072423297	221511854	/nfs/dbraw/zinc/51/18/54/221511854.db2.gz	JWQPRLATMAYFJD-UHFFFAOYSA-N	-1	0	356.422	2.711	50	0		FFAARM
COc1ccc(C(NC(=O)[C@@H]2C[C@H]2C(=O)[O-])c2ccc(OC)cc2)cc1	ZINC000299753610	533370527	/nfs/dbraw/zinc/37/05/27/533370527.db2.gz	YUFIDRRBKHGYJX-IAGOWNOFSA-N	-1	0	355.390	2.630	50	0		FFAARM
O=C([O-])c1ccc(N2CCC(c3nccn3Cc3ccncc3)CC2)nc1	ZINC000095361828	132207760	/nfs/dbraw/zinc/20/77/60/132207760.db2.gz	YLECDSZSDQVFOT-UHFFFAOYSA-N	-1	0	363.421	2.804	50	0		FFAARM
CCOc1ccccc1N1CCN(C(=O)[C@@H]2CCCC[C@@H]2C(=O)[O-])CC1	ZINC000002739289	132384086	/nfs/dbraw/zinc/38/40/86/132384086.db2.gz	JOYNFTZYFAUFHS-CVEARBPZSA-N	-1	0	360.454	2.625	50	0		FFAARM
O=C([O-])c1cccc(S(=O)(=O)N2CCCc3cc(F)cc(F)c32)c1	ZINC000040082752	136119213	/nfs/dbraw/zinc/11/92/13/136119213.db2.gz	ZSRZENWULHENIU-UHFFFAOYSA-N	-1	0	353.346	2.805	50	0		FFAARM
O=C([O-])[C@]1(Cc2ccc(F)cc2F)CCCN(c2ncnc3nc[nH]c32)C1	ZINC000071750640	136140089	/nfs/dbraw/zinc/14/00/89/136140089.db2.gz	SUJJACXPMSWFLD-SFHVURJKSA-N	-1	0	373.363	2.545	50	0		FFAARM
Cc1nc([C@H]2CCCN(c3ncccc3C(=O)[O-])C2)cc(N2CCCC2)n1	ZINC000072475431	136149149	/nfs/dbraw/zinc/14/91/49/136149149.db2.gz	DLFLPYGZTDTQND-HNNXBMFYSA-N	-1	0	367.453	2.862	50	0		FFAARM
CC1(C)C[C@]1(C(=O)N1CCn2nc(CCC(=O)[O-])cc2C1)c1cccs1	ZINC000072469292	221544225	/nfs/dbraw/zinc/54/42/25/221544225.db2.gz	WBRZHQNKSJFJQG-LJQANCHMSA-N	-1	0	373.478	2.672	50	0		FFAARM
COc1cc(C(=O)[O-])cc(NC(=O)c2cnn(-c3ccccc3)c2)c1OC	ZINC000095424838	221901666	/nfs/dbraw/zinc/90/16/66/221901666.db2.gz	DZEAOPHRWNLIFS-UHFFFAOYSA-N	-1	0	367.361	2.840	50	0		FFAARM
COC(=O)C[C@@H](c1ccsc1)c1c([O-])nc2ccc(Cl)cn2c1=O	ZINC000096117431	222032570	/nfs/dbraw/zinc/03/25/70/222032570.db2.gz	GVSLGVFACPJRML-NSHDSACASA-N	-1	0	364.810	2.810	50	0		FFAARM
COc1ccc2c(c1)OC[C@]1(C(=O)[O-])CN(C(=O)c3ccc(F)cc3)C[C@H]21	ZINC000096131678	222036818	/nfs/dbraw/zinc/03/68/18/222036818.db2.gz	HIIMAHKMEFTZCT-OXQOHEQNSA-N	-1	0	371.364	2.537	50	0		FFAARM
CSCC[C@H](NC(=O)Cc1ccc2c(c1)CCC(C)(C)O2)C(=O)[O-]	ZINC000096222349	222084943	/nfs/dbraw/zinc/08/49/43/222084943.db2.gz	BHTDCRNCGQVYRH-AWEZNQCLSA-N	-1	0	351.468	2.655	50	0	biogenic	FFAARM
CC(=O)c1cccc([N-]S(=O)(=O)c2c(C)[nH]c(C)c2-c2nnc(C)o2)c1	ZINC000096379561	222117508	/nfs/dbraw/zinc/11/75/08/222117508.db2.gz	HQRLKOHBCYSDCP-UHFFFAOYSA-N	-1	0	374.422	2.993	50	0		FFAARM
COc1ccc(/C=C\C(=O)[O-])cc1S(=O)(=O)N(C)c1ccc(F)cc1	ZINC000096401803	222119736	/nfs/dbraw/zinc/11/97/36/222119736.db2.gz	HMDBLAONMATSGO-WMZJFQQLSA-N	-1	0	365.382	2.757	50	0		FFAARM
COc1ccc(/C=C\C(=O)[O-])cc1S(=O)(=O)Nc1c(F)cccc1F	ZINC000096747852	222128912	/nfs/dbraw/zinc/12/89/12/222128912.db2.gz	UBZVQRRJSDTVOC-VURMDHGXSA-N	-1	0	369.345	2.872	50	0		FFAARM
Cc1cccc(S(=O)(=O)NCCC[C@@H](C)C(=O)[O-])c1Br	ZINC000097165139	222165863	/nfs/dbraw/zinc/16/58/63/222165863.db2.gz	MDABDFHIZOETLK-SNVBAGLBSA-N	-1	0	364.261	2.537	50	0		FFAARM
CC(=O)c1nn(-c2ccccc2Cl)c2c(O)n(-c3ccccc3)c(O)c12	ZINC000100053608	222234224	/nfs/dbraw/zinc/23/42/24/222234224.db2.gz	VDIZIYFCLMTVGZ-WBVHZDCISA-N	-1	0	367.792	2.663	50	0		FFAARM
Cc1nc2[n-]c(NC(=O)c3ccc(C(C)(C)C)cc3)nn2c(=O)c1Cl	ZINC000100650751	222249418	/nfs/dbraw/zinc/24/94/18/222249418.db2.gz	DJBHYLSSVJPRGO-UHFFFAOYSA-N	-1	0	359.817	2.929	50	0		FFAARM
Cc1[n-]n(-c2nc(-c3ccc(C)cc3)cs2)c(=O)c1CC(=O)N(C)C	ZINC000101831390	222286180	/nfs/dbraw/zinc/28/61/80/222286180.db2.gz	FHYSPIANSDDORV-UHFFFAOYSA-N	-1	0	356.451	2.949	50	0		FFAARM
O=C([O-])[C@H]1CC=CC[C@H]1C(=O)Nc1ccccc1C(=O)NCc1ccco1	ZINC000001019557	506244140	/nfs/dbraw/zinc/24/41/40/506244140.db2.gz	STQFQNBZRUSIST-CABCVRRESA-N	-1	0	368.389	2.815	50	0		FFAARM
Cc1cc(C)nc([N-]S(=O)(=O)c2ccc(NC(=O)C(C)(C)C)cc2)n1	ZINC000001505633	506264812	/nfs/dbraw/zinc/26/48/12/506264812.db2.gz	MTQCDURNGWPLJI-UHFFFAOYSA-N	-1	0	362.455	2.879	50	0		FFAARM
Cc1oc2cc3oc(=O)c(CC(=O)N[C@H](C)C(=O)[O-])c(C)c3cc2c1C	ZINC000002151990	506273547	/nfs/dbraw/zinc/27/35/47/506273547.db2.gz	BQAOCSASHCTOLX-SNVBAGLBSA-N	-1	0	357.362	2.596	50	0	biogenic	FFAARM
CC[C@H](NC(=O)Cc1c(C)c2cc3c(C)coc3c(C)c2oc1=O)C(=O)[O-]	ZINC000002156395	506274480	/nfs/dbraw/zinc/27/44/80/506274480.db2.gz	PDXSMFZCPSLJRO-HNNXBMFYSA-N	-1	0	371.389	2.986	50	0	biogenic	FFAARM
CCOC(=O)N[C@]([N-]c1ccc(F)cc1F)(C(=O)OCC)C(F)(F)F	ZINC000002271078	506275807	/nfs/dbraw/zinc/27/58/07/506275807.db2.gz	OZZBGHXKHSPKMK-CYBMUJFWSA-N	-1	0	370.274	2.945	50	0		FFAARM
COc1ccc(Br)cc1S(=O)(=O)[N-]c1ccccc1O	ZINC000002857670	506298889	/nfs/dbraw/zinc/29/88/89/506298889.db2.gz	MDXFESLYXHRFDS-UHFFFAOYSA-N	-1	0	358.213	2.964	50	0		FFAARM
CCS(=O)(=O)c1ccc(O)c([N-]S(=O)(=O)c2ccc(C)cc2C)c1	ZINC000003350995	506323699	/nfs/dbraw/zinc/32/36/99/506323699.db2.gz	WPGHKMOTOCZDKT-UHFFFAOYSA-N	-1	0	369.464	2.603	50	0		FFAARM
CS(=O)(=O)c1ccc([N-]S(=O)(=O)c2ccc(Cl)cc2F)cc1	ZINC000003442349	506331426	/nfs/dbraw/zinc/33/14/26/506331426.db2.gz	PMNCITDPBANYSA-UHFFFAOYSA-N	-1	0	363.819	2.683	50	0		FFAARM
COc1ccc(/C=C(/NC(=O)c2ccccc2)C(=O)[O-])c(OC)c1OC	ZINC000004171426	506364641	/nfs/dbraw/zinc/36/46/41/506364641.db2.gz	TUXDNYVTMBJLME-SDNWHVSQSA-N	-1	0	357.362	2.568	50	0	biogenic	FFAARM
O=C([O-])[C@H]1CCCC[C@@H]1C(=O)N1CCN(C/C=C/c2ccccc2)CC1	ZINC000004179202	506364859	/nfs/dbraw/zinc/36/48/59/506364859.db2.gz	JQBIIYXKEFVGST-BDJRERGKSA-N	-1	0	356.466	2.735	50	0		FFAARM
O=C(CSC1=Nc2ccccc2S(=O)(=O)[N-]1)Nc1ccccc1F	ZINC000004306494	506369404	/nfs/dbraw/zinc/36/94/04/506369404.db2.gz	UMMJRHHBCFAOSB-UHFFFAOYSA-N	-1	0	365.411	2.668	50	0		FFAARM
O=C(CSC1=Nc2ccccc2S(=O)(=O)[N-]1)Nc1ccc(F)cc1	ZINC000004306498	506369712	/nfs/dbraw/zinc/36/97/12/506369712.db2.gz	RQJDGPBBHWDDRI-UHFFFAOYSA-N	-1	0	365.411	2.668	50	0		FFAARM
CCCOc1cccc(-c2nnc(CCC(=O)N[C@@H](C)CC)c(=O)[n-]2)c1	ZINC000034765219	506370002	/nfs/dbraw/zinc/37/00/02/506370002.db2.gz	BFPDITFUMPPAHY-ZDUSSCGKSA-N	-1	0	358.442	2.880	50	0		FFAARM
CCOc1ccc(N2C[C@H](C(=O)Nc3cccc(C(=O)[O-])c3)CC2=O)cc1	ZINC000004385200	506374302	/nfs/dbraw/zinc/37/43/02/506374302.db2.gz	MGKFCYOYPKXYGZ-CQSZACIVSA-N	-1	0	368.389	2.775	50	0		FFAARM
CC[C@@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C(=O)[O-])C(C)C	ZINC000004760122	506393775	/nfs/dbraw/zinc/39/37/75/506393775.db2.gz	XISNUVNLGJKNIK-KBMXLJTQSA-N	-1	0	364.442	2.553	50	0		FFAARM
CC(=O)c1[n-]n(-c2ccc(C)cc2)c2c(O)n(-c3ccc(C)cc3)c(=O)c1-2	ZINC000004862890	506401082	/nfs/dbraw/zinc/40/10/82/506401082.db2.gz	DFPRLVSTULKADY-PKOBYXMFSA-N	-1	0	361.401	2.627	50	0		FFAARM
CC(NCc1cccc(F)c1)=C1C(=O)[N-]C(=O)N(c2ccccc2F)C1=O	ZINC000005799054	506458192	/nfs/dbraw/zinc/45/81/92/506458192.db2.gz	QLNVPJIZSYUACV-LFIBNONCSA-N	-1	0	371.343	2.611	50	0		FFAARM
Cc1ccc(CSc2nc(N)c(NC(=O)c3ccco3)c(=O)[n-]2)cc1	ZINC000006309357	506476220	/nfs/dbraw/zinc/47/62/20/506476220.db2.gz	QYJKWGTWIMMROB-UHFFFAOYSA-N	-1	0	356.407	2.798	50	0		FFAARM
Cc1c(C)n(Cc2ccco2)c2ncnc(N3CCC(C(=O)[O-])CC3)c12	ZINC000040456197	506485805	/nfs/dbraw/zinc/48/58/05/506485805.db2.gz	YQCVZTCUPYHPDI-UHFFFAOYSA-N	-1	0	354.410	2.990	50	0		FFAARM
CCCNC(=O)c1ccccc1[N-]S(=O)(=O)c1ccc(F)c(F)c1	ZINC000006549614	506487961	/nfs/dbraw/zinc/48/79/61/506487961.db2.gz	DXMSBZQHHQIVAM-UHFFFAOYSA-N	-1	0	354.378	2.905	50	0		FFAARM
CC1=C(C)C[C@H](C(=O)N2CCN(CCc3ccccc3)CC2)[C@H](C(=O)[O-])C1	ZINC000006731456	506500239	/nfs/dbraw/zinc/50/02/39/506500239.db2.gz	YVSBYFWGAAAUSZ-VQTJNVASSA-N	-1	0	370.493	2.821	50	0		FFAARM
O=C([O-])[C@@H]1CC=CC[C@H]1C(=O)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000006726760	506501180	/nfs/dbraw/zinc/50/11/80/506501180.db2.gz	CMRMAQFDMFBWPC-IAGOWNOFSA-N	-1	0	362.857	2.651	50	0		FFAARM
CC1=C(C)C[C@@H](C(=O)N2CCN(Cc3cccc(F)c3)CC2)[C@H](C(=O)[O-])C1	ZINC000006741884	506502030	/nfs/dbraw/zinc/50/20/30/506502030.db2.gz	RHAWVMBDVZUSKT-RTBURBONSA-N	-1	0	374.456	2.917	50	0		FFAARM
O=C([O-])Cc1ccc(N[C@H]2CC(=O)N(c3ccc(Cl)cc3)C2=O)cc1	ZINC000006820100	506510066	/nfs/dbraw/zinc/51/00/66/506510066.db2.gz	FWIGVQKFOMJGLJ-HNNXBMFYSA-N	-1	0	358.781	2.711	50	0		FFAARM
COc1cc(C)c(NS(=O)(=O)c2cccc(C(=O)[O-])c2)cc1OC	ZINC000007050696	506528274	/nfs/dbraw/zinc/52/82/74/506528274.db2.gz	AWOCDAAGCOXFLJ-UHFFFAOYSA-N	-1	0	351.380	2.511	50	0		FFAARM
COc1ccc(NS(=O)(=O)c2ccc(F)c(C(=O)[O-])c2)cc1Cl	ZINC000007428342	506561390	/nfs/dbraw/zinc/56/13/90/506561390.db2.gz	IUZIUNHBJGIHJG-UHFFFAOYSA-N	-1	0	359.762	2.987	50	0		FFAARM
CC(=O)Nc1cc(C(=O)CSc2nncn2Cc2ccco2)ccc1[O-]	ZINC000009316065	506690101	/nfs/dbraw/zinc/69/01/01/506690101.db2.gz	URYYVXSJYARJLA-UHFFFAOYSA-N	-1	0	372.406	2.558	50	0		FFAARM
COc1ccc(Cl)cc1S(=O)(=O)[N-]c1ccc2c(c1)oc(=O)n2C	ZINC000009526617	506701528	/nfs/dbraw/zinc/70/15/28/506701528.db2.gz	OCLACPJEAHTIAW-UHFFFAOYSA-N	-1	0	368.798	2.594	50	0		FFAARM
CC[C@H](C)C1C(=O)N=C(SCC(=O)Nc2ccccc2OC)N=C1[O-]	ZINC000012436706	506863996	/nfs/dbraw/zinc/86/39/96/506863996.db2.gz	QVUNEIQCRABDCI-JTQLQIEISA-N	-1	0	363.439	2.728	50	0		FFAARM
COc1ccc(Cl)c(NS(=O)(=O)c2cc(C(=O)[O-])ccc2OC)c1	ZINC000058391784	507410656	/nfs/dbraw/zinc/41/06/56/507410656.db2.gz	INNSWAOSTTXTOF-UHFFFAOYSA-N	-1	0	371.798	2.856	50	0		FFAARM
O=C([O-])CCc1cc2n(n1)CCN(Cc1ccc([C@H]3CCCO3)s1)C2	ZINC000072168124	507768383	/nfs/dbraw/zinc/76/83/83/507768383.db2.gz	AIGQQUHMWLTCRA-MRXNPFEDSA-N	-1	0	361.467	2.829	50	0		FFAARM
CC(C)c1ccn(C2(C(=O)[O-])CCN(C(=O)CCc3ccco3)CC2)n1	ZINC000072429351	507789894	/nfs/dbraw/zinc/78/98/94/507789894.db2.gz	PVFJBPKEBMXHTL-UHFFFAOYSA-N	-1	0	359.426	2.635	50	0		FFAARM
CC(C)c1ccn(C2(C(=O)[O-])CCN(C(=O)c3ccc(F)cc3)CC2)n1	ZINC000072447403	507793468	/nfs/dbraw/zinc/79/34/68/507793468.db2.gz	OZGYQGMYXIXBMC-UHFFFAOYSA-N	-1	0	359.401	2.862	50	0		FFAARM
CCC[C@@H](NC(=O)c1cc(C)c2c(=O)[n-]c(=O)nc-2[nH]1)c1ccccc1	ZINC000072847615	507861816	/nfs/dbraw/zinc/86/18/16/507861816.db2.gz	PHDGVSUJYHCMBK-CYBMUJFWSA-N	-1	0	352.394	2.603	50	0		FFAARM
O=C(Nc1ccc(F)cc1)C1CCN(c2nc3[n-]cnc(=O)c3s2)CC1	ZINC000073666551	507944409	/nfs/dbraw/zinc/94/44/09/507944409.db2.gz	CNDWWERRBOIGEK-UHFFFAOYSA-N	-1	0	373.413	2.786	50	0		FFAARM
Cc1cc(N2CC[C@]3(C2)CCCN(C)C3=O)nc(-c2ccccc2[O-])n1	ZINC000091756231	508009006	/nfs/dbraw/zinc/00/90/06/508009006.db2.gz	CFBVQIOOXLPENT-FQEVSTJZSA-N	-1	0	352.438	2.606	50	0		FFAARM
CC(C)=CC[C@@]1(C(=O)[O-])CCCN(C(=O)CN(C)Cc2ccccn2)C1	ZINC000092028163	508034667	/nfs/dbraw/zinc/03/46/67/508034667.db2.gz	SFHXEDHLTLYBFH-FQEVSTJZSA-N	-1	0	359.470	2.563	50	0		FFAARM
CC(C)=CC[C@]1(C(=O)[O-])CCCN(C(=O)CN(C)Cc2ccncc2)C1	ZINC000092061633	508038568	/nfs/dbraw/zinc/03/85/68/508038568.db2.gz	PCUXWBUUWBDPCH-HXUWFJFHSA-N	-1	0	359.470	2.563	50	0		FFAARM
O=C([O-])c1ccc(Cn2cc(-c3cnc(-c4ccccn4)nc3)nn2)s1	ZINC000095380030	508180729	/nfs/dbraw/zinc/18/07/29/508180729.db2.gz	JQRZXCUDJCXHRN-UHFFFAOYSA-N	-1	0	364.390	2.605	50	0		FFAARM
CC(=O)N1CCCN([C@H](C(=O)[O-])c2cc(Cl)ccc2OC(C)C)CC1	ZINC000095378239	508180757	/nfs/dbraw/zinc/18/07/57/508180757.db2.gz	JACJEPFYCXYJKN-KRWDZBQOSA-N	-1	0	368.861	2.807	50	0		FFAARM
O=C([O-])[C@@]1(NC(=O)c2cccc(-n3cccn3)c2)CCCc2ccccc21	ZINC000095392074	508184329	/nfs/dbraw/zinc/18/43/29/508184329.db2.gz	IVIGTYJNDHULKI-OAQYLSRUSA-N	-1	0	361.401	2.919	50	0		FFAARM
Cc1nn(C)cc1C(=O)NC[C@@H](Cc1ccc2ccccc2c1)C(=O)[O-]	ZINC000095425463	508184982	/nfs/dbraw/zinc/18/49/82/508184982.db2.gz	JYZISULPVOFCTE-QGZVFWFLSA-N	-1	0	351.406	2.555	50	0		FFAARM
O=C([O-])CCCN(Cc1ccccc1)C(=O)CCNC(=O)c1cccs1	ZINC000095464512	508187344	/nfs/dbraw/zinc/18/73/44/508187344.db2.gz	DDIYTMJGQKMPJV-UHFFFAOYSA-N	-1	0	374.462	2.762	50	0		FFAARM
COC(=O)c1cccc([N-]S(=O)(=O)c2ccccc2-c2ccno2)c1	ZINC000095468044	508187982	/nfs/dbraw/zinc/18/79/82/508187982.db2.gz	SNOPVMQNAVDLKT-UHFFFAOYSA-N	-1	0	358.375	2.929	50	0		FFAARM
COC(=O)c1[n-]c(=NC(=O)CCc2c(C)noc2C)sc1C(C)C	ZINC000095473938	508188459	/nfs/dbraw/zinc/18/84/59/508188459.db2.gz	BQUGKHCYPAFZCB-UHFFFAOYSA-N	-1	0	351.428	3.229	50	0		FFAARM
CCOC(=O)c1csc(=NC(=O)c2cc3ccccc3n2CCOC)[n-]1	ZINC000095478445	508189289	/nfs/dbraw/zinc/18/92/89/508189289.db2.gz	LBXNHHQSBNAKKD-UHFFFAOYSA-N	-1	0	373.434	3.173	50	0		FFAARM
O=C(C[C@H](c1ccccc1)c1ccc(Cl)cc1)NCc1n[nH]c(=O)[n-]1	ZINC000095500424	508190551	/nfs/dbraw/zinc/19/05/51/508190551.db2.gz	KEHSGVMDTGBKPN-OAHLLOKOSA-N	-1	0	356.813	2.590	50	0		FFAARM
Cc1nc(N(C)C)ncc1C(=O)N1CCC[C@H]1c1ccc(C(=O)[O-])s1	ZINC000095505983	508192024	/nfs/dbraw/zinc/19/20/24/508192024.db2.gz	PTAYTZUIVNYCNU-LBPRGKRZSA-N	-1	0	360.439	2.588	50	0		FFAARM
O=S(=O)([N-]c1cnn([C@@H]2CCOC2)c1)c1cc(Cl)ccc1Cl	ZINC000096123288	508207806	/nfs/dbraw/zinc/20/78/06/508207806.db2.gz	RZILPKGMVCKSQU-LLVKDONJSA-N	-1	0	362.238	2.952	50	0		FFAARM
O=C([O-])c1c2c(I)c[nH]c2ncc1C(F)(F)F	ZINC000077011260	508273975	/nfs/dbraw/zinc/27/39/75/508273975.db2.gz	SKWWDEVCYKPVLQ-UHFFFAOYSA-N	-1	0	356.041	2.885	50	0		FFAARM
CC(C)n1cc(S(=O)(=O)[N-]c2ccc(C(=O)N3CCCC3)cc2)cn1	ZINC000157597549	508585714	/nfs/dbraw/zinc/58/57/14/508585714.db2.gz	JVOKZCPGZWGFAD-UHFFFAOYSA-N	-1	0	362.455	2.501	50	0		FFAARM
O=C([O-])[C@H]1CCCN(C(=O)Cc2csc(Cc3ccc(F)cc3)n2)C1	ZINC000128529965	508606786	/nfs/dbraw/zinc/60/67/86/508606786.db2.gz	UUEAHJYXOPXGJN-ZDUSSCGKSA-N	-1	0	362.426	2.739	50	0		FFAARM
O=C([O-])[C@@H]1CCCN(C(=O)c2ccccc2C(=O)c2ccc(F)cc2)C1	ZINC000136145378	508674562	/nfs/dbraw/zinc/67/45/62/508674562.db2.gz	ZPNBSORIHXXCEK-CQSZACIVSA-N	-1	0	355.365	2.994	50	0		FFAARM
O=c1cc(CSc2ncnc3c2cnn3Cc2ccccc2)occ1O	ZINC000126526284	509090000	/nfs/dbraw/zinc/09/00/00/509090000.db2.gz	GXZBBMLOEFEKFF-UHFFFAOYSA-N	-1	0	366.402	2.826	50	0		FFAARM
CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)N[C@H](C(=O)[O-])c1ccccc1	ZINC000236830554	509512439	/nfs/dbraw/zinc/51/24/39/509512439.db2.gz	UYKLCDQLPOXTSE-QUCCMNQESA-N	-1	0	364.401	2.893	50	0		FFAARM
CCc1noc(CC)c1CC(=O)N1CCC(C(=O)[O-])(c2ccccc2)CC1	ZINC000237074100	509565622	/nfs/dbraw/zinc/56/56/22/509565622.db2.gz	UUQSKAQKTCTYQW-UHFFFAOYSA-N	-1	0	370.449	2.987	50	0		FFAARM
COc1ccc([C@@H]2CCCCCN2C(=O)CN2CCC[C@@H]2C(=O)[O-])cc1	ZINC000237286134	509614027	/nfs/dbraw/zinc/61/40/27/509614027.db2.gz	SBAGCOZGVRZKAK-ZWKOTPCHSA-N	-1	0	360.454	2.688	50	0		FFAARM
CCCOc1ccc(C=Cc2nc(C)c(CC(=O)[O-])c(=O)[nH]2)cc1OC	ZINC000170618832	509682798	/nfs/dbraw/zinc/68/27/98/509682798.db2.gz	CHOARVVWIYCZJL-SOFGYWHQSA-N	-1	0	358.394	2.673	50	0		FFAARM
Cc1ccc(N2CC[C@H](C(=O)N3CCC[C@H](CCC(=O)[O-])C3)C2=O)cc1C	ZINC000237639273	509697830	/nfs/dbraw/zinc/69/78/30/509697830.db2.gz	XUDIVKFQVCOTQN-SJLPKXTDSA-N	-1	0	372.465	2.760	50	0		FFAARM
Cc1cc(C(=O)N2CCO[C@@H](C(=O)[O-])C2)c(C)n1[C@@H](C)c1ccccc1	ZINC000237638724	509697902	/nfs/dbraw/zinc/69/79/02/509697902.db2.gz	OPYIERXDAYTHAS-KBXCAEBGSA-N	-1	0	356.422	2.640	50	0		FFAARM
O=C(c1ccc2c(=O)[nH]c(=S)[n-]c2c1)N1CCS[C@H]2CCCC[C@@H]21	ZINC000170656846	509702610	/nfs/dbraw/zinc/70/26/10/509702610.db2.gz	PMTQRYJXNAMOOZ-KBPBESRZSA-N	-1	0	361.492	2.712	50	0		FFAARM
Cc1ccc(-c2cc(C(=O)N(CCC(=O)[O-])C3CCOCC3)on2)cc1	ZINC000237700887	509713493	/nfs/dbraw/zinc/71/34/93/509713493.db2.gz	LIJLCZYZMPSOTD-UHFFFAOYSA-N	-1	0	358.394	2.746	50	0		FFAARM
Cc1nn(C)c2sc(C(=O)N3Cc4ccccc4C[C@H]3C(=O)[O-])cc12	ZINC000237914666	509773620	/nfs/dbraw/zinc/77/36/20/509773620.db2.gz	YLNOXVDOWFCHRE-AWEZNQCLSA-N	-1	0	355.419	2.595	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)C[C@@H]1CCCO1)c1ccc(Br)cc1	ZINC000237935925	509778293	/nfs/dbraw/zinc/77/82/93/509778293.db2.gz	WZSWPTNEPDCJCV-STQMWFEESA-N	-1	0	356.216	2.650	50	0		FFAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)C2(c3ccc(F)cc3)CCOCC2)C1	ZINC000237955209	509785076	/nfs/dbraw/zinc/78/50/76/509785076.db2.gz	REZSKHYSWVEUOC-HNNXBMFYSA-N	-1	0	363.429	2.977	50	0		FFAARM
O=C([O-])COc1cccc(CNC(=O)[C@@H]2C[C@@H]2c2cc(F)ccc2F)c1	ZINC000238018741	509800215	/nfs/dbraw/zinc/80/02/15/509800215.db2.gz	HUGGUINYSXVEFB-GDBMZVCRSA-N	-1	0	361.344	2.848	50	0		FFAARM
O=C([O-])C1(c2ccccc2)CCN(C(=O)c2cc(F)cc3nc[nH]c32)CC1	ZINC000238069066	509814770	/nfs/dbraw/zinc/81/47/70/509814770.db2.gz	QMCJKVVXCFJKFZ-UHFFFAOYSA-N	-1	0	367.380	2.961	50	0		FFAARM
O=C([O-])[C@@H]1CCCN1C(=O)/C=C/c1ccc(OCc2ccccn2)cc1	ZINC000238077666	509816213	/nfs/dbraw/zinc/81/62/13/509816213.db2.gz	ULNRSNYCKIZETJ-MZEUMTGBSA-N	-1	0	352.390	2.749	50	0		FFAARM
O=C([O-])[C@H]1CCN(C(=O)c2cc(-c3ccco3)nn2-c2ccccc2)C1	ZINC000238137608	509825816	/nfs/dbraw/zinc/82/58/16/509825816.db2.gz	NRVAPUVVNVGZRQ-ZDUSSCGKSA-N	-1	0	351.362	2.679	50	0		FFAARM
Cc1ccc(CS(=O)(=O)[N-]C(=O)Cc2c[nH]c3ccccc23)c(C)c1	ZINC000252494043	509844163	/nfs/dbraw/zinc/84/41/63/509844163.db2.gz	NJLDETBSDOOLIB-UHFFFAOYSA-N	-1	0	356.447	2.973	50	0		FFAARM
CCN(CCS(=O)(=O)c1ccc(C)cc1)Cc1cccc(C(=O)[O-])c1	ZINC000244724043	509867478	/nfs/dbraw/zinc/86/74/78/509867478.db2.gz	MMLFINMFOZUHGU-UHFFFAOYSA-N	-1	0	361.463	2.989	50	0		FFAARM
Cc1cc(CCNS(=O)(=O)c2cc(C)c(Cl)cc2Cl)nn1C	ZINC000244947614	509878156	/nfs/dbraw/zinc/87/81/56/509878156.db2.gz	DTBMINSKIWDYET-UHFFFAOYSA-N	-1	0	362.282	2.865	50	0		FFAARM
Cc1ccc(C(=O)Nc2cccc(C=NNc3nnc(C)c(=O)[n-]3)c2)cc1	ZINC000254349351	509905385	/nfs/dbraw/zinc/90/53/85/509905385.db2.gz	LBGIHZZZAQUPNF-UHFFFAOYSA-N	-1	0	362.393	2.892	50	0		FFAARM
O=C(c1s[n-]c(=O)c1Cl)N1CCCN(c2ccccc2F)CC1	ZINC000376427642	512814399	/nfs/dbraw/zinc/81/43/99/512814399.db2.gz	NWYRJAYZFKXUSA-UHFFFAOYSA-N	-1	0	355.822	2.994	50	0		FFAARM
C[C@@H]1CC[C@H](CCC(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)[O-])O1	ZINC000299744773	534235576	/nfs/dbraw/zinc/23/55/76/534235576.db2.gz	PUHCAAQJQWXZCP-JDSLSITLSA-N	-1	0	362.401	2.767	50	0		FFAARM
C[C@H](NC(=O)C(C)(C)C(=O)[O-])c1ccc(NC(=O)c2ccncc2)cc1	ZINC000563200458	517730080	/nfs/dbraw/zinc/73/00/80/517730080.db2.gz	LXTIFWGXKXWKCS-LBPRGKRZSA-N	-1	0	355.394	2.622	50	0		FFAARM
O=C([O-])[C@H](CNC(=O)[C@H]1CC=CCC1)Oc1ccc(Br)cc1	ZINC000573252676	518577445	/nfs/dbraw/zinc/57/74/45/518577445.db2.gz	DKMOPKPPNQYRMS-FZMZJTMJSA-N	-1	0	368.227	2.754	50	0		FFAARM
CCOc1cc(C(=O)N[C@@H]2CCC[C@H](SC)C2)ccc1OCC(=O)[O-]	ZINC000268950097	520665844	/nfs/dbraw/zinc/66/58/44/520665844.db2.gz	PQILPCDQLDGXMG-KGLIPLIRSA-N	-1	0	367.467	2.953	50	0		FFAARM
O=C([O-])[C@@H]1COCCN1C(=O)/C=C\c1ccc(Cl)c(C(F)(F)F)c1	ZINC000606441311	521068973	/nfs/dbraw/zinc/06/89/73/521068973.db2.gz	RYTLKJHCMGTIKU-QQHVMHFCSA-N	-1	0	363.719	2.684	50	0		FFAARM
COc1cc(C2(C(=O)N3CCO[C@@H](CC(=O)[O-])C3)CCCC2)ccc1C	ZINC000269023300	522306116	/nfs/dbraw/zinc/30/61/16/522306116.db2.gz	JHFZZXYBAAECDI-INIZCTEOSA-N	-1	0	361.438	2.518	50	0		FFAARM
CC[C@@H](C)[C@H](NC(=O)CCc1nc(-c2ccc3cc[nH]c3c2)no1)C(=O)[O-]	ZINC000218187551	522372658	/nfs/dbraw/zinc/37/26/58/522372658.db2.gz	ULUVSAUIWNKOPX-DIFFPNOSSA-N	-1	0	370.409	2.766	50	0		FFAARM
O=C([O-])[C@H](NC(=O)c1cnn(C2CC2)c1)c1ccccc1Br	ZINC000630208264	522699114	/nfs/dbraw/zinc/69/91/14/522699114.db2.gz	RWTSGJQLWMEUCS-CYBMUJFWSA-N	-1	0	364.199	2.536	50	0		FFAARM
O=C([O-])COc1ccc(C(=O)N[C@H]2CCO[C@H](c3ccc(F)cc3)C2)cc1	ZINC000621540199	522916407	/nfs/dbraw/zinc/91/64/07/522916407.db2.gz	NTFRYHXWEHFBON-WMZOPIPTSA-N	-1	0	373.380	2.939	50	0		FFAARM
O=C([O-])[C@@H]1COCCN1C(=O)/C=C/c1ccc(Cl)c(C(F)(F)F)c1	ZINC000268989652	526287669	/nfs/dbraw/zinc/28/76/69/526287669.db2.gz	RYTLKJHCMGTIKU-KMOQFTEPSA-N	-1	0	363.719	2.684	50	0		FFAARM
COc1cccc(-c2nc3c([nH]2)CN(c2ccc(C(=O)[O-])cn2)CC3)c1	ZINC000096131473	537069087	/nfs/dbraw/zinc/06/90/87/537069087.db2.gz	OUFUGZQSVDWXEP-UHFFFAOYSA-N	-1	0	350.378	2.741	50	0		FFAARM
CCOc1cc2c(cc1OCC)CN(C(=O)N=c1ccc(OC)n[n-]1)CC2	ZINC000499498030	561552434	/nfs/dbraw/zinc/55/24/34/561552434.db2.gz	CQQGOYKZWYZPDJ-UHFFFAOYSA-N	-1	0	372.425	2.873	50	0		FFAARM
Cc1ncc(S(=O)(=O)[N-]c2ccc(OCC(F)(F)F)nc2)s1	ZINC000084290659	571081648	/nfs/dbraw/zinc/08/16/48/571081648.db2.gz	PEIKZRYWUSAZCJ-UHFFFAOYSA-N	-1	0	353.347	2.588	50	0		FFAARM
O=C([O-])[C@@H]1OCC[C@@H]1NC(=O)OCC1c2ccccc2-c2ccccc21	ZINC000685945003	571104646	/nfs/dbraw/zinc/10/46/46/571104646.db2.gz	NUCSYZBFEPVWSU-ZWKOTPCHSA-N	-1	0	353.374	2.767	50	0		FFAARM
O=C([O-])[C@@H]1CN(S(=O)(=O)c2ccc(Cl)nc2Cl)c2ccccc21	ZINC000170633438	571130685	/nfs/dbraw/zinc/13/06/85/571130685.db2.gz	RLFLNZDCJRDYSX-SECBINFHSA-N	-1	0	373.217	2.766	50	0		FFAARM
O=C([O-])[C@H]1C[C@@H]1C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1	ZINC000141588335	600102236	/nfs/dbraw/zinc/10/22/36/600102236.db2.gz	LLSBLJWIOJPIPV-OALUTQOASA-N	-1	0	364.445	2.641	50	0		FFAARM
O=C([O-])[C@H](NC(=O)c1cc(=O)[nH]c2ccccc21)c1ccccc1Cl	ZINC000095508713	728480355	/nfs/dbraw/zinc/48/03/55/728480355.db2.gz	YWSRQLLXVAOFQR-MRXNPFEDSA-N	-1	0	356.765	2.737	50	0		FFAARM
O=C([O-])c1cccnc1N1CCO[C@@H](c2cccc(OC(F)F)c2)C1	ZINC000647451746	730743459	/nfs/dbraw/zinc/74/34/59/730743459.db2.gz	GGQMUVDWNBAMEJ-CQSZACIVSA-N	-1	0	350.321	2.959	50	0		FFAARM
COc1nc(C)c([N-]S(=O)(=O)c2cccc(C(F)(F)F)c2)c(C)n1	ZINC000585278447	845949570	/nfs/dbraw/zinc/94/95/70/845949570.db2.gz	GXTMBPDZZMWTEU-UHFFFAOYSA-N	-1	0	361.345	2.922	50	0		FFAARM
C[C@H](C(=O)[O-])c1cccc(NC(=O)[C@H]2CCCN(C(=O)N3CCCC3)C2)c1	ZINC000263178035	980535947	/nfs/dbraw/zinc/53/59/47/980535947.db2.gz	GYHNTFUXXOKUTB-HOCLYGCPSA-N	-1	0	373.453	2.741	50	0		FFAARM
O=C([O-])[C@@]1(CC2CC2)CCCN(c2ccc(C(=O)N3CCCC3)cn2)C1	ZINC000219610642	1008298080	/nfs/dbraw/zinc/29/80/80/1008298080.db2.gz	ARWPKHURDUFHNN-HXUWFJFHSA-N	-1	0	357.454	2.789	50	0		FFAARM
O=C([O-])[C@]1(Cc2ccc(F)cc2)CCCN(C(=O)c2ccc(CO)cc2)C1	ZINC000071551675	1019661950	/nfs/dbraw/zinc/66/19/50/1019661950.db2.gz	LMPBHEAOADELDR-NRFANRHFSA-N	-1	0	371.408	2.868	50	0		FFAARM
O=C([O-])[C@@H]1CCN(S(=O)(=O)c2ccc3c(c2)CCCO3)c2ccccc21	ZINC000656645722	1025434869	/nfs/dbraw/zinc/43/48/69/1025434869.db2.gz	QZINCDGYSKBRIE-MRXNPFEDSA-N	-1	0	373.430	2.779	50	0		FFAARM
O=C([O-])c1coc(CN2CCCN(c3nc4ccccc4s3)CC2)n1	ZINC001529172027	1062199399	/nfs/dbraw/zinc/19/93/99/1062199399.db2.gz	GDFXCPWTJAXAIB-UHFFFAOYSA-N	-1	0	358.423	2.695	50	0		FFAARM
Cc1noc([N-]S(=O)(=O)c2ccc(NC(=O)c3ccncc3)cc2)c1C	ZINC000000790651	219321598	/nfs/dbraw/zinc/32/15/98/219321598.db2.gz	LCBCQOLFFZEVCA-UHFFFAOYSA-N	-1	0	372.406	2.740	50	0		FFAARM
CCc1ccc(OCC(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)[O-])cc1	ZINC000000790603	219321962	/nfs/dbraw/zinc/32/19/62/219321962.db2.gz	JVNJFKIJZXDEBC-LJQANCHMSA-N	-1	0	366.417	2.921	50	0	biogenic	FFAARM
O=C([O-])CCC(=O)N1N=C(c2ccccc2)C[C@H]1c1ccc2c(c1)OCO2	ZINC000000798804	219322571	/nfs/dbraw/zinc/32/25/71/219322571.db2.gz	VRLZWWXKIBUPQC-INIZCTEOSA-N	-1	0	366.373	2.958	50	0		FFAARM
O=C1N[C@H](c2ccccc2)C(=C([O-])c2cccs2)[C@](O)(C(F)(F)F)N1	ZINC000001014138	219354084	/nfs/dbraw/zinc/35/40/84/219354084.db2.gz	OXRRYKXYECAQSB-ZOWXZIJZSA-N	-1	0	370.352	2.852	50	0		FFAARM
COc1ccccc1-n1c(=O)cc([O-])nc1SCC(=O)c1ccccc1	ZINC000001230478	219391671	/nfs/dbraw/zinc/39/16/71/219391671.db2.gz	WWXHYUIOWGLYEL-UHFFFAOYSA-N	-1	0	368.414	2.922	50	0		FFAARM
Cc1oc2c(cc3c(C)c(CC(=O)N[C@@H](C)C(=O)[O-])c(=O)oc3c2C)c1C	ZINC000002154321	219429520	/nfs/dbraw/zinc/42/95/20/219429520.db2.gz	CSXJKVDDBBBNAF-NSHDSACASA-N	-1	0	371.389	2.905	50	0	biogenic	FFAARM
CCCCn1c2ccccc2c([O-])c(C(=O)NCc2ccccn2)c1=O	ZINC000002250667	219433993	/nfs/dbraw/zinc/43/39/93/219433993.db2.gz	QAYKSVFIYWOPOZ-UHFFFAOYSA-N	-1	0	351.406	2.832	50	0		FFAARM
CCO[C@@H](C)c1nc(CC(=O)N2Cc3ccccc3C[C@H]2C(=O)[O-])cs1	ZINC000237037359	222903840	/nfs/dbraw/zinc/90/38/40/222903840.db2.gz	KOMLTUODQSJEAM-LRDDRELGSA-N	-1	0	374.462	2.821	50	0		FFAARM
COc1ccc([C@H](CC(=O)[O-])NC(=O)COc2ccccc2C)cc1OC	ZINC000003626930	219522932	/nfs/dbraw/zinc/52/29/32/219522932.db2.gz	GQHRPCWAXLBKPL-HNNXBMFYSA-N	-1	0	373.405	2.723	50	0		FFAARM
CC(=O)Oc1ccc(NC(=O)COc2c(C)cccc2C)c(C(=O)[O-])c1	ZINC000004825780	219610065	/nfs/dbraw/zinc/61/00/65/219610065.db2.gz	FMWWZVVCOIVMIY-UHFFFAOYSA-N	-1	0	357.362	2.944	50	0		FFAARM
O=C([O-])C[C@]1(C(=O)NCc2ccccc2)CC(c2ccc(Cl)cc2)=NO1	ZINC000006755220	219766938	/nfs/dbraw/zinc/76/69/38/219766938.db2.gz	LADLBDPTABWOSD-IBGZPJMESA-N	-1	0	372.808	2.994	50	0		FFAARM
C[C@H](NC(=O)CCc1ccc(C(=O)[O-])cc1)c1ccc2c(c1)NC(=O)CO2	ZINC000299748368	223079801	/nfs/dbraw/zinc/07/98/01/223079801.db2.gz	HDBGQBOVQPOKAN-LBPRGKRZSA-N	-1	0	368.389	2.526	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)c2cc3ccccc3n2Cc2ccccc2)CCO1	ZINC000299745015	223079820	/nfs/dbraw/zinc/07/98/20/223079820.db2.gz	QSELGQZXFKWNIA-IBGZPJMESA-N	-1	0	364.401	2.615	50	0		FFAARM
O=C([O-])[C@@]12CN(C(=O)C3CCOCC3)C[C@@H]1C[C@@H](c1ccccc1)CC2	ZINC000299780213	223093919	/nfs/dbraw/zinc/09/39/19/223093919.db2.gz	IUXDVNXBACIFBV-WFXMLNOXSA-N	-1	0	357.450	2.910	50	0		FFAARM
O=C([N-]N1C(=O)NC2(CCCCC2)C1=O)c1ccc(-c2ccc(F)cc2)o1	ZINC000012568872	220008345	/nfs/dbraw/zinc/00/83/45/220008345.db2.gz	LZDRJBKVUOLOEZ-UHFFFAOYSA-N	-1	0	371.368	2.985	50	0		FFAARM
O=C([O-])[C@H]1CC=CC[C@H]1C(=O)Nc1cccc(I)c1	ZINC000013012565	220053591	/nfs/dbraw/zinc/05/35/91/220053591.db2.gz	HUTIEOAQYBWKQB-NEPJUHHUSA-N	-1	0	371.174	2.897	50	0		FFAARM
O=C([O-])[C@H](Cc1c[nH]c2ccccc12)NC(=O)NCc1ccc(F)cc1	ZINC000013235495	220062415	/nfs/dbraw/zinc/06/24/15/220062415.db2.gz	KNYCJRTZJKCCNX-KRWDZBQOSA-N	-1	0	355.369	2.802	50	0		FFAARM
C[C@H](NC(=O)CC1(C(=O)[O-])CCCCC1)c1ccc(-n2cncn2)cc1	ZINC000013468268	220068541	/nfs/dbraw/zinc/06/85/41/220068541.db2.gz	RPBHVMHYZOFDTG-AWEZNQCLSA-N	-1	0	356.426	2.870	50	0		FFAARM
O=C([O-])[C@H](O)[C@H](Cc1ccccc1)NC(=O)c1cc2cc(Cl)ccc2[nH]1	ZINC000013780535	220094972	/nfs/dbraw/zinc/09/49/72/220094972.db2.gz	FFEPTJHAPRPKOB-DOTOQJQBSA-N	-1	0	372.808	2.608	50	0		FFAARM
O=C([O-])[C@]1(NC(=O)OCC2c3ccccc3-c3ccccc32)CC[C@@H](O)C1	ZINC000015446456	220154861	/nfs/dbraw/zinc/15/48/61/220154861.db2.gz	FPTJRPYTKCYJLR-ASSNKEHSSA-N	-1	0	367.401	2.893	50	0		FFAARM
COc1ccc(Br)cc1S(=O)(=O)[N-]c1cccc(O)c1	ZINC000016625906	220189255	/nfs/dbraw/zinc/18/92/55/220189255.db2.gz	IYXMUEOGJVDAIZ-UHFFFAOYSA-N	-1	0	358.213	2.964	50	0		FFAARM
CCc1c([O-])nc(SCC(=O)N2CCCCC2)n(-c2ccccc2)c1=O	ZINC000016513605	220186884	/nfs/dbraw/zinc/18/68/84/220186884.db2.gz	VMYAPDKHNSGIIQ-UHFFFAOYSA-N	-1	0	373.478	2.605	50	0		FFAARM
CCOC(=O)Cc1cc(=O)n2[n-]c(C)c(-c3ccc(OC)c(OC)c3)c2n1	ZINC000017045879	220199879	/nfs/dbraw/zinc/19/98/79/220199879.db2.gz	QHSYENZMLWGACX-UHFFFAOYSA-N	-1	0	371.393	2.533	50	0		FFAARM
Cc1sc(NC(=O)[C@@H]2CC(C)=C(C)C[C@@H]2C(=O)[O-])c(C(N)=O)c1C	ZINC000017072718	220201903	/nfs/dbraw/zinc/20/19/03/220201903.db2.gz	CXJGDABQUUDLPG-NEPJUHHUSA-N	-1	0	350.440	2.850	50	0		FFAARM
Cc1cc(=O)n2nc(NC(=O)C(c3ccccc3)c3ccccc3)[n-]c2n1	ZINC000018219979	220230357	/nfs/dbraw/zinc/23/03/57/220230357.db2.gz	GXLMJNFXPJVDBF-UHFFFAOYSA-N	-1	0	359.389	2.909	50	0		FFAARM
NC1=NC(=O)C(CCC[C@@H](C(=O)[O-])c2ccc(Cl)c(Cl)c2)C(=O)N1	ZINC000019862502	220301211	/nfs/dbraw/zinc/30/12/11/220301211.db2.gz	TWEKHKOAMDTORE-MRVPVSSYSA-N	-1	0	372.208	2.968	50	0		FFAARM
Cn1cc(C(=O)[O-])c(C(=O)Nc2ccc(Br)c(Cl)c2)n1	ZINC000020614923	220336677	/nfs/dbraw/zinc/33/66/77/220336677.db2.gz	PYZDSGVBRVPNQW-UHFFFAOYSA-N	-1	0	358.579	2.787	50	0		FFAARM
CCc1ccccc1[N-]S(=O)(=O)c1ccc(-c2ccc(=O)[nH]n2)s1	ZINC000021531481	220359033	/nfs/dbraw/zinc/35/90/33/220359033.db2.gz	LRIWDIASCRDVCO-UHFFFAOYSA-N	-1	0	361.448	2.862	50	0		FFAARM
CC(=O)c1cn(CC(=O)N[C@@H](C(=O)[O-])c2ccccc2)c2ccccc12	ZINC000036354173	220812847	/nfs/dbraw/zinc/81/28/47/220812847.db2.gz	VQFQARALCWYIER-LJQANCHMSA-N	-1	0	350.374	2.786	50	0		FFAARM
COc1c(Cl)cc(C(=O)N[C@@]2(C(=O)[O-])CCSC2)cc1Cl	ZINC000043509901	220948798	/nfs/dbraw/zinc/94/87/98/220948798.db2.gz	APYIOHQVRCABIO-ZDUSSCGKSA-N	-1	0	350.223	2.692	50	0		FFAARM
COc1ccc(CC(=O)[O-])cc1S(=O)(=O)Nc1cccc(Cl)c1F	ZINC000048331825	221008007	/nfs/dbraw/zinc/00/80/07/221008007.db2.gz	AXQBNHUNRDQJKT-UHFFFAOYSA-N	-1	0	373.789	2.916	50	0		FFAARM
COc1ccccc1N(C)S(=O)(=O)c1cc(C(=O)[O-])cc2c1CCC2	ZINC000055650966	221072178	/nfs/dbraw/zinc/07/21/78/221072178.db2.gz	OWSZQVUBFFKCLK-UHFFFAOYSA-N	-1	0	361.419	2.707	50	0		FFAARM
Cc1cnc2c(cccc2S(=O)(=O)[N-]c2cc(C(N)=O)cc(F)c2C)c1	ZINC000055614923	221072507	/nfs/dbraw/zinc/07/25/07/221072507.db2.gz	AIYCWTRQQPEISE-UHFFFAOYSA-N	-1	0	373.409	2.890	50	0		FFAARM
Cc1ccc(C)c(NS(=O)(=O)c2cc3c(c(C(=O)[O-])c2)OCCO3)c1	ZINC000057115431	221083872	/nfs/dbraw/zinc/08/38/72/221083872.db2.gz	UAXQEEZSBOTPKY-UHFFFAOYSA-N	-1	0	363.391	2.574	50	0		FFAARM
CC(=O)NCCc1ccc(S(=O)(=O)[N-]c2ccc(C)c(F)c2)s1	ZINC000058169156	221102807	/nfs/dbraw/zinc/10/28/07/221102807.db2.gz	JECGRJFPDJZPQJ-UHFFFAOYSA-N	-1	0	356.444	2.675	50	0		FFAARM
Cc1nc(-c2ccccn2)[nH]c(=O)c1CCC(=O)NCc1ccccc1F	ZINC000058244840	221110649	/nfs/dbraw/zinc/11/06/49/221110649.db2.gz	IYNYXOOUOYMGEF-UHFFFAOYSA-N	-1	0	366.396	2.528	50	0		FFAARM
COc1ccc(Cl)c(NS(=O)(=O)c2ccc(OC)c(C(=O)[O-])c2)c1	ZINC000063345137	221142233	/nfs/dbraw/zinc/14/22/33/221142233.db2.gz	HSYKTULJYODEMK-UHFFFAOYSA-N	-1	0	371.798	2.856	50	0		FFAARM
Cc1ccc(C)c([N-]S(=O)(=O)c2cc3[nH]c(=O)[nH]c3cc2Cl)c1	ZINC000064976587	221159984	/nfs/dbraw/zinc/15/99/84/221159984.db2.gz	XDZBKYYTWJQQHG-UHFFFAOYSA-N	-1	0	351.815	2.927	50	0		FFAARM
Cc1cc(C)cc([N-]S(=O)(=O)c2cc(-c3ccc(=O)[nH]n3)cs2)c1	ZINC000065119356	221171078	/nfs/dbraw/zinc/17/10/78/221171078.db2.gz	JGIMSCNLEFIVTP-UHFFFAOYSA-N	-1	0	361.448	2.916	50	0		FFAARM
O=C(NCc1ccc(C(F)(F)F)cc1)c1c(=O)[nH]c2ncccc2c1[O-]	ZINC000065249542	221188218	/nfs/dbraw/zinc/18/82/18/221188218.db2.gz	VPHWNTZHHDKFDI-UHFFFAOYSA-N	-1	0	363.295	2.578	50	0		FFAARM
Cc1cccc([N-]S(=O)(=O)c2cc3n(c2)CCN(C(C)C)C3=O)c1C	ZINC000065254761	221189057	/nfs/dbraw/zinc/18/90/57/221189057.db2.gz	RZYJGGOQZQIARA-UHFFFAOYSA-N	-1	0	361.467	2.770	50	0		FFAARM
Cc1n[nH]c(C)c1[C@@H](NC(=O)c1csc(-c2cccs2)n1)C(=O)[O-]	ZINC000067490249	221257566	/nfs/dbraw/zinc/25/75/66/221257566.db2.gz	YNZOJERMBWRBMA-GFCCVEGCSA-N	-1	0	362.436	2.767	50	0		FFAARM
O=C([O-])c1nnn(Cc2ccc(Br)cc2)c1-c1cccnc1	ZINC000070457000	221332533	/nfs/dbraw/zinc/33/25/33/221332533.db2.gz	INXHLUMLVOPCBT-UHFFFAOYSA-N	-1	0	359.183	2.849	50	0		FFAARM
COc1ccc(C(=O)NC2CCCC2)cc1NC(=O)[C@@H]1[C@H](C(=O)[O-])C1(C)C	ZINC000071287533	221339972	/nfs/dbraw/zinc/33/99/72/221339972.db2.gz	AWUJXOXSTGRUNI-JKSUJKDBSA-N	-1	0	374.437	2.663	50	0		FFAARM
COc1ccccc1Nc1nn2c(nc3cc(C(=O)[O-])ccc3c2=O)s1	ZINC000071289363	221340717	/nfs/dbraw/zinc/34/07/17/221340717.db2.gz	FVUZMZKSZCULOJ-UHFFFAOYSA-N	-1	0	368.374	2.755	50	0		FFAARM
Cc1ccc(OC2(C(=O)[O-])CCN(C(=O)c3ccccc3F)CC2)cn1	ZINC000072418710	221506351	/nfs/dbraw/zinc/50/63/51/221506351.db2.gz	UBZRLXISKXWWOL-UHFFFAOYSA-N	-1	0	358.369	2.668	50	0		FFAARM
O=C([O-])C1(Oc2ccc(Cl)cc2)CCN(c2ncnc3nc[nH]c32)CC1	ZINC000077340258	132180991	/nfs/dbraw/zinc/18/09/91/132180991.db2.gz	YDGSYUZPXPVJQS-UHFFFAOYSA-N	-1	0	373.800	2.509	50	0		FFAARM
Cc1nccc(N2CCC(Oc3ccc4ncccc4c3)(C(=O)[O-])CC2)n1	ZINC000077353860	132182207	/nfs/dbraw/zinc/18/22/07/132182207.db2.gz	UQPZOGVGCLGHOF-UHFFFAOYSA-N	-1	0	364.405	2.836	50	0		FFAARM
COc1ccc(N2CCN(Cc3ccc(CC(=O)[O-])cc3)[C@H](C)C2=O)cc1	ZINC000077407305	132184184	/nfs/dbraw/zinc/18/41/84/132184184.db2.gz	RFKCYCLDFSFORK-OAHLLOKOSA-N	-1	0	368.433	2.560	50	0		FFAARM
O=C([O-])c1cccc(N2CCC(c3nccn3Cc3ccccn3)CC2)n1	ZINC000092064943	132206235	/nfs/dbraw/zinc/20/62/35/132206235.db2.gz	GXTRKMYJXZWSKB-UHFFFAOYSA-N	-1	0	363.421	2.804	50	0		FFAARM
CC(C)c1ccc(S(=O)(=O)N2C[C@H](C(=O)[O-])Oc3ccccc32)cc1	ZINC000014114471	132306767	/nfs/dbraw/zinc/30/67/67/132306767.db2.gz	SKCZPGVHAOQPIB-QGZVFWFLSA-N	-1	0	361.419	2.851	50	0		FFAARM
Cc1cccc(N2CCN(CC(=O)Nc3ccc(C(=O)[O-])cc3)CC2)c1C	ZINC000003245556	132385002	/nfs/dbraw/zinc/38/50/02/132385002.db2.gz	INUQAUSLAKCZKA-UHFFFAOYSA-N	-1	0	367.449	2.762	50	0		FFAARM
CN(C)c1cc(N2CCC[C@](Cc3ccccc3F)(C(=O)[O-])C2)ncn1	ZINC000071523821	136139526	/nfs/dbraw/zinc/13/95/26/136139526.db2.gz	XAYSAMJTZPWKES-LJQANCHMSA-N	-1	0	358.417	2.596	50	0		FFAARM
O=C([O-])C1(n2ccc(-c3ccco3)n2)CCN(c2ncccc2F)CC1	ZINC000072477146	136149404	/nfs/dbraw/zinc/14/94/04/136149404.db2.gz	IJNOBDJRUCCSDU-UHFFFAOYSA-N	-1	0	356.357	2.758	50	0		FFAARM
O=C([O-])c1ccc(C[C@@H]2CCN(C(=O)Cc3ccc(CO)cc3)C2)cc1	ZINC000072478694	221551923	/nfs/dbraw/zinc/55/19/23/221551923.db2.gz	AFNAZTNNDWMWNK-SFHVURJKSA-N	-1	0	353.418	2.511	50	0		FFAARM
COc1cccc(OC)c1C(=O)N1C[C@@H](c2ccc(F)cc2)[C@H](C(=O)[O-])C1	ZINC000092108028	221841298	/nfs/dbraw/zinc/84/12/98/221841298.db2.gz	WJHALWURVAOJKN-LSDHHAIUSA-N	-1	0	373.380	2.783	50	0		FFAARM
CCOc1ccccc1[C@@H](CC(=O)Nc1ccc(C(=O)[O-])cc1)NC(C)=O	ZINC000095424260	221902196	/nfs/dbraw/zinc/90/21/96/221902196.db2.gz	BZJPGNBPJPIVER-QGZVFWFLSA-N	-1	0	370.405	2.990	50	0		FFAARM
CN(C)c1ncc([N-]S(=O)(=O)c2ccc3ccccc3c2)c(N(C)C)n1	ZINC000096098782	222022787	/nfs/dbraw/zinc/02/27/87/222022787.db2.gz	GSNIWYRRLVOAAT-UHFFFAOYSA-N	-1	0	371.466	2.563	50	0		FFAARM
Cc1ccc([N-]S(=O)(=O)c2n[nH]cc2C(=O)Nc2cccc(F)c2)cc1	ZINC000096361084	222117400	/nfs/dbraw/zinc/11/74/00/222117400.db2.gz	XNAAMZQRDJGBMS-UHFFFAOYSA-N	-1	0	374.397	2.910	50	0		FFAARM
Cc1cccc(S(=O)(=O)NCCC[C@H](C)C(=O)[O-])c1Br	ZINC000097165140	222165633	/nfs/dbraw/zinc/16/56/33/222165633.db2.gz	MDABDFHIZOETLK-JTQLQIEISA-N	-1	0	364.261	2.537	50	0		FFAARM
CCOc1ccccc1NC(=O)c1ccc2c(c1)[n-]c(=S)n(C)c2=O	ZINC000102335349	222294221	/nfs/dbraw/zinc/29/42/21/222294221.db2.gz	VIPMSXDRUZUPAL-UHFFFAOYSA-N	-1	0	355.419	2.873	50	0		FFAARM
Cc1ccc(-n2[nH][n-]c3c(=O)n(-c4ccc(F)c(F)c4)c(=O)c2=3)cc1F	ZINC000102819271	222309043	/nfs/dbraw/zinc/30/90/43/222309043.db2.gz	QYTDNLBQOBEJTR-GJZGRUSLSA-N	-1	0	360.295	2.910	50	0		FFAARM
COc1cccc(-n2c(=O)c3[n-][nH]n(-c4ccc(C)c(C)c4)c=3c2=O)c1	ZINC000102819709	222309066	/nfs/dbraw/zinc/30/90/66/222309066.db2.gz	BJJHOKUVWRUEGK-DLBZAZTESA-N	-1	0	350.378	2.810	50	0		FFAARM
C[C@@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)N1CCCC[C@H]1C(=O)[O-]	ZINC000136520362	222544708	/nfs/dbraw/zinc/54/47/08/222544708.db2.gz	MHSZUFBELCOXRZ-SKDRFNHKSA-N	-1	0	373.236	2.577	50	0		FFAARM
Cc1ccc(C)c(S(=O)(=O)[N-]c2ccccc2C(=O)N2CCCO2)c1	ZINC000155814029	222552875	/nfs/dbraw/zinc/55/28/75/222552875.db2.gz	MZMCDHSAOLKJKA-UHFFFAOYSA-N	-1	0	360.435	2.882	50	0		FFAARM
COC(=O)c1sccc1S(=O)(=O)[N-]c1cc(Cl)ccc1OC	ZINC000009645753	263362488	/nfs/dbraw/zinc/36/24/88/263362488.db2.gz	ZFIFZBTZQJBICF-UHFFFAOYSA-N	-1	0	361.828	2.998	50	0		FFAARM
CCN(CC1CCOCC1)C(=O)c1cccc(-c2cncc(C(=O)[O-])n2)c1	ZINC000426526008	263620049	/nfs/dbraw/zinc/62/00/49/263620049.db2.gz	HTHOOGBPXUYTJR-UHFFFAOYSA-N	-1	0	369.421	2.731	50	0		FFAARM
O=C([O-])[C@@H]1CCCN(C(=O)c2cc3ccc(Br)cc3[nH]2)C1	ZINC000261649821	510013107	/nfs/dbraw/zinc/01/31/07/510013107.db2.gz	FHRAHYXPHOLHNI-SNVBAGLBSA-N	-1	0	351.200	2.867	50	0		FFAARM
O=C([O-])C1(C(=O)N[C@H]2C[C@H](c3ccc(F)c(Br)c3)C2)CC1	ZINC000263568863	510752211	/nfs/dbraw/zinc/75/22/11/510752211.db2.gz	HESWZMQNFUFGME-MGCOHNPYSA-N	-1	0	356.191	2.815	50	0		FFAARM
COc1c(Br)c(C(=O)[O-])c(Br)c(OC)c1OC	ZINC000001676019	506267183	/nfs/dbraw/zinc/26/71/83/506267183.db2.gz	KFEXAABXBSOKEH-UHFFFAOYSA-N	-1	0	369.993	2.936	50	0		FFAARM
Cc1coc2c1cc1c(C)c(CCC(=O)N(C)CC(=O)[O-])c(=O)oc1c2C	ZINC000002104749	506271914	/nfs/dbraw/zinc/27/19/14/506271914.db2.gz	YVWOPXHSROFORA-UHFFFAOYSA-N	-1	0	371.389	2.940	50	0	biogenic	FFAARM
O=C([O-])[C@H](Cc1ccc(Cl)cc1)NS(=O)(=O)c1ccccc1Cl	ZINC000002243971	506273512	/nfs/dbraw/zinc/27/35/12/506273512.db2.gz	KKPGVOCNDFEBEZ-ZDUSSCGKSA-N	-1	0	374.245	2.968	50	0		FFAARM
C[C@](CC(=O)Nc1ccc(C(=O)NC2CC2)cc1)(C(=O)[O-])c1ccccc1	ZINC000032771951	506293400	/nfs/dbraw/zinc/29/34/00/506293400.db2.gz	CCTIGNAMXBSTPM-OAQYLSRUSA-N	-1	0	366.417	2.950	50	0		FFAARM
COc1ccccc1[N-]S(=O)(=O)c1cccc(C(=O)N2CCCC2)c1	ZINC000003316423	506319946	/nfs/dbraw/zinc/31/99/46/506319946.db2.gz	YPGXZWYXGOJNSV-UHFFFAOYSA-N	-1	0	360.435	2.732	50	0		FFAARM
O=C([O-])/C=C/C(=O)Nc1ccccc1N1CCN(c2ccccc2)CC1	ZINC000033330723	506356728	/nfs/dbraw/zinc/35/67/28/506356728.db2.gz	MBACQRCTXOZQEI-ZHACJKMWSA-N	-1	0	351.406	2.593	50	0		FFAARM
Cc1ccc(N2C(=O)[C@@H]3C(C(=O)c4ccc(Cl)cc4)=NOC3=C2[O-])cc1	ZINC000004173783	506363777	/nfs/dbraw/zinc/36/37/77/506363777.db2.gz	LJWXLMOQRWMLFW-RHSMWYFYSA-N	-1	0	368.776	2.776	50	0		FFAARM
Cc1ccccc1NC(=O)CSC1=Nc2ccccc2S(=O)(=O)[N-]1	ZINC000004306481	506370183	/nfs/dbraw/zinc/37/01/83/506370183.db2.gz	UIVMQOOCMHWQLG-UHFFFAOYSA-N	-1	0	361.448	2.837	50	0		FFAARM
COc1ccc(CNc2ccc([N+](=O)[O-])cc2OC)c(C(=O)[O-])c1OC	ZINC000004427829	506376613	/nfs/dbraw/zinc/37/66/13/506376613.db2.gz	DXVRRYZPHAZJQR-UHFFFAOYSA-N	-1	0	362.338	2.931	50	0		FFAARM
COc1cc([C@@H]2N[C@H](C(=O)[O-])CS2)ccc1OC(=O)c1ccccc1	ZINC000004553708	506381808	/nfs/dbraw/zinc/38/18/08/506381808.db2.gz	NRPIROMOVISGKT-XJKSGUPXSA-N	-1	0	359.403	2.703	50	0		FFAARM
CCN(CC)c1ncc(NS(=O)(=O)c2ccc(C)cc2)cc1C(=O)[O-]	ZINC000035397638	506381907	/nfs/dbraw/zinc/38/19/07/506381907.db2.gz	QTFIVQHYJOOHCT-UHFFFAOYSA-N	-1	0	363.439	2.735	50	0		FFAARM
CCOc1ccc([C@H](CC(=O)[O-])NC(=O)Cc2ccccc2)cc1OC	ZINC000004580575	506383542	/nfs/dbraw/zinc/38/35/42/506383542.db2.gz	RQGVWRJQTSUSJZ-INIZCTEOSA-N	-1	0	357.406	2.969	50	0		FFAARM
COc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc2c(c1)oc(=O)n2C	ZINC000004820770	506396695	/nfs/dbraw/zinc/39/66/95/506396695.db2.gz	RNDJVHWAJPQTHF-UHFFFAOYSA-N	-1	0	368.798	2.594	50	0		FFAARM
O=C([O-])[C@H](CSC(=O)c1ccccc1)NC(=O)OCc1ccccc1	ZINC000004831214	506397634	/nfs/dbraw/zinc/39/76/34/506397634.db2.gz	SGXFVAMPPOGQON-HNNXBMFYSA-N	-1	0	359.403	2.940	50	0		FFAARM
O=C1CCCN1c1cccc([N-]S(=O)(=O)c2cc(F)ccc2F)c1	ZINC000005329470	506435425	/nfs/dbraw/zinc/43/54/25/506435425.db2.gz	FAAKEYCRGJRGDX-UHFFFAOYSA-N	-1	0	352.362	2.892	50	0		FFAARM
CCOC(=O)c1c(C)[nH]c(C)c1S(=O)(=O)[N-]c1ccccc1OC	ZINC000006887511	506513124	/nfs/dbraw/zinc/51/31/24/506513124.db2.gz	LULZULPAKAHSKC-UHFFFAOYSA-N	-1	0	352.412	2.618	50	0		FFAARM
CCOC(=O)c1ccccc1[N-]S(=O)(=O)c1ccsc1C(=O)OC	ZINC000009338367	506691694	/nfs/dbraw/zinc/69/16/94/506691694.db2.gz	MQELMEOXQJXDGI-UHFFFAOYSA-N	-1	0	369.420	2.512	50	0		FFAARM
CC[C@H](C)c1csc(N(C)C(=O)Cc2c(C)nc3cc(=O)[n-]n3c2C)n1	ZINC000067027319	506728695	/nfs/dbraw/zinc/72/86/95/506728695.db2.gz	OASBIYAZEVEAKY-JTQLQIEISA-N	-1	0	373.482	2.815	50	0		FFAARM
CC[C@@H](C)c1csc(N(C)C(=O)Cc2c(C)nc3cc(=O)[n-]n3c2C)n1	ZINC000067027318	506729733	/nfs/dbraw/zinc/72/97/33/506729733.db2.gz	OASBIYAZEVEAKY-SNVBAGLBSA-N	-1	0	373.482	2.815	50	0		FFAARM
Cc1cc(C(=O)[O-])c2c(C3CC3)nn(CC(=O)NC3CCCCC3)c2n1	ZINC000012396433	506859694	/nfs/dbraw/zinc/85/96/94/506859694.db2.gz	TWAHXKPHTCNECS-UHFFFAOYSA-N	-1	0	356.426	2.764	50	0		FFAARM
O=C([O-])c1ccc(C=NNC(=O)CSc2nc3ccccc3o2)cc1	ZINC000013108394	506929180	/nfs/dbraw/zinc/92/91/80/506929180.db2.gz	ALFDSGZRVOTTDY-UHFFFAOYSA-N	-1	0	355.375	2.768	50	0		FFAARM
COC(=O)c1ccc(/C=C2/C(=O)[N-]N(c3ccc(C)c(C)c3)C2=O)cc1	ZINC000016667436	507103936	/nfs/dbraw/zinc/10/39/36/507103936.db2.gz	GGXOQPBQLOJXJH-BOPFTXTBSA-N	-1	0	350.374	2.551	50	0		FFAARM
COc1cc(C(=O)c2ccccc2)c(OC)cc1C(=O)SCC(=O)[O-]	ZINC000022130760	507280964	/nfs/dbraw/zinc/28/09/64/507280964.db2.gz	HFAULIVWDVHQKV-UHFFFAOYSA-N	-1	0	360.387	2.893	50	0		FFAARM
O=C([O-])c1cc(NS(=O)(=O)c2ccc3c(c2)CCO3)ccc1Cl	ZINC000047318103	507307742	/nfs/dbraw/zinc/30/77/42/507307742.db2.gz	HAJHTEXHTRCSAB-UHFFFAOYSA-N	-1	0	353.783	2.774	50	0		FFAARM
CC(C)=CC[C@@]1(C(=O)[O-])CCCN(C(=O)c2ccccc2-c2nn[nH]n2)C1	ZINC000091364739	507982223	/nfs/dbraw/zinc/98/22/23/507982223.db2.gz	CNTMNZBQNKWKNI-IBGZPJMESA-N	-1	0	369.425	2.530	50	0		FFAARM
Cc1ccccc1[C@@H]1CN(C(=O)c2n[nH]c3c2CCCC3)C[C@H]1C(=O)[O-]	ZINC000091551534	507992068	/nfs/dbraw/zinc/99/20/68/507992068.db2.gz	DRZXQXDOBZIERR-JKSUJKDBSA-N	-1	0	353.422	2.537	50	0		FFAARM
CCn1nc(C)c(C(=O)N2C[C@@H](c3ccccc3C)[C@H](C(=O)[O-])C2)c1C	ZINC000091713882	508004662	/nfs/dbraw/zinc/00/46/62/508004662.db2.gz	KBCOWWNPLBOQHP-DLBZAZTESA-N	-1	0	355.438	2.769	50	0		FFAARM
Cc1n[nH]c(CCC(=O)N2C[C@@H](c3ccccc3C)[C@H](C(=O)[O-])C2)c1C	ZINC000091965879	508028305	/nfs/dbraw/zinc/02/83/05/508028305.db2.gz	WPZFLMWPDNZFJJ-DLBZAZTESA-N	-1	0	355.438	2.594	50	0		FFAARM
CCn1cc2ccc(NS(=O)(=O)c3ccc(C)c(C(=O)[O-])c3)cc2n1	ZINC000075572867	508118630	/nfs/dbraw/zinc/11/86/30/508118630.db2.gz	PRCQAQULFDYCHY-UHFFFAOYSA-N	-1	0	359.407	2.864	50	0		FFAARM
CCNc1ncc(C(=O)N2CCC[C@H](c3cccc(C(=O)[O-])c3)C2)cn1	ZINC000095359237	508175584	/nfs/dbraw/zinc/17/55/84/508175584.db2.gz	VETHRBWPHJBQHZ-HNNXBMFYSA-N	-1	0	354.410	2.626	50	0		FFAARM
CC(=O)N1CCCN([C@@H](C(=O)[O-])c2cc(Cl)ccc2OC(C)C)CC1	ZINC000095378240	508180559	/nfs/dbraw/zinc/18/05/59/508180559.db2.gz	JACJEPFYCXYJKN-QGZVFWFLSA-N	-1	0	368.861	2.807	50	0		FFAARM
O=C([O-])c1cccc(C[C@@H]2CCN(C(=O)c3scc4c3OCCO4)C2)c1	ZINC000095383891	508182141	/nfs/dbraw/zinc/18/21/41/508182141.db2.gz	CIKHBBQMMGCMPA-ZDUSSCGKSA-N	-1	0	373.430	2.922	50	0		FFAARM
Cc1ccc(Cl)c([C@H](C(=O)[O-])N2CCN(Cc3cccnc3)CC2)c1	ZINC000095389405	508183593	/nfs/dbraw/zinc/18/35/93/508183593.db2.gz	KCCWTQAMRCAPHU-GOSISDBHSA-N	-1	0	359.857	2.987	50	0		FFAARM
COc1ccc(C(C)=O)cc1CC(=O)N(C)Cc1cc(C(=O)[O-])c(C)o1	ZINC000095425068	508185126	/nfs/dbraw/zinc/18/51/26/508185126.db2.gz	WCUAOBUHORDDBI-UHFFFAOYSA-N	-1	0	359.378	2.699	50	0		FFAARM
Cc1cc(C)n(Cc2ccc(C(=O)Nc3cccc(OCC(=O)[O-])c3)o2)n1	ZINC000095425130	508185309	/nfs/dbraw/zinc/18/53/09/508185309.db2.gz	BTLRJHDCNCIPOS-UHFFFAOYSA-N	-1	0	369.377	2.857	50	0		FFAARM
COC(=O)[C@]([N-]c1nccs1)(NC(=O)c1ccccc1C)C(F)(F)F	ZINC000096579828	508214874	/nfs/dbraw/zinc/21/48/74/508214874.db2.gz	HYNXJUAPEUZTAK-CQSZACIVSA-N	-1	0	373.356	2.725	50	0		FFAARM
CC1(C(=O)N2CCc3ccc(S(=O)(=O)[N-]c4cccnc4)cc3C2)CC1	ZINC000077353901	508303697	/nfs/dbraw/zinc/30/36/97/508303697.db2.gz	FLWYEOQQYAYNRF-UHFFFAOYSA-N	-1	0	371.462	2.567	50	0		FFAARM
COc1ccc(-c2cnc(CCC(=O)N3CCC[C@H](C(=O)[O-])C3)o2)cc1	ZINC000136160654	508675722	/nfs/dbraw/zinc/67/57/22/508675722.db2.gz	FHEQCQCDRXTIHW-AWEZNQCLSA-N	-1	0	358.394	2.606	50	0		FFAARM
CCOc1cc(C(=O)[O-])ccc1OS(=O)(=O)c1ccc(OC)cc1	ZINC000217042975	509266536	/nfs/dbraw/zinc/26/65/36/509266536.db2.gz	APBFMLZEGPYWBC-UHFFFAOYSA-N	-1	0	352.364	2.560	50	0		FFAARM
COc1cccc([C@@H]2C[C@@H]2C(=O)N2Cc3ccccc3C[C@@H]2C(=O)[O-])c1	ZINC000237542568	509674406	/nfs/dbraw/zinc/67/44/06/509674406.db2.gz	ULZMIHVMFPFTQD-GBESFXJTSA-N	-1	0	351.402	2.837	50	0		FFAARM
Cc1nc(C(F)(F)F)ccc1C(=O)N(CCC(=O)[O-])C[C@@H]1CCCO1	ZINC000237563938	509679983	/nfs/dbraw/zinc/67/99/83/509679983.db2.gz	KOKLVSYDACKESU-NSHDSACASA-N	-1	0	360.332	2.505	50	0		FFAARM
Cc1cc(C(=O)N2CCO[C@H](C(=O)[O-])C2)c(C)n1[C@H](C)c1ccccc1	ZINC000237767608	509731114	/nfs/dbraw/zinc/73/11/14/509731114.db2.gz	OPYIERXDAYTHAS-KDOFPFPSSA-N	-1	0	356.422	2.640	50	0		FFAARM
O=C([O-])CC[C@H]1CCCN(C(=O)COc2cccc(Br)c2)C1	ZINC000238002560	509795335	/nfs/dbraw/zinc/79/53/35/509795335.db2.gz	XKSDOHVVBHPKBG-GFCCVEGCSA-N	-1	0	370.243	2.931	50	0		FFAARM
O=C([O-])c1ccc(C(=O)NCC2(c3cccc(Cl)c3)CCOCC2)cn1	ZINC000238010522	509797107	/nfs/dbraw/zinc/79/71/07/509797107.db2.gz	ROWIWJQMXBFJSX-UHFFFAOYSA-N	-1	0	374.824	2.911	50	0		FFAARM
O=C([O-])C1CCN(C(=O)c2ccccc2C(=O)c2ccc(F)cc2)CC1	ZINC000238032053	509805003	/nfs/dbraw/zinc/80/50/03/509805003.db2.gz	NPZCYDLSIGCBFX-UHFFFAOYSA-N	-1	0	355.365	2.994	50	0		FFAARM
O=C([O-])CCN(C[C@@H]1CCCO1)C(=O)c1cc(F)cc(Br)c1	ZINC000238093003	509820322	/nfs/dbraw/zinc/82/03/22/509820322.db2.gz	SCAAGDIVSUMMFK-ZDUSSCGKSA-N	-1	0	374.206	2.684	50	0		FFAARM
O=C([O-])CN(C(=O)/C=C/c1cc(Br)cs1)C1CCOCC1	ZINC000238106308	509821694	/nfs/dbraw/zinc/82/16/94/509821694.db2.gz	SZFADJXTIBIDEY-OWOJBTEDSA-N	-1	0	374.256	2.616	50	0		FFAARM
O=C([O-])CN(C(=O)c1csc(-c2cccs2)n1)C1CCOCC1	ZINC000238116001	509823646	/nfs/dbraw/zinc/82/36/46/509823646.db2.gz	DRNAGCIJFJVOJC-UHFFFAOYSA-N	-1	0	352.437	2.577	50	0		FFAARM
O=C([O-])CCN(Cc1ccc(F)c(F)c1)C(=O)[C@H]1CC12CCOCC2	ZINC000238124656	509825059	/nfs/dbraw/zinc/82/50/59/509825059.db2.gz	QRYDQSBHPKSZMO-CYBMUJFWSA-N	-1	0	353.365	2.585	50	0		FFAARM
COc1ccc(C[N@@H+]2CC[C@](C(=O)[O-])(c3ccccc3)C2)cc1C(=O)[O-]	ZINC000252482709	509839646	/nfs/dbraw/zinc/83/96/46/509839646.db2.gz	DMHYBKXKBCSCGF-HXUWFJFHSA-N	-1	0	355.390	2.622	50	0		FFAARM
Cc1cc(F)ccc1CS(=O)(=O)[N-]C(=O)Cc1c[nH]c2ccccc12	ZINC000252489639	509842358	/nfs/dbraw/zinc/84/23/58/509842358.db2.gz	JVGILALPGQJIDK-UHFFFAOYSA-N	-1	0	360.410	2.804	50	0		FFAARM
O=C([O-])[C@H]1CCN(C(=O)/C=C\c2ccc(Oc3cccnc3)c(F)c2)C1	ZINC000255573230	509930367	/nfs/dbraw/zinc/93/03/67/509930367.db2.gz	ICEWSQYTOONLKD-SDQPKGBYSA-N	-1	0	356.353	2.959	50	0		FFAARM
O=C([O-])[C@@H]1CCCN(C(=O)CCc2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000268894413	510122737	/nfs/dbraw/zinc/12/27/37/510122737.db2.gz	BHYNLIPFYAIDHE-GFCCVEGCSA-N	-1	0	363.801	2.646	50	0		FFAARM
O=C([O-])[C@H]1CN(C(=O)c2cc(Cl)ccc2OC2CCCC2)CCO1	ZINC000262040944	510157255	/nfs/dbraw/zinc/15/72/55/510157255.db2.gz	CTHCGOVONXWRLL-OAHLLOKOSA-N	-1	0	353.802	2.587	50	0		FFAARM
Cc1c(C(=O)Nc2ccc(OCC(=O)[O-])cc2C)cnn1C1CCOCC1	ZINC000262741075	510392142	/nfs/dbraw/zinc/39/21/42/510392142.db2.gz	GTYRURNDZXWSRF-UHFFFAOYSA-N	-1	0	373.409	2.567	50	0		FFAARM
O=C([O-])[C@H](CNC(=O)c1ccc(Cl)c2cccnc12)C1CCOCC1	ZINC000262987190	510508710	/nfs/dbraw/zinc/50/87/10/510508710.db2.gz	PXIZEMQVLGQBMS-CQSZACIVSA-N	-1	0	362.813	2.745	50	0		FFAARM
Cc1cc(C(=O)N2CC[C@H](C(=O)[O-])C2)c2cc(Br)ccc2n1	ZINC000178257212	510511652	/nfs/dbraw/zinc/51/16/52/510511652.db2.gz	DJXMOGBYTCOEOY-JTQLQIEISA-N	-1	0	363.211	2.852	50	0		FFAARM
CCCN1C[C@@H](NC(=O)c2cccc(-c3ccccc3C(=O)[O-])c2)CC1=O	ZINC000584901972	518531035	/nfs/dbraw/zinc/53/10/35/518531035.db2.gz	VCAQRDJZDMMRBF-INIZCTEOSA-N	-1	0	366.417	2.793	50	0		FFAARM
CC(C)c1ccc(OC2CCN(C(=O)c3cnc(C(=O)[O-])cn3)CC2)cc1	ZINC000578131143	519435445	/nfs/dbraw/zinc/43/54/45/519435445.db2.gz	GGMMIMPCLGBSRM-UHFFFAOYSA-N	-1	0	369.421	2.982	50	0		FFAARM
O=C([O-])[C@@H](C(=O)NCc1cnn(-c2cccc(F)c2)c1)C1CCCCC1	ZINC000299786661	534511633	/nfs/dbraw/zinc/51/16/33/534511633.db2.gz	NSBWFFNQPFSQAM-QGZVFWFLSA-N	-1	0	359.401	2.909	50	0		FFAARM
COc1cc(/C=C\C(=O)N2CCC[C@H](C(=O)[O-])C2)cc(Cl)c1OC	ZINC000606441131	521068879	/nfs/dbraw/zinc/06/88/79/521068879.db2.gz	UKFZZSKNQUWDRW-FJOGCWAESA-N	-1	0	353.802	2.694	50	0		FFAARM
CCc1nc(C)c(C(=O)N2C[C@@H](c3cccc(OC)c3)[C@H](C(=O)[O-])C2)s1	ZINC000091656273	522191410	/nfs/dbraw/zinc/19/14/10/522191410.db2.gz	ICLCUPKWBUQDMC-LSDHHAIUSA-N	-1	0	374.462	2.963	50	0		FFAARM
CC[C@@H](C)[C@H](NC(=O)Cc1csc(-c2ccccc2OC)n1)C(=O)[O-]	ZINC000020739998	522375635	/nfs/dbraw/zinc/37/56/35/522375635.db2.gz	JUHBOQXNALNPGD-BZNIZROVSA-N	-1	0	362.451	2.977	50	0		FFAARM
COC(=O)c1c([S-])nc(-c2ccccc2)n(-c2ccc(C)cc2)c1=O	ZINC000000715363	523944598	/nfs/dbraw/zinc/94/45/98/523944598.db2.gz	DYRSNFLOVVQYNW-OAHLLOKOSA-N	-1	0	352.415	2.905	50	0		FFAARM
Cc1ccccc1[C@@H](CC(=O)[O-])NC(=O)[C@H]1CC(=O)Nc2cc(F)ccc21	ZINC000237599410	525365954	/nfs/dbraw/zinc/36/59/54/525365954.db2.gz	FGHCEKCYERRBTO-DOTOQJQBSA-N	-1	0	370.380	2.892	50	0		FFAARM
Cc1noc(-c2ccc(C(=O)N3[C@@H]4CCCC[C@H]4C[C@H]3C(=O)[O-])cc2)n1	ZINC000299742668	534874923	/nfs/dbraw/zinc/87/49/23/534874923.db2.gz	IERWBAYNEFRYMF-XHSDSOJGSA-N	-1	0	355.394	2.903	50	0		FFAARM
O=C([O-])COc1cccc(CNC(=O)[C@H]2C[C@@H]2c2cccc(F)c2F)c1	ZINC000238020943	527618438	/nfs/dbraw/zinc/61/84/38/527618438.db2.gz	GFSLSLIVINFQFP-CABCVRRESA-N	-1	0	361.344	2.848	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)[C@H]1CC(=O)Nc2ccccc21)c1ccc(F)cc1	ZINC000238149370	527625430	/nfs/dbraw/zinc/62/54/30/527625430.db2.gz	RFBAPSSIFUKBQD-GOEBONIOSA-N	-1	0	356.353	2.584	50	0		FFAARM
COc1ccc(Cc2c([O-])[nH]c(=O)n(-c3cccc(Cl)c3)c2=O)cc1	ZINC000001071834	536508775	/nfs/dbraw/zinc/50/87/75/536508775.db2.gz	MVMNGIFKXNRBFK-OAHLLOKOSA-N	-1	0	358.781	2.790	50	0		FFAARM
O=C(CCC(=O)c1csc2ccccc12)[N-]S(=O)(=O)c1cccnc1	ZINC000119797249	570522437	/nfs/dbraw/zinc/52/24/37/570522437.db2.gz	RTETTZIVWGZFMA-UHFFFAOYSA-N	-1	0	374.443	2.764	50	0		FFAARM
O=C1CCc2cc(S(=O)(=O)[N-]c3ccc4c(c3)CCC4)c(F)cc2N1	ZINC000047329280	570885356	/nfs/dbraw/zinc/88/53/56/570885356.db2.gz	ACJBAIOFHOJTME-UHFFFAOYSA-N	-1	0	360.410	3.000	50	0		FFAARM
CC(C)(C)CS(=O)(=O)[N-]C(=O)c1ccc(OCc2cscn2)cc1	ZINC000112762825	570960316	/nfs/dbraw/zinc/96/03/16/570960316.db2.gz	SWUSPKBLMGPAMS-UHFFFAOYSA-N	-1	0	368.480	2.828	50	0		FFAARM
O=C([O-])c1cc(Cl)cc(NC(=O)C2CCN(c3cnccn3)CC2)c1	ZINC000181868011	600622987	/nfs/dbraw/zinc/62/29/87/600622987.db2.gz	BUKJEYSFZPVMAC-UHFFFAOYSA-N	-1	0	360.801	2.683	50	0		FFAARM
CCc1ccc(OCCNc2nc(C)c(Br)c(=O)[n-]2)cc1	ZINC000002840838	727774698	/nfs/dbraw/zinc/77/46/98/727774698.db2.gz	NRGDKQPUGAXIDE-UHFFFAOYSA-N	-1	0	352.232	2.894	50	0		FFAARM
Cn1c(SCC(=O)[O-])nnc1-c1cccc(NC(=O)c2ccccc2)c1	ZINC000005712873	1010894820	/nfs/dbraw/zinc/89/48/20/1010894820.db2.gz	WAHAPPIQCAUPQY-UHFFFAOYSA-N	-1	0	368.418	2.911	50	0		FFAARM
COc1cc(CNc2nccc(-c3cc(C(=O)[O-])ccn3)n2)cc(OC)c1	ZINC000077301897	1020664584	/nfs/dbraw/zinc/66/45/84/1020664584.db2.gz	AGEUVGKMEVWJKV-UHFFFAOYSA-N	-1	0	366.377	2.866	50	0		FFAARM
Cc1ccc(C(=O)[O-])c(N2CCC[C@]3(CCC(=O)N(CC4CC4)C3)C2)n1	ZINC000077535065	1020674391	/nfs/dbraw/zinc/67/43/91/1020674391.db2.gz	JHGLPKLADSFELY-FQEVSTJZSA-N	-1	0	357.454	2.707	50	0		FFAARM
CCOc1cc(C)c(Cl)cc1S(=O)(=O)N1CCC[C@@H](C(=O)[O-])C1	ZINC001506431759	1059517583	/nfs/dbraw/zinc/51/75/83/1059517583.db2.gz	YCIHHYCPHNORLT-LLVKDONJSA-N	-1	0	361.847	2.532	50	0		FFAARM
COc1ccc([C@@H](C(=O)[O-])N(C)Cc2nc3cc(F)ccc3[nH]2)cc1OC	ZINC001529142937	1062183448	/nfs/dbraw/zinc/18/34/48/1062183448.db2.gz	XVIXNEONDKWQKY-SFHVURJKSA-N	-1	0	373.384	2.977	50	0		FFAARM
C[S@](=O)C[C@H](NC(=O)c1ccc2[n-]c(=S)oc2c1)c1ccccc1	ZINC000170649103	222612735	/nfs/dbraw/zinc/61/27/35/222612735.db2.gz	KWDZMZFXSKQPSO-BSEYFRJRSA-N	-1	0	360.460	2.966	50	0		FFAARM
COc1ccc(NC(=O)c2nc[n-]c2C(=O)Nc2ccc(OC)cc2)cc1	ZINC000000715359	219316328	/nfs/dbraw/zinc/31/63/28/219316328.db2.gz	ADMIWEFTECZSLA-UHFFFAOYSA-N	-1	0	366.377	2.932	50	0		FFAARM
CCn1c(SCC(=O)Nc2cccc(C(=O)[O-])c2)nnc1-c1ccco1	ZINC000000813825	219324506	/nfs/dbraw/zinc/32/45/06/219324506.db2.gz	OVPMLYWKJITCNI-UHFFFAOYSA-N	-1	0	372.406	2.987	50	0		FFAARM
COc1cccc(N2C(=O)C[C@H](Sc3ccccc3C(=O)[O-])C2=O)c1	ZINC000000915020	219340515	/nfs/dbraw/zinc/34/05/15/219340515.db2.gz	BIOMZRBOOIMBTP-HNNXBMFYSA-N	-1	0	357.387	2.818	50	0		FFAARM
COc1ccc(/C=C/C(=O)[O-])cc1S(=O)(=O)N1CCc2ccccc2C1	ZINC000001183767	219386102	/nfs/dbraw/zinc/38/61/02/219386102.db2.gz	DMEQLNWEKHKODN-VQHVLOKHSA-N	-1	0	373.430	2.540	50	0		FFAARM
O=C([O-])c1cccc(NC2=C(Cl)C(=O)N(Cc3ccccc3)C2=O)c1	ZINC000001779589	219418937	/nfs/dbraw/zinc/41/89/37/219418937.db2.gz	YZBXAGXTTCACIK-UHFFFAOYSA-N	-1	0	356.765	2.816	50	0		FFAARM
Cc1ccc(CN2C(=O)CC[C@H]2C(=O)N2CCC[C@H](CCC(=O)[O-])C2)cc1	ZINC000237733631	222909793	/nfs/dbraw/zinc/90/97/93/222909793.db2.gz	IZDYYGJHULGZFJ-AEFFLSMTSA-N	-1	0	372.465	2.589	50	0		FFAARM
O=C([O-])[C@H]1CC=CC[C@@H]1C(=O)NCCc1csc(-c2cccnc2)n1	ZINC000004167060	219550911	/nfs/dbraw/zinc/55/09/11/219550911.db2.gz	FHDIIOLXXLEGLF-GJZGRUSLSA-N	-1	0	357.435	2.531	50	0		FFAARM
COC(=O)C[C@H](NC(=O)C1=C(C(=O)[O-])CCCC1)c1cccc(C)c1C	ZINC000004551228	219585729	/nfs/dbraw/zinc/58/57/29/219585729.db2.gz	GOWYLTYMIOUSNS-KRWDZBQOSA-N	-1	0	359.422	2.979	50	0		FFAARM
O=C([O-])[C@@H]1CCN(C(=O)c2cc(-c3ccco3)nn2-c2ccccc2)C1	ZINC000299743478	223079662	/nfs/dbraw/zinc/07/96/62/223079662.db2.gz	NRVAPUVVNVGZRQ-CYBMUJFWSA-N	-1	0	351.362	2.679	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)C[C@H]1CCOC1)c1ccc(Br)cc1	ZINC000299742084	223079690	/nfs/dbraw/zinc/07/96/90/223079690.db2.gz	GTNTZGAZHPDWIT-MFKMUULPSA-N	-1	0	356.216	2.508	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)C1CCOCC1)c1ccc(OC(F)(F)F)cc1	ZINC000299343412	223077639	/nfs/dbraw/zinc/07/76/39/223077639.db2.gz	HMBVWJHADDDDHB-ZDUSSCGKSA-N	-1	0	361.316	2.644	50	0		FFAARM
O=C([O-])[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1cnn(Cc2ccccc2)c1	ZINC000299327658	223078369	/nfs/dbraw/zinc/07/83/69/223078369.db2.gz	BNIDNLXXOAFNAI-SZMVWBNQSA-N	-1	0	353.422	2.789	50	0		FFAARM
O=C([O-])[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1cnn(Cc2ccccc2)c1	ZINC000299327654	223078470	/nfs/dbraw/zinc/07/84/70/223078470.db2.gz	BNIDNLXXOAFNAI-JQHSSLGASA-N	-1	0	353.422	2.789	50	0		FFAARM
O=C([O-])CCN(C[C@@H]1CCCO1)C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1F	ZINC000299753362	223080121	/nfs/dbraw/zinc/08/01/21/223080121.db2.gz	XZGWVBRMUXGQIH-AEGPPILISA-N	-1	0	353.365	2.551	50	0		FFAARM
Cc1nc(-c2ccc(Cl)s2)sc1C(=O)N1CCOC[C@@H]1C(=O)[O-]	ZINC000299750233	223080831	/nfs/dbraw/zinc/08/08/31/223080831.db2.gz	MZJXFURCKMAKHO-MRVPVSSYSA-N	-1	0	372.855	2.759	50	0		FFAARM
O=C([O-])c1cccc(S(=O)(=O)Nc2cccc(NC(=O)C3CC3)c2)c1	ZINC000012526186	220002547	/nfs/dbraw/zinc/00/25/47/220002547.db2.gz	WRGLMQPNUNVUCJ-UHFFFAOYSA-N	-1	0	360.391	2.534	50	0		FFAARM
CC[C@@H](C(=O)OCC(=O)[N-]C(=O)c1ccccc1OC)c1ccccc1	ZINC000012980060	220048361	/nfs/dbraw/zinc/04/83/61/220048361.db2.gz	MXOURERVUZSPPZ-OAHLLOKOSA-N	-1	0	355.390	2.689	50	0		FFAARM
COc1ccc(CNC(=O)c2ccc(-n3nccc3C)cc2)cc1C(=O)[O-]	ZINC000012992871	220049763	/nfs/dbraw/zinc/04/97/63/220049763.db2.gz	DDJPGTJLZVJMSF-UHFFFAOYSA-N	-1	0	365.389	2.818	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)c1cnn(-c2ccccc2)c1)c1ccc(F)cc1	ZINC000013257821	220062711	/nfs/dbraw/zinc/06/27/11/220062711.db2.gz	AYMULZQKKOCWIY-QGZVFWFLSA-N	-1	0	353.353	2.957	50	0		FFAARM
O=C([O-])c1cccc(OCC(=O)N(Cc2ccco2)CC(F)(F)F)c1	ZINC000013419207	220067401	/nfs/dbraw/zinc/06/74/01/220067401.db2.gz	QZMNWLCMCXCNNL-UHFFFAOYSA-N	-1	0	357.284	2.948	50	0		FFAARM
Cc1cnc(NC(=O)c2ccc3nc([N-]S(C)(=O)=O)sc3c2)s1	ZINC000013692509	220087586	/nfs/dbraw/zinc/08/75/86/220087586.db2.gz	JEYLHYXIDCEUHC-UHFFFAOYSA-N	-1	0	368.465	2.685	50	0		FFAARM
CN(Cc1nc(=O)c2sccc2[n-]1)C(=O)COc1ccccc1Cl	ZINC000014371637	220123379	/nfs/dbraw/zinc/12/33/79/220123379.db2.gz	ZWERVTFUVLOVSX-UHFFFAOYSA-N	-1	0	363.826	2.675	50	0		FFAARM
O=S(=O)([N-]c1ncn(Cc2ccc(F)cc2)n1)c1cc(F)ccc1F	ZINC000014250847	220119547	/nfs/dbraw/zinc/11/95/47/220119547.db2.gz	XEOSDOUKIZURTQ-UHFFFAOYSA-N	-1	0	368.340	2.545	50	0		FFAARM
COCCc1ccc(O[C@H]2C[C@@H](C(=O)[O-])N(C(=O)OC(C)(C)C)C2)cc1	ZINC000014632526	220128523	/nfs/dbraw/zinc/12/85/23/220128523.db2.gz	PRHIWKFRRWQFOQ-HOTGVXAUSA-N	-1	0	365.426	2.717	50	0		FFAARM
Cc1sc(NC(=O)CCC(=O)[O-])c(C(N)=O)c1-c1ccc(F)cc1	ZINC000017072670	220201722	/nfs/dbraw/zinc/20/17/22/220201722.db2.gz	WBDZSSUKTYRHLN-UHFFFAOYSA-N	-1	0	350.371	2.765	50	0		FFAARM
COc1ccc(NC(=O)Cc2c(C)[n-]n(-c3nc(C)cs3)c2=O)cc1	ZINC000021801988	220367229	/nfs/dbraw/zinc/36/72/29/220367229.db2.gz	GGLKAVHBGSPPFZ-UHFFFAOYSA-N	-1	0	358.423	2.841	50	0		FFAARM
COc1cc2c(cc1OC)[C@H](CC(=O)[O-])N(C(=O)c1ccc(C)n1C)CC2	ZINC000299395756	533172982	/nfs/dbraw/zinc/17/29/82/533172982.db2.gz	LKBYBNZWOSULEE-INIZCTEOSA-N	-1	0	372.421	2.565	50	0		FFAARM
COC(=O)[C@@H](CC(=O)[O-])NC(=O)OCC1c2ccccc2-c2ccccc21	ZINC000034587126	220756054	/nfs/dbraw/zinc/75/60/54/220756054.db2.gz	UEUZUMRMWJUEMK-QGZVFWFLSA-N	-1	0	369.373	2.541	50	0		FFAARM
CC(C)COc1ccc(-c2nnc(CCC(=O)N3CCCC3)c(=O)[n-]2)cc1	ZINC000034763914	220761873	/nfs/dbraw/zinc/76/18/73/220761873.db2.gz	BNXLEAHXZAZYRD-UHFFFAOYSA-N	-1	0	370.453	2.834	50	0		FFAARM
CCS(=O)(=O)c1ccc([O-])c(NC(=O)c2cc3ccccc3n2C)c1	ZINC000048365096	221011490	/nfs/dbraw/zinc/01/14/90/221011490.db2.gz	KOBTYKVCEGZVKT-UHFFFAOYSA-N	-1	0	358.419	2.930	50	0		FFAARM
CCn1cc(S(=O)(=O)[N-]c2ccc(F)cc2Br)nc1C	ZINC000050265798	221031267	/nfs/dbraw/zinc/03/12/67/221031267.db2.gz	IZFDMMHCNPIVNI-UHFFFAOYSA-N	-1	0	362.224	2.914	50	0		FFAARM
O=C([O-])[C@@H]1CC=CC[C@@H]1C(=O)Nc1cccc(CN2CCCCC2=O)c1	ZINC000051186057	221034467	/nfs/dbraw/zinc/03/44/67/221034467.db2.gz	VNUPHNBKQPRWKO-DLBZAZTESA-N	-1	0	356.422	2.805	50	0		FFAARM
CCNC(=O)c1ccc(Cl)cc1NC(=O)[C@H]1CC=CC[C@H]1C(=O)[O-]	ZINC000055150239	221059606	/nfs/dbraw/zinc/05/96/06/221059606.db2.gz	SAKJFVXUXIJFAP-NWDGAFQWSA-N	-1	0	350.802	2.695	50	0		FFAARM
O=C([O-])c1cn([C@@H](CO)c2ccccc2)cc(Oc2ccccc2)c1=O	ZINC000055308961	221065597	/nfs/dbraw/zinc/06/55/97/221065597.db2.gz	ZWTFXDJOUZPZTJ-KRWDZBQOSA-N	-1	0	351.358	2.921	50	0		FFAARM
CCN(c1cccc(F)c1)S(=O)(=O)c1ccc(OC)c(C(=O)[O-])c1	ZINC000055663082	221073568	/nfs/dbraw/zinc/07/35/68/221073568.db2.gz	XBWOJQQICUYGMZ-UHFFFAOYSA-N	-1	0	353.371	2.748	50	0		FFAARM
CCc1cccc(NS(=O)(=O)c2cc3c(c(C(=O)[O-])c2)OCCO3)c1	ZINC000057115970	221083979	/nfs/dbraw/zinc/08/39/79/221083979.db2.gz	OUKKUDHNLMVUTD-UHFFFAOYSA-N	-1	0	363.391	2.519	50	0		FFAARM
O=C([O-])c1ccc2c(c1)S[C@H](CC(=O)Nc1cccc(F)c1)C(=O)N2	ZINC000061719601	221134694	/nfs/dbraw/zinc/13/46/94/221134694.db2.gz	OACPXCPRSSQEBL-CQSZACIVSA-N	-1	0	360.366	2.966	50	0		FFAARM
COc1ccc(C(=O)N2CCC(C(=O)N3CCC(C)CC3)CC2)c(O)c1	ZINC000058244829	221110662	/nfs/dbraw/zinc/11/06/62/221110662.db2.gz	QTMRAFPKYRIJBW-UHFFFAOYSA-N	-1	0	360.454	2.512	50	0		FFAARM
CCc1nnc(-c2ccc(S(=O)(=O)[N-]c3ccc(OC)c(F)c3)o2)o1	ZINC000065246260	221185555	/nfs/dbraw/zinc/18/55/55/221185555.db2.gz	NBGQVHCAPZYYAG-UHFFFAOYSA-N	-1	0	367.358	2.841	50	0		FFAARM
O=C([O-])c1ccc2c(c1)n(CCCCO)c(=O)n2CCc1ccccc1	ZINC000065528338	221230890	/nfs/dbraw/zinc/23/08/90/221230890.db2.gz	YPOQFDRTELKDRV-UHFFFAOYSA-N	-1	0	354.406	2.516	50	0		FFAARM
O=C([O-])[C@@]1(C/C=C/c2ccccc2)CCCN(C(=O)c2ccc(=O)[nH]c2)C1	ZINC000071730229	221357257	/nfs/dbraw/zinc/35/72/57/221357257.db2.gz	JUYQDTBGCSVJMW-VPVJOJIASA-N	-1	0	366.417	2.785	50	0		FFAARM
CCOc1ccc(S(=O)(=O)N2c3ccccc3C[C@H]2C)cc1C(=O)[O-]	ZINC000071837542	221381817	/nfs/dbraw/zinc/38/18/17/221381817.db2.gz	UEQNUOSRKRPRIX-GFCCVEGCSA-N	-1	0	361.419	2.923	50	0		FFAARM
COc1ccc(CNC(=O)[C@@H]2Cc3cc(C)c(C)cc3O2)cc1C(=O)[O-]	ZINC000299750941	533641493	/nfs/dbraw/zinc/64/14/93/533641493.db2.gz	OVGFQBCYVTXTJO-SFHVURJKSA-N	-1	0	355.390	2.630	50	0		FFAARM
O=C([O-])c1ccc(N2CCC[C@]3(CCC(=O)N(C4CCCC4)C3)C2)nc1	ZINC000077428915	132184800	/nfs/dbraw/zinc/18/48/00/132184800.db2.gz	YTZMASMNHQLVNC-FQEVSTJZSA-N	-1	0	357.454	2.931	50	0		FFAARM
CN1C(=O)C[C@@H](C(=O)[O-])C12CCN(c1ccnc3cc(Cl)ccc31)CC2	ZINC000095387177	132210101	/nfs/dbraw/zinc/21/01/01/132210101.db2.gz	KAQJCZLPIWZNLN-AWEZNQCLSA-N	-1	0	373.840	2.790	50	0		FFAARM
O=C([O-])c1csc(CCNC(=O)c2ccc(N3CCCCC3)cc2)n1	ZINC000220450265	132275986	/nfs/dbraw/zinc/27/59/86/132275986.db2.gz	VHXBBPMZPLGWHQ-UHFFFAOYSA-N	-1	0	359.451	2.804	50	0		FFAARM
Cc1ccc(S(=O)(=O)N2c3cc(C)ccc3OC[C@H]2CC(=O)[O-])cc1	ZINC000299803785	132300941	/nfs/dbraw/zinc/30/09/41/132300941.db2.gz	CMFVXMWZZPYPMC-CQSZACIVSA-N	-1	0	361.419	2.734	50	0		FFAARM
C[C@@H](CC(=O)[O-])CC(=O)N1CCN(c2cccc(C(F)(F)F)c2)CC1	ZINC000017073913	132373862	/nfs/dbraw/zinc/37/38/62/132373862.db2.gz	KHTXRVHWAGYJEW-GFCCVEGCSA-N	-1	0	358.360	2.855	50	0		FFAARM
Cc1c(-c2cc(C(F)(F)F)nc(N3CCC[C@@H](C(=O)[O-])C3)n2)cnn1C	ZINC000002554457	132383715	/nfs/dbraw/zinc/38/37/15/132383715.db2.gz	FBKHJUWWJBKNBG-SNVBAGLBSA-N	-1	0	369.347	2.505	50	0		FFAARM
O=C([O-])C[C@H]1Oc2ccccc2N(CCCOCc2ccccc2)C1=O	ZINC000055308986	136126417	/nfs/dbraw/zinc/12/64/17/136126417.db2.gz	NTWVOIMKGUFMBE-GOSISDBHSA-N	-1	0	355.390	2.862	50	0		FFAARM
Cc1cnc(C)c(N2CCC(C(=O)[O-])(n3ccc(-c4ccco4)n3)CC2)n1	ZINC000072431188	136146942	/nfs/dbraw/zinc/14/69/42/136146942.db2.gz	CSLBAZDZLNJOSL-UHFFFAOYSA-N	-1	0	367.409	2.630	50	0		FFAARM
CCOCC(=O)N1CCC(Oc2ccc3ccccc3c2)(C(=O)[O-])CC1	ZINC000072475277	221547319	/nfs/dbraw/zinc/54/73/19/221547319.db2.gz	JJDCRDOVCDDCIT-UHFFFAOYSA-N	-1	0	357.406	2.701	50	0		FFAARM
O=C([O-])c1ccnc(-c2ccnc(NCCc3nc4c(s3)CCC4)n2)c1	ZINC000077452255	221628347	/nfs/dbraw/zinc/62/83/47/221628347.db2.gz	BHTMGDSSZYHKRK-UHFFFAOYSA-N	-1	0	367.434	2.837	50	0		FFAARM
C[C@H](O)[C@H](C(=O)[O-])n1cnc(-c2ccccc2)c1-c1ccc(N(C)C)nc1	ZINC000092028219	221826944	/nfs/dbraw/zinc/82/69/44/221826944.db2.gz	OJOIYXVNKBTROH-SCLBCKFNSA-N	-1	0	366.421	2.685	50	0		FFAARM
CCS(=O)(=O)c1ccc(CC(=O)Nc2ccc(C(=O)[O-])cc2C)cc1	ZINC000095430556	221902172	/nfs/dbraw/zinc/90/21/72/221902172.db2.gz	RAUSDSQVZPLDCR-UHFFFAOYSA-N	-1	0	361.419	2.668	50	0		FFAARM
COc1cc(OC)cc(C2=NN(C(=O)CCC(=O)[O-])[C@@H](c3ccco3)C2)c1	ZINC000095532115	221957852	/nfs/dbraw/zinc/95/78/52/221957852.db2.gz	XBOAYEDBNASBLC-MRXNPFEDSA-N	-1	0	372.377	2.839	50	0		FFAARM
COc1ccccc1[N-]S(=O)(=O)c1ccc(/C=C\C(=O)N2CCC2)cc1	ZINC000096920555	222139990	/nfs/dbraw/zinc/13/99/90/222139990.db2.gz	DZHVITOTNZMXLX-XFXZXTDPSA-N	-1	0	372.446	2.742	50	0		FFAARM
COc1ccc(-n2c(=O)c3[n-][nH]n(-c4ccc(F)c(Cl)c4)c=3c2=O)cc1	ZINC000097076900	222156493	/nfs/dbraw/zinc/15/64/93/222156493.db2.gz	JLCQVCJVEGUNCQ-GJZGRUSLSA-N	-1	0	374.759	2.986	50	0		FFAARM
Cc1nc(-n2[n-]c(-c3ccccc3)cc2=O)[nH]c(=O)c1Cc1ccccc1	ZINC000100916375	222256440	/nfs/dbraw/zinc/25/64/40/222256440.db2.gz	GLPVCQXKUXQMEF-UHFFFAOYSA-N	-1	0	358.401	2.815	50	0		FFAARM
COc1ccc(C(=O)/N=c2\sc3cccc(F)c3n2CC(=O)[O-])cc1	ZINC000100969441	222259278	/nfs/dbraw/zinc/25/92/78/222259278.db2.gz	ZQWZYMVGMZLYAP-ZPHPHTNESA-N	-1	0	360.366	2.676	50	0		FFAARM
CCOc1ccc(-n2c(=O)c3[n-][nH]n(Cc4cccc(C)c4)c=3c2=O)cc1	ZINC000101167840	222264684	/nfs/dbraw/zinc/26/46/84/222264684.db2.gz	APEKABPSHXGTFT-MSOLQXFVSA-N	-1	0	364.405	2.887	50	0		FFAARM
CCc1ccc(Cn2[nH][n-]c3c(=O)n(-c4ccc(F)cc4)c(=O)c2=3)cc1	ZINC000101167260	222264848	/nfs/dbraw/zinc/26/48/48/222264848.db2.gz	UUMNYXAVKLUMKN-IRXDYDNUSA-N	-1	0	352.369	2.882	50	0		FFAARM
COc1ccc(Nc2n[n-]c3nc4c(cnn4-c4ccccc4)c(=O)n23)cc1	ZINC000101230651	222265401	/nfs/dbraw/zinc/26/54/01/222265401.db2.gz	VKDYEYAYFHHZGJ-UHFFFAOYSA-N	-1	0	373.376	2.509	50	0		FFAARM
CC(=O)c1cccc(NC(=O)N2CCC[C@@H](c3ccn(CC(=O)[O-])n3)C2)c1	ZINC000426386476	263571342	/nfs/dbraw/zinc/57/13/42/263571342.db2.gz	URHRFMJIBYMUNZ-OAHLLOKOSA-N	-1	0	370.409	2.582	50	0		FFAARM
Cc1ccc(OCC(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)[O-])cc1	ZINC000000626134	506224485	/nfs/dbraw/zinc/22/44/85/506224485.db2.gz	XYEFUSIUQLPQHR-GOSISDBHSA-N	-1	0	352.390	2.667	50	0	biogenic	FFAARM
Cc1oc(-c2ccc3c(c2)OCCO3)cc1C(=O)N[C@@H](C(=O)[O-])C(C)C	ZINC000001105316	506249998	/nfs/dbraw/zinc/24/99/98/506249998.db2.gz	MTSNQZACVRBVTI-QGZVFWFLSA-N	-1	0	359.378	2.865	50	0		FFAARM
CCN1c2ccc(S(=O)(=O)[N-]c3cc(C)on3)c3cccc(c23)C1=O	ZINC000001463013	506264662	/nfs/dbraw/zinc/26/46/62/506264662.db2.gz	UFLWYPIEKIUVQQ-UHFFFAOYSA-N	-1	0	357.391	2.917	50	0		FFAARM
COc1ccc(-c2coc3cc(OCC(=O)[O-])ccc3c2=O)cc1OC	ZINC000002100141	506271689	/nfs/dbraw/zinc/27/16/89/506271689.db2.gz	HSTAXJOSSSHEQZ-UHFFFAOYSA-N	-1	0	356.330	2.941	50	0	biogenic	FFAARM
CCOc1ccc([C@@H]2[NH2+][C@H](C(=O)[O-])Cc3c4ccccc4[nH]c32)cc1O	ZINC000002145068	506272480	/nfs/dbraw/zinc/27/24/80/506272480.db2.gz	RFWQOKDGSGXSCY-YJBOKZPZSA-N	-1	0	352.390	2.961	50	0	biogenic	FFAARM
CC(C)(C)OC(=O)CCC[C@H](NC(=O)OCc1ccccc1)C(=O)[O-]	ZINC000002560797	506283123	/nfs/dbraw/zinc/28/31/23/506283123.db2.gz	OJUXORJKDRYZEV-AWEZNQCLSA-N	-1	0	351.399	2.878	50	0		FFAARM
COc1ccc(S(=O)(=O)[N-]c2ccn(Cc3ccccc3)n2)cc1OC	ZINC000002760434	506289627	/nfs/dbraw/zinc/28/96/27/506289627.db2.gz	ZDLSASTUKFYNCC-UHFFFAOYSA-N	-1	0	373.434	2.749	50	0		FFAARM
O=C([O-])c1ccc(-c2nnn(Cc3cccc(Br)c3)n2)cc1	ZINC000002861870	506298950	/nfs/dbraw/zinc/29/89/50/506298950.db2.gz	PIRUQGDYEAUFPB-UHFFFAOYSA-N	-1	0	359.183	2.849	50	0		FFAARM
CCOC(=O)N[C@]([N-]c1ccccc1F)(C(=O)OCC)C(F)(F)F	ZINC000003138058	506311489	/nfs/dbraw/zinc/31/14/89/506311489.db2.gz	TZRHBYAQEKENMX-CYBMUJFWSA-N	-1	0	352.284	2.805	50	0		FFAARM
O=C([O-])C1(c2ccccc2)CCN(S(=O)(=O)c2cccs2)CC1	ZINC000003444199	506330365	/nfs/dbraw/zinc/33/03/65/506330365.db2.gz	USLPKEZSWWUSPC-UHFFFAOYSA-N	-1	0	351.449	2.555	50	0		FFAARM
NC(=O)c1c(NC(=O)[C@@H]2CC=CC[C@H]2C(=O)[O-])sc2c1CCCCC2	ZINC000004019128	506355310	/nfs/dbraw/zinc/35/53/10/506355310.db2.gz	MAVGXAKPWNROPG-GHMZBOCLSA-N	-1	0	362.451	2.721	50	0		FFAARM
O=C([O-])CCC(=O)NCCNc1ncnc2scc(-c3ccccc3)c21	ZINC000004299582	506369358	/nfs/dbraw/zinc/36/93/58/506369358.db2.gz	OPXLHVGRNKJWAA-UHFFFAOYSA-N	-1	0	370.434	2.751	50	0		FFAARM
Cc1ccc(-c2nnc(CCC(=O)NCCc3ccccc3)c(=O)[n-]2)cc1	ZINC000034768766	506369533	/nfs/dbraw/zinc/36/95/33/506369533.db2.gz	NGFXWOAEVJUHNU-UHFFFAOYSA-N	-1	0	362.433	2.844	50	0		FFAARM
COc1ccc(CNc2ccc(N3CCOCC3)c(C(=O)[O-])c2)cc1OC	ZINC000004386320	506374320	/nfs/dbraw/zinc/37/43/20/506374320.db2.gz	IQNMJUIUQQRRJS-UHFFFAOYSA-N	-1	0	372.421	2.851	50	0		FFAARM
O=C(C[C@@H](C(=O)[O-])N1CCOCC1)Nc1ccc(Oc2ccccc2)cc1	ZINC000004487933	506377732	/nfs/dbraw/zinc/37/77/32/506377732.db2.gz	MEGODSAOAKOGED-SFHVURJKSA-N	-1	0	370.405	2.593	50	0		FFAARM
COc1cc([C@H]2N[C@H](C(=O)[O-])CS2)ccc1OC(=O)c1ccccc1	ZINC000004553710	506381483	/nfs/dbraw/zinc/38/14/83/506381483.db2.gz	NRPIROMOVISGKT-BBRMVZONSA-N	-1	0	359.403	2.703	50	0		FFAARM
COc1cc([C@H]2N[C@@H](C(=O)[O-])CS2)ccc1OC(=O)c1ccccc1	ZINC000004553712	506382489	/nfs/dbraw/zinc/38/24/89/506382489.db2.gz	NRPIROMOVISGKT-CJNGLKHVSA-N	-1	0	359.403	2.703	50	0		FFAARM
O=C([O-])CN(Cc1ccccc1F)S(=O)(=O)c1ccc(Cl)cc1	ZINC000004687055	506388645	/nfs/dbraw/zinc/38/86/45/506388645.db2.gz	GXQZXGIBZTUKLB-UHFFFAOYSA-N	-1	0	357.790	2.755	50	0		FFAARM
O=C([O-])[C@@H](Cc1ccccc1)NC(=O)N1CCc2c3ccccc3[nH]c2C1	ZINC000036569775	506406929	/nfs/dbraw/zinc/40/69/29/506406929.db2.gz	XMPSHBGQQYRLFX-GOSISDBHSA-N	-1	0	363.417	2.932	50	0		FFAARM
C[C@@H](NS(=O)(=O)c1ccccc1)c1n[n-]c(=S)n1-c1ccccc1	ZINC000005695674	506454726	/nfs/dbraw/zinc/45/47/26/506454726.db2.gz	LLQBBESLKILMFG-GFCCVEGCSA-N	-1	0	360.464	2.969	50	0		FFAARM
CC(C)=C[C@H]1[C@@H](C(=O)[N-]S(=O)(=O)c2ccc3c(c2)OCCO3)C1(C)C	ZINC000042267865	506613576	/nfs/dbraw/zinc/61/35/76/506613576.db2.gz	ZVTAAJWGRPQSJT-BBRMVZONSA-N	-1	0	365.451	2.501	50	0		FFAARM
CC(C)=C[C@@H]1[C@@H](C(=O)[N-]S(=O)(=O)c2ccc3c(c2)OCCO3)C1(C)C	ZINC000042267860	506614383	/nfs/dbraw/zinc/61/43/83/506614383.db2.gz	ZVTAAJWGRPQSJT-CJNGLKHVSA-N	-1	0	365.451	2.501	50	0		FFAARM
O=C([O-])c1cccc(NC(=O)c2ccccc2NC(=O)[C@@H]2CCCO2)c1	ZINC000008189548	506630563	/nfs/dbraw/zinc/63/05/63/506630563.db2.gz	FSYPIIBAPCWCHP-INIZCTEOSA-N	-1	0	354.362	2.755	50	0		FFAARM
O=C([O-])c1cc(-c2ccc3c(c2)OCO3)nc2c1cnn2Cc1ccncc1	ZINC000008391777	506647685	/nfs/dbraw/zinc/64/76/85/506647685.db2.gz	MTLXOLBTGVZGKX-UHFFFAOYSA-N	-1	0	374.356	2.969	50	0		FFAARM
Cc1ccc(C(=O)[O-])cc1NC(=O)[C@@H]1CCCN1C(=O)c1cccs1	ZINC000008708134	506661908	/nfs/dbraw/zinc/66/19/08/506661908.db2.gz	UTBHURUZFFQTEE-AWEZNQCLSA-N	-1	0	358.419	2.998	50	0		FFAARM
CCOC(=O)c1cccc([N-]S(=O)(=O)c2ccsc2C(=O)OC)c1	ZINC000009002282	506677514	/nfs/dbraw/zinc/67/75/14/506677514.db2.gz	XCVRCDDYZXGXGB-UHFFFAOYSA-N	-1	0	369.420	2.512	50	0		FFAARM
Cc1ccc(C2C(=O)C(=O)N(c3nnn[n-]3)[C@@H]2c2ccccc2F)cc1	ZINC000045928566	507046612	/nfs/dbraw/zinc/04/66/12/507046612.db2.gz	NCQHNMQFTSSIQL-OAHLLOKOSA-N	-1	0	351.341	2.704	50	0		FFAARM
CCCCn1c(=O)c(C2=NN[C@@H](c3ccccc3OC)C2)c([O-])[nH]c1=S	ZINC000015834795	507062475	/nfs/dbraw/zinc/06/24/75/507062475.db2.gz	BCFUEFMBHPGZGP-GFCCVEGCSA-N	-1	0	374.466	2.859	50	0		FFAARM
Cc1nc(=O)c2sc3nc(N4CCOCC4)c4c(c3c2[n-]1)CCCC4	ZINC000018165184	507143567	/nfs/dbraw/zinc/14/35/67/507143567.db2.gz	BTENNEYZZLSSNE-UHFFFAOYSA-N	-1	0	356.451	2.557	50	0		FFAARM
COc1cccc(-n2[nH][n-]c3c(=O)n(-c4cc(C)cc(C)c4)c(=O)c2=3)c1	ZINC000023125748	507331648	/nfs/dbraw/zinc/33/16/48/507331648.db2.gz	KDKDTASWZUTCBV-DLBZAZTESA-N	-1	0	350.378	2.810	50	0		FFAARM
O=C([O-])C[C@@H]1COCCN1Cc1ccccc1OCCc1ccccc1	ZINC000072172595	507770221	/nfs/dbraw/zinc/77/02/21/507770221.db2.gz	RLOTZQHXKSQQEX-LJQANCHMSA-N	-1	0	355.434	2.984	50	0		FFAARM
COc1ccc(S(=O)(=O)Nc2cccc(CC(=O)[O-])c2)cc1Cl	ZINC000072295201	507772798	/nfs/dbraw/zinc/77/27/98/507772798.db2.gz	MXIJZCIBAGKIDH-UHFFFAOYSA-N	-1	0	355.799	2.777	50	0		FFAARM
COc1ccc(S(=O)(=O)[N-]c2cnc3onc(C)c3c2)cc1Cl	ZINC000072301175	507773403	/nfs/dbraw/zinc/77/34/03/507773403.db2.gz	ZVRVFIAXUKDFRU-UHFFFAOYSA-N	-1	0	353.787	2.994	50	0		FFAARM
O=C([O-])C1(Oc2cccc(F)c2)CCN(c2ncnc3[nH]ccc32)CC1	ZINC000072468755	507794788	/nfs/dbraw/zinc/79/47/88/507794788.db2.gz	HXCIVCYEUSCCNZ-UHFFFAOYSA-N	-1	0	356.357	2.600	50	0		FFAARM
O=C([O-])[C@H]1c2nc[nH]c2CCN1C(=O)c1ccc(Oc2ccccc2)o1	ZINC000072470793	507795179	/nfs/dbraw/zinc/79/51/79/507795179.db2.gz	GRLCOTNXKRFEBJ-MRXNPFEDSA-N	-1	0	353.334	2.619	50	0		FFAARM
O=C([O-])C1(n2ccnc2)CCN(C(=O)c2csc3c2CCCC3)CC1	ZINC000072476893	507796013	/nfs/dbraw/zinc/79/60/13/507796013.db2.gz	DOLSUJCBTDJHNS-UHFFFAOYSA-N	-1	0	359.451	2.540	50	0		FFAARM
CCC[C@@]1(C(=O)[O-])CCCN(C(=O)c2cc(=O)[nH]c3ccc(C)cc32)C1	ZINC000091563121	507993161	/nfs/dbraw/zinc/99/31/61/507993161.db2.gz	JNWZTNYTKZJCEI-HXUWFJFHSA-N	-1	0	356.422	2.944	50	0		FFAARM
CSc1cccc(CN(C)C(=O)c2ccc(N3CC(=O)N=C3[O-])cc2)c1	ZINC000095375720	508179969	/nfs/dbraw/zinc/17/99/69/508179969.db2.gz	XOEZCQKSLAJWES-UHFFFAOYSA-N	-1	0	369.446	2.737	50	0		FFAARM
CN(CC(=O)N1CCC[C@@H](c2ccc(C(=O)[O-])cc2)C1)Cc1cccnc1	ZINC000095384263	508181902	/nfs/dbraw/zinc/18/19/02/508181902.db2.gz	MIRQVKPBWNQYDN-LJQANCHMSA-N	-1	0	367.449	2.618	50	0		FFAARM
CS(=O)(=O)c1cc(NC(=O)c2cc3ccccc3o2)cc(C(=O)[O-])c1	ZINC000095425593	508184941	/nfs/dbraw/zinc/18/49/41/508184941.db2.gz	XEUVEUHNIWOUGW-UHFFFAOYSA-N	-1	0	359.359	2.787	50	0		FFAARM
Cc1ccc([C@H](NC(=O)C2CCN(C(=O)C3CCCC3)CC2)C(=O)[O-])cc1	ZINC000095526302	508195549	/nfs/dbraw/zinc/19/55/49/508195549.db2.gz	GQRDBMQSTIIQLM-SFHVURJKSA-N	-1	0	372.465	2.666	50	0		FFAARM
COc1ccc(C(=O)N2CCS[C@H]3CCCC[C@@H]32)cc1OCC(=O)[O-]	ZINC000095989967	508200942	/nfs/dbraw/zinc/20/09/42/508200942.db2.gz	SPPXFQRKUYDBCN-BBRMVZONSA-N	-1	0	365.451	2.659	50	0		FFAARM
O=C([O-])CS[C@@H]1c2ccccc2C(=O)N1Cc1ccc2c(c1)OCO2	ZINC000085430413	508308575	/nfs/dbraw/zinc/30/85/75/508308575.db2.gz	SUOQMXIEYAHTTE-GOSISDBHSA-N	-1	0	357.387	2.888	50	0		FFAARM
CCC[C@H](NC(=O)c1cc(C2CC2)nc2ccc(OC)cc21)c1nnn[n-]1	ZINC000119609899	508828598	/nfs/dbraw/zinc/82/85/98/508828598.db2.gz	ZKDDYHUDUHYXGH-INIZCTEOSA-N	-1	0	366.425	2.905	50	0		FFAARM
O=C([O-])c1nc[nH]c1C(=O)N1CCC[C@H]1c1nc2cc(Cl)ccc2[nH]1	ZINC000216429012	509262015	/nfs/dbraw/zinc/26/20/15/509262015.db2.gz	KXAHMPQHYQJDFC-NSHDSACASA-N	-1	0	359.773	2.615	50	0		FFAARM
CN1Cc2ccc(NC(=O)C[C@@H](CC(=O)[O-])c3ccccc3F)cc2C1=O	ZINC000223077896	509328747	/nfs/dbraw/zinc/32/87/47/509328747.db2.gz	DOFAWSAIEZXXSM-ZDUSSCGKSA-N	-1	0	370.380	2.998	50	0		FFAARM
O=C([O-])c1ccc(S(=O)(=O)N[C@@H]2CCCC[C@@H]2C(F)(F)F)c(F)c1	ZINC000225436547	509372898	/nfs/dbraw/zinc/37/28/98/509372898.db2.gz	XFUCACKIMWFIBN-GXSJLCMTSA-N	-1	0	369.336	2.923	50	0		FFAARM
Cc1[nH]c2ccccc2c(=O)c1C[C@@H](C(=O)[O-])C(=O)Nc1ccccc1	ZINC000227163496	509406529	/nfs/dbraw/zinc/40/65/29/509406529.db2.gz	CRQFTWGSFJQOEZ-MRXNPFEDSA-N	-1	0	350.374	2.719	50	0		FFAARM
CC(C)COc1cn(-c2ccccc2)nc1C(=O)N1CCC[C@@H]1C(=O)[O-]	ZINC000236705342	509484822	/nfs/dbraw/zinc/48/48/22/509484822.db2.gz	FFGZJERAAXSKJV-OAHLLOKOSA-N	-1	0	357.410	2.596	50	0		FFAARM
Cc1ccc(F)c(S(=O)(=O)[N-]c2ccccc2SCC(N)=O)c1	ZINC000170617455	509681355	/nfs/dbraw/zinc/68/13/55/509681355.db2.gz	YYCNOMXPOXDWAZ-UHFFFAOYSA-N	-1	0	354.428	2.512	50	0		FFAARM
C[C@@]1(C(=O)[O-])CCN(C(=O)c2[nH]c3ccccc3c2Br)C1	ZINC000237655467	509703080	/nfs/dbraw/zinc/70/30/80/509703080.db2.gz	CVMIPMCYEKAWBP-OAHLLOKOSA-N	-1	0	351.200	2.867	50	0		FFAARM
Cc1noc(-c2ccc(C(=O)N3Cc4ccccc4C[C@@H]3C(=O)[O-])cc2)n1	ZINC000237745549	509726032	/nfs/dbraw/zinc/72/60/32/509726032.db2.gz	WOTCTAMLQZLILK-QGZVFWFLSA-N	-1	0	363.373	2.697	50	0		FFAARM
Cc1nn(-c2ccccc2)c(C)c1/C=C/C(=O)N1CC[C@](C)(C(=O)[O-])C1	ZINC000237825569	509743002	/nfs/dbraw/zinc/74/30/02/509743002.db2.gz	JJKDXGUXRIGTSF-XTXLJPNXSA-N	-1	0	353.422	2.826	50	0		FFAARM
Cc1ccc2nc(C)c(C(=O)N(CCC(=O)[O-])C[C@@H]3CCCO3)cc2c1	ZINC000237897704	509766077	/nfs/dbraw/zinc/76/60/77/509766077.db2.gz	UGMPHTRQAMDHEF-INIZCTEOSA-N	-1	0	356.422	2.948	50	0		FFAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)/C=C/c2ccc(N3CCCC3=O)cc2)C1	ZINC000237965432	509788184	/nfs/dbraw/zinc/78/81/84/509788184.db2.gz	SQMFFWBQRWCGBI-ZBZNSMLMSA-N	-1	0	370.449	2.930	50	0		FFAARM
O=C([O-])c1cc(C(=O)N[C@@H]2CCOc3ccccc32)n(-c2ccccc2)n1	ZINC000237989009	509792090	/nfs/dbraw/zinc/79/20/90/509792090.db2.gz	XXVCQAHKLYKYJT-OAHLLOKOSA-N	-1	0	363.373	2.824	50	0		FFAARM
O=C([O-])CCN(C(=O)c1cccc(Br)c1)C1CCOCC1	ZINC000238075119	509814164	/nfs/dbraw/zinc/81/41/64/509814164.db2.gz	RFTPXHUBRFVJMZ-UHFFFAOYSA-N	-1	0	356.216	2.545	50	0		FFAARM
O=C([O-])CCN(C[C@@H]1CCCO1)C(=O)/C=C/c1cccc2cccnc12	ZINC000238091032	509820067	/nfs/dbraw/zinc/82/00/67/509820067.db2.gz	LLNTUQXXGFKTJB-IJDCCNJMSA-N	-1	0	354.406	2.730	50	0		FFAARM
O=C([O-])CCN(Cc1cccc(F)c1F)C(=O)COc1ccccc1F	ZINC000238142947	509826793	/nfs/dbraw/zinc/82/67/93/509826793.db2.gz	ACSYKFBPFWRZPX-UHFFFAOYSA-N	-1	0	367.323	2.986	50	0		FFAARM
O=C([O-])C[C@@H]1CN(C(=O)c2ccc(-c3ccc(F)cc3)cc2F)CCO1	ZINC000238198664	509832057	/nfs/dbraw/zinc/83/20/57/509832057.db2.gz	NPERHMOJDHGNRJ-OAHLLOKOSA-N	-1	0	361.344	2.948	50	0		FFAARM
O=C([O-])[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1ccc2c(c1)NC(=O)CS2	ZINC000261657956	510015834	/nfs/dbraw/zinc/01/58/34/510015834.db2.gz	KJPKIKPTJFKACH-HONMWMINSA-N	-1	0	360.435	2.589	50	0		FFAARM
O=C([O-])c1ccc(C(=O)N2CCCC[C@@H]2CNC(=O)c2ccccc2)s1	ZINC000262716232	510382971	/nfs/dbraw/zinc/38/29/71/510382971.db2.gz	CRQZJOOHDYSPCU-CQSZACIVSA-N	-1	0	372.446	2.871	50	0		FFAARM
CC(C)Cn1cnc(S(=O)(=O)[N-]c2cnc(-c3cccc(O)c3)nc2)c1	ZINC000174946810	510399306	/nfs/dbraw/zinc/39/93/06/510399306.db2.gz	RLBANUGCVVEITK-UHFFFAOYSA-N	-1	0	373.438	2.503	50	0		FFAARM
Cc1cc(C(=O)N[C@H](CC(F)F)C(=O)[O-])c(C)cc1Br	ZINC000262926857	510480444	/nfs/dbraw/zinc/48/04/44/510480444.db2.gz	GQCGYYGVVRZZFX-SNVBAGLBSA-N	-1	0	350.159	2.904	50	0		FFAARM
COc1ccccc1N1CCN(C(=O)CCc2ccc(C(=O)[O-])cc2)CC1	ZINC000262996599	510513532	/nfs/dbraw/zinc/51/35/32/510513532.db2.gz	WLIBWDJOYDQYLD-UHFFFAOYSA-N	-1	0	368.433	2.675	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)[C@@H]2CC=CC[C@@H]2c2nc3ccccc3s2)CCO1	ZINC000263046914	510533974	/nfs/dbraw/zinc/53/39/74/510533974.db2.gz	WKCUTVWKQUVJGC-GUTXKFCHSA-N	-1	0	372.446	2.658	50	0		FFAARM
C[C@H](C(=O)[O-])N(C)C(=O)[C@H](c1cccc(Br)c1)N1CCCC1	ZINC000408513539	513084365	/nfs/dbraw/zinc/08/43/65/513084365.db2.gz	VCRSHTUKJFJQGO-RISCZKNCSA-N	-1	0	369.259	2.518	50	0		FFAARM
CC(=O)c1cccc(NC(=O)N2CCC[C@H](c3ccn(CC(=O)[O-])n3)C2)c1	ZINC000426386475	513922909	/nfs/dbraw/zinc/92/29/09/513922909.db2.gz	URHRFMJIBYMUNZ-HNNXBMFYSA-N	-1	0	370.409	2.582	50	0		FFAARM
CCc1cnc(C)nc1-c1cccc(C(=O)N[C@@H](C)c2n[n-]c(=N)s2)c1	ZINC000426518759	513966979	/nfs/dbraw/zinc/96/69/79/513966979.db2.gz	KDYIXNBMHUZZFX-JTQLQIEISA-N	-1	0	368.466	2.939	50	0		FFAARM
C[C@H]1Cc2cc(S(=O)(=O)[N-]c3nnc(C4CCC4)[nH]3)cc(Cl)c2O1	ZINC000508196984	514702624	/nfs/dbraw/zinc/70/26/24/514702624.db2.gz	XGXBFGHOSFBPII-QMMMGPOBSA-N	-1	0	368.846	2.850	50	0		FFAARM
CO[C@@H](CS(=O)(=O)[N-]c1c(F)cccc1CO)c1ccc(F)cc1	ZINC000530133655	517583629	/nfs/dbraw/zinc/58/36/29/517583629.db2.gz	HSVJDTONEFBEAS-HNNXBMFYSA-N	-1	0	357.378	2.587	50	0		FFAARM
CCOc1cc(C(=O)N[C@H]2CCC[C@@H](SC)C2)ccc1OCC(=O)[O-]	ZINC000268950098	520666894	/nfs/dbraw/zinc/66/68/94/520666894.db2.gz	PQILPCDQLDGXMG-UONOGXRCSA-N	-1	0	367.467	2.953	50	0		FFAARM
CCCn1ncc(C(=O)N2C[C@@H](c3cccc(OC)c3)[C@H](C(=O)[O-])C2)c1C	ZINC000091691568	521670635	/nfs/dbraw/zinc/67/06/35/521670635.db2.gz	XBPJOMATHHTGAC-ZWKOTPCHSA-N	-1	0	371.437	2.551	50	0		FFAARM
COc1cc(/C=C/C(=O)N2CCCC[C@@H]2C(=O)[O-])cc(Cl)c1OC	ZINC000272405071	521926707	/nfs/dbraw/zinc/92/67/07/521926707.db2.gz	KAMDWWBTXWJDNI-KTRBRXNASA-N	-1	0	353.802	2.836	50	0		FFAARM
C[C@@H]1C[C@H](C(=O)Nc2ccc(C(=O)Nc3ccccc3)cc2)O[C@H]1C(=O)[O-]	ZINC000630114353	522629995	/nfs/dbraw/zinc/62/99/95/522629995.db2.gz	MTQVXFBSJLCUFK-CSMYWGQOSA-N	-1	0	368.389	2.756	50	0		FFAARM
COCc1c(C(=O)N2CCO[C@H](CC(=O)[O-])C2)sc2cccc(F)c21	ZINC000262407467	522896370	/nfs/dbraw/zinc/89/63/70/522896370.db2.gz	BPJFJZIWMYTBFE-SNVBAGLBSA-N	-1	0	367.398	2.503	50	0		FFAARM
Cn1c(C(=O)N(CC(=O)[O-])C2CCOCC2)ccc1-c1ccc(F)cc1	ZINC000299752984	534677681	/nfs/dbraw/zinc/67/76/81/534677681.db2.gz	WIABYECCRNYBDH-UHFFFAOYSA-N	-1	0	360.385	2.537	50	0		FFAARM
CCc1cc(C(=O)N2C[C@@H](c3ccc(Cl)cc3)[C@H](C(=O)[O-])C2)n(C)n1	ZINC000634804342	523679833	/nfs/dbraw/zinc/67/98/33/523679833.db2.gz	DQLJOZSDAKSXKR-LSDHHAIUSA-N	-1	0	361.829	2.576	50	0		FFAARM
Cc1cc(C)c2nc(C3CC3)cc(C(=O)N3CCO[C@@H](C(=O)[O-])C3)c2c1	ZINC000178281116	524352188	/nfs/dbraw/zinc/35/21/88/524352188.db2.gz	PACYRTAGDRZRIV-QGZVFWFLSA-N	-1	0	354.406	2.655	50	0		FFAARM
Cc1cc(C(=O)N2CCOC[C@@H]2C(=O)[O-])c(C)n1[C@@H](C)c1ccccc1	ZINC000262560620	526255067	/nfs/dbraw/zinc/25/50/67/526255067.db2.gz	YHYBMNGDIOMSJZ-KBXCAEBGSA-N	-1	0	356.422	2.640	50	0		FFAARM
O=C([O-])c1cccc(NC(=O)CCCc2nc(-c3cccnc3)no2)c1	ZINC000020894475	526391326	/nfs/dbraw/zinc/39/13/26/526391326.db2.gz	BTCQHWLGRQWMMG-UHFFFAOYSA-N	-1	0	352.350	2.791	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)C[C@H]1CCOC1)c1cccc(Br)c1	ZINC000299753902	527624451	/nfs/dbraw/zinc/62/44/51/527624451.db2.gz	ZSJITYGKWVAYCY-ZWNOBZJWSA-N	-1	0	356.216	2.508	50	0		FFAARM
Cc1ccc(N(Cc2nn3c([n-]2)nc(C)cc3=O)C(=O)c2ccccc2)cc1	ZINC000101583095	570821166	/nfs/dbraw/zinc/82/11/66/570821166.db2.gz	LIEMBTNNLGOFMW-UHFFFAOYSA-N	-1	0	373.416	2.881	50	0		FFAARM
O=C(CSc1nc(=O)cc([O-])n1C1CCCC1)Nc1ccc(F)cc1	ZINC000102137565	570827227	/nfs/dbraw/zinc/82/72/27/570827227.db2.gz	PTWSWYLNVHTPHO-UHFFFAOYSA-N	-1	0	363.414	2.934	50	0		FFAARM
COc1ccc([N-]S(=O)(=O)c2cc(C(=O)N3CCCC3)cs2)cc1	ZINC000045961544	570917064	/nfs/dbraw/zinc/91/70/64/570917064.db2.gz	GYFIUMRRBFMZCW-UHFFFAOYSA-N	-1	0	366.464	2.794	50	0		FFAARM
O=C([O-])[C@@H]1CCCN(C(=O)C2(c3ccc(Cl)cc3)CCOCC2)C1	ZINC000109621834	570928877	/nfs/dbraw/zinc/92/88/77/570928877.db2.gz	JUBPLWMIPAMFQV-CYBMUJFWSA-N	-1	0	351.830	2.711	50	0		FFAARM
COc1ccc(OCC(=O)NN=C(CCC(=O)[O-])c2cccs2)cc1	ZINC000254904404	729627244	/nfs/dbraw/zinc/62/72/44/729627244.db2.gz	MQVVRKGQFCHGHE-UHFFFAOYSA-N	-1	0	362.407	2.521	50	0		FFAARM
COc1ccc(S(=O)(=O)[N-]c2c(C)nc(OC)nc2C)cc1Cl	ZINC000585436105	845951700	/nfs/dbraw/zinc/95/17/00/845951700.db2.gz	RRHJEDANQXMFGU-UHFFFAOYSA-N	-1	0	357.819	2.565	50	0		FFAARM
O=C(NC[C@H]1CC[C@H](C(=O)[O-])CC1)c1cc(-c2ccc3c(c2)CCO3)n[nH]1	ZINC000952963611	1011013535	/nfs/dbraw/zinc/01/35/35/1011013535.db2.gz	CJKVJROMWLHMEJ-JOCQHMNTSA-N	-1	0	369.421	2.632	50	0		FFAARM
CC(C)c1ccc(C(=O)N2CC[C@@H](Cc3ccc(C(=O)[O-])cc3)C2)c(=O)[nH]1	ZINC000072447184	1019898745	/nfs/dbraw/zinc/89/87/45/1019898745.db2.gz	ODJPXMOIOYBYRK-HNNXBMFYSA-N	-1	0	368.433	2.901	50	0		FFAARM
C[C@@H]1Oc2ccccc2O[C@H]1C(=O)N1CC[C@@H](C(=O)[O-])c2ccccc21	ZINC000669436706	1027936171	/nfs/dbraw/zinc/93/61/71/1027936171.db2.gz	COBKYMWYZQRLAE-WPKBUWHJSA-N	-1	0	353.374	2.820	50	0		FFAARM
O=C([O-])c1cc(O)cc(C(=O)N2CCC([C@@H](O)c3cccs3)CC2)c1	ZINC001506399229	1059492252	/nfs/dbraw/zinc/49/22/52/1059492252.db2.gz	KYUGGLFPSPUSNM-MRXNPFEDSA-N	-1	0	361.419	2.738	50	0		FFAARM
NC(=O)c1c2c(sc1NC(=O)[C@@H]1CCCC[C@H]1C(=O)[O-])CCCC2	ZINC000000355782	219305076	/nfs/dbraw/zinc/30/50/76/219305076.db2.gz	OFSGNJCEUBTMGV-NXEZZACHSA-N	-1	0	350.440	2.555	50	0		FFAARM
Cc1cc([N-]S(=O)(=O)c2ccc(NC(=O)C(C)(C)C)cc2)nc(C)n1	ZINC000000790545	219321469	/nfs/dbraw/zinc/32/14/69/219321469.db2.gz	FXQBNYTXHNGQKY-UHFFFAOYSA-N	-1	0	362.455	2.879	50	0		FFAARM
O=C([O-])[C@@H]1Cn2c(nc3c(c2=O)C2(CCCC2)Cc2ccccc2-3)S1	ZINC000000912148	219340465	/nfs/dbraw/zinc/34/04/65/219340465.db2.gz	YZNOCZYSARSFSL-ZDUSSCGKSA-N	-1	0	354.431	2.837	50	0	biogenic	FFAARM
COc1ccc2nc(N3C(=O)c4ccc(C(=O)[O-])cc4C3=O)sc2c1	ZINC000001064074	219361440	/nfs/dbraw/zinc/36/14/40/219361440.db2.gz	DSXWBBOKVNLBRT-UHFFFAOYSA-N	-1	0	354.343	2.804	50	0		FFAARM
O=C([O-])c1cccc(NC(=O)c2cccc(NC(=O)[C@@H]3CCCO3)c2)c1	ZINC000001059298	219360364	/nfs/dbraw/zinc/36/03/64/219360364.db2.gz	JPFPIKVARSCUCV-INIZCTEOSA-N	-1	0	354.362	2.755	50	0		FFAARM
CC[C@]1(c2ccccc2)C(=O)[N-]C(=O)N(C(=O)c2ccccc2Cl)C1=O	ZINC000001214362	219390190	/nfs/dbraw/zinc/39/01/90/219390190.db2.gz	JHPRLOSLYKIZRC-IBGZPJMESA-N	-1	0	370.792	2.907	50	0		FFAARM
Cc1coc2cc3oc(=O)c(CCC(=O)N(C)CC(=O)[O-])c(C)c3cc12	ZINC000002135639	219428951	/nfs/dbraw/zinc/42/89/51/219428951.db2.gz	MCCZZFKAFHKYRW-UHFFFAOYSA-N	-1	0	357.362	2.632	50	0	biogenic	FFAARM
O=C([O-])CC[C@@H](CNS(=O)(=O)c1ccc(Cl)cc1)C(F)(F)F	ZINC000002451277	219445655	/nfs/dbraw/zinc/44/56/55/219445655.db2.gz	VKHJEEXMUYSYLW-QMMMGPOBSA-N	-1	0	359.753	2.662	50	0		FFAARM
CC[C@H](C)[C@H](NC(=O)c1ccc(CN2C[C@H](C)O[C@@H](C)C2)cc1)C(=O)[O-]	ZINC000236990693	222903820	/nfs/dbraw/zinc/90/38/20/222903820.db2.gz	LYYQMWIQKAKXBA-XSWJXKHESA-N	-1	0	362.470	2.525	50	0		FFAARM
Cc1cc(C(=O)N2CCO[C@@H](C(=O)[O-])C2)c(C)n1[C@H](C)c1ccccc1	ZINC000237767554	222911418	/nfs/dbraw/zinc/91/14/18/222911418.db2.gz	OPYIERXDAYTHAS-RDTXWAMCSA-N	-1	0	356.422	2.640	50	0		FFAARM
O=C([O-])C1(c2ccccc2)CCN(C(=O)C[C@@H](O)c2cccc(F)c2)CC1	ZINC000238105517	222913285	/nfs/dbraw/zinc/91/32/85/222913285.db2.gz	NLTLXSJUBAHEJA-GOSISDBHSA-N	-1	0	371.408	2.894	50	0		FFAARM
Cc1noc(C)c1COc1cccc(C(=O)N2CCCC[C@@H]2C(=O)[O-])c1	ZINC000237640518	222908793	/nfs/dbraw/zinc/90/87/93/222908793.db2.gz	NOHAQMGOMLDNSG-QGZVFWFLSA-N	-1	0	358.394	2.950	50	0		FFAARM
COc1ccc(-c2n[nH]cc2CNC(=O)[C@@H](C(=O)[O-])C2CCCCC2)cc1	ZINC000240228142	222917924	/nfs/dbraw/zinc/91/79/24/222917924.db2.gz	KGQXSAUALZCGMK-KRWDZBQOSA-N	-1	0	371.437	2.983	50	0		FFAARM
COc1ccc(-c2n[nH]cc2CNC(=O)[C@H](C(=O)[O-])C2CCCCC2)cc1	ZINC000240228143	222918146	/nfs/dbraw/zinc/91/81/46/222918146.db2.gz	KGQXSAUALZCGMK-QGZVFWFLSA-N	-1	0	371.437	2.983	50	0		FFAARM
CCOc1ccc([C@H](CC(=O)[O-])NC(=O)COc2ccccc2OC)cc1	ZINC000003624788	219522824	/nfs/dbraw/zinc/52/28/24/219522824.db2.gz	ZFULXTAMGYPNRP-INIZCTEOSA-N	-1	0	373.405	2.805	50	0		FFAARM
COc1cc([C@H]2[C@@H](C(=O)[O-])c3ccccc3C(=O)N2C)cc(OC)c1OC	ZINC000004563631	219586906	/nfs/dbraw/zinc/58/69/06/219586906.db2.gz	HZWXNYYVVCDQFJ-IRXDYDNUSA-N	-1	0	371.389	2.708	50	0		FFAARM
O=C([O-])[C@@H]1CCCN1C(=O)c1csc(-c2cnn(-c3ccccc3)c2)n1	ZINC000299745647	223079428	/nfs/dbraw/zinc/07/94/28/223079428.db2.gz	RPKOLNLBHPVNBZ-HNNXBMFYSA-N	-1	0	368.418	2.685	50	0		FFAARM
O=C([O-])CCCNS(=O)(=O)c1ccc(Br)c2ccccc21	ZINC000012290923	219975987	/nfs/dbraw/zinc/97/59/87/219975987.db2.gz	UBEKVGFVLKRZCY-UHFFFAOYSA-N	-1	0	372.240	2.745	50	0		FFAARM
CCOc1ccc(Nc2nc(=O)c(Cc3ccc(OC)cc3)n[n-]2)cc1	ZINC000012514347	220001544	/nfs/dbraw/zinc/00/15/44/220001544.db2.gz	HRKOYSGZKYQVRB-UHFFFAOYSA-N	-1	0	352.394	2.907	50	0		FFAARM
O=c1c2ccccc2[n-]c(=S)n1C[C@H]1CN(Cc2ccccc2)CCO1	ZINC000012541002	220004325	/nfs/dbraw/zinc/00/43/25/220004325.db2.gz	LVFLVLIPAYVHNB-MRXNPFEDSA-N	-1	0	367.474	2.960	50	0		FFAARM
O=C([O-])c1cccc(OCC(=O)Nc2ccc(N3CCCC3=O)cc2)c1	ZINC000012852239	220036066	/nfs/dbraw/zinc/03/60/66/220036066.db2.gz	MNDWEZVILBBEGL-UHFFFAOYSA-N	-1	0	354.362	2.529	50	0		FFAARM
CCNC(=O)c1cccc([N-]S(=O)(=O)c2ccc(F)c(F)c2F)c1	ZINC000013041642	220056671	/nfs/dbraw/zinc/05/66/71/220056671.db2.gz	OUIJOYMMJMJRKB-UHFFFAOYSA-N	-1	0	358.341	2.654	50	0		FFAARM
Cc1ccccc1CNC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)[O-]	ZINC000013237099	220061837	/nfs/dbraw/zinc/06/18/37/220061837.db2.gz	ZZGZVCOWJDRVRD-GOSISDBHSA-N	-1	0	351.406	2.971	50	0		FFAARM
Cc1ccc(CNC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)[O-])cc1	ZINC000013235036	220062503	/nfs/dbraw/zinc/06/25/03/220062503.db2.gz	MDFHEEVKXVMNJK-SFHVURJKSA-N	-1	0	351.406	2.971	50	0		FFAARM
COc1ccc(OC)c([C@@H](C)NC(=O)COc2ccc(C(=O)[O-])cc2)c1	ZINC000013413693	220066904	/nfs/dbraw/zinc/06/69/04/220066904.db2.gz	PJTZNUTURASZCY-GFCCVEGCSA-N	-1	0	359.378	2.658	50	0		FFAARM
CCCCCCn1c(=O)cc([O-])nc1SCC(=O)NCc1ccco1	ZINC000013957266	220099394	/nfs/dbraw/zinc/09/93/94/220099394.db2.gz	UIFPVZVTSSGCKY-UHFFFAOYSA-N	-1	0	365.455	2.531	50	0		FFAARM
CNC(=O)c1ccccc1[N-]S(=O)(=O)c1ccc(OC(F)(F)F)cc1	ZINC000014869519	220133619	/nfs/dbraw/zinc/13/36/19/220133619.db2.gz	FRRSYZSGEADKGT-UHFFFAOYSA-N	-1	0	374.340	2.746	50	0		FFAARM
Cc1ccc(S(C)(=O)=O)cc1[N-]S(=O)(=O)c1ccc(Cl)s1	ZINC000014867695	220133846	/nfs/dbraw/zinc/13/38/46/220133846.db2.gz	QQFWXUQHRAJTIS-UHFFFAOYSA-N	-1	0	365.885	2.914	50	0		FFAARM
CC[C@H]1CCCCN1C(=O)CSC1=Nc2ccccc2S(=O)(=O)[N-]1	ZINC000015826910	220166510	/nfs/dbraw/zinc/16/65/10/220166510.db2.gz	BTKKQEVPVHXKQT-LBPRGKRZSA-N	-1	0	367.496	2.681	50	0		FFAARM
Cc1cc(C)cc(N2C(=O)C[C@H](Sc3ncccc3C(=O)[O-])C2=O)c1	ZINC000017877399	220218849	/nfs/dbraw/zinc/21/88/49/220218849.db2.gz	WUQLIUGUODUZDO-AWEZNQCLSA-N	-1	0	356.403	2.821	50	0		FFAARM
O=c1[n-]c(SCc2ccccc2)ncc1S(=O)(=O)c1ccccc1	ZINC000018204421	220227605	/nfs/dbraw/zinc/22/76/05/220227605.db2.gz	RFMYKGSDCMAGEZ-UHFFFAOYSA-N	-1	0	358.444	2.895	50	0		FFAARM
Cn1ncc(C(=O)[O-])c1C(=O)Nc1ccc(Br)cc1Cl	ZINC000020615260	220335947	/nfs/dbraw/zinc/33/59/47/220335947.db2.gz	DMGUHADJJMKXHI-UHFFFAOYSA-N	-1	0	358.579	2.787	50	0		FFAARM
COc1ccc(-c2noc(CN3[C@@H]4CCCC[C@@H]4C[C@H]3C(=O)[O-])n2)cc1	ZINC000294297819	533204190	/nfs/dbraw/zinc/20/41/90/533204190.db2.gz	WBMRMVTXYPCSOD-BMFZPTHFSA-N	-1	0	357.410	2.963	50	0		FFAARM
COc1ccc(S(=O)(=O)[N-]C(=O)[C@H]2[C@@H](C=C(C)C)C2(C)C)cc1OC	ZINC000042295052	220938192	/nfs/dbraw/zinc/93/81/92/220938192.db2.gz	WVMXLKXRMGDETI-CZUORRHYSA-N	-1	0	367.467	2.747	50	0		FFAARM
O=S(=O)([N-]c1ccc(F)cc1OCCO)c1ccc(Cl)cc1F	ZINC000048286252	221005125	/nfs/dbraw/zinc/00/51/25/221005125.db2.gz	SGSXNGSZKDULTH-UHFFFAOYSA-N	-1	0	363.769	2.790	50	0		FFAARM
CCn1c2ccsc2c([O-])c(C(=O)Nc2ccc3c(c2)OCCO3)c1=O	ZINC000049409524	221021822	/nfs/dbraw/zinc/02/18/22/221021822.db2.gz	MUTQNVHOJXVLNO-UHFFFAOYSA-N	-1	0	372.402	2.812	50	0		FFAARM
O=C(CSc1nc(=O)c2sccc2[n-]1)Nc1ccc(F)c(F)c1	ZINC000051317221	221034613	/nfs/dbraw/zinc/03/46/13/221034613.db2.gz	NDBYJRZRRCYBHF-UHFFFAOYSA-N	-1	0	353.375	2.994	50	0		FFAARM
CCNC(=O)c1ccc(Cl)cc1NC(=O)[C@@H]1CC=CC[C@H]1C(=O)[O-]	ZINC000055150237	221060410	/nfs/dbraw/zinc/06/04/10/221060410.db2.gz	SAKJFVXUXIJFAP-VXGBXAGGSA-N	-1	0	350.802	2.695	50	0		FFAARM
CC(=O)c1cc2c(cc1NC(=O)C[C@H](C(=O)[O-])c1ccccc1)OCO2	ZINC000054500225	221054417	/nfs/dbraw/zinc/05/44/17/221054417.db2.gz	SIICHCQKEXMANP-AWEZNQCLSA-N	-1	0	355.346	2.815	50	0		FFAARM
COC(=O)c1ccccc1S(=O)(=O)[N-]c1cc(F)c(OC)c(F)c1	ZINC000055682794	221073904	/nfs/dbraw/zinc/07/39/04/221073904.db2.gz	FZBOFBZQBWTIMC-UHFFFAOYSA-N	-1	0	357.334	2.561	50	0		FFAARM
COc1ccc(C)cc1CN(C)C(=O)c1ccccc1[N-]S(C)(=O)=O	ZINC000057996791	221096225	/nfs/dbraw/zinc/09/62/25/221096225.db2.gz	LPGSUDCRFDWVCX-UHFFFAOYSA-N	-1	0	362.451	2.647	50	0		FFAARM
Cc1ccc(NS(=O)(=O)c2ccc(OCC(=O)[O-])c(C)c2)cc1F	ZINC000058368501	221115849	/nfs/dbraw/zinc/11/58/49/221115849.db2.gz	BRTLEZIKBZUWLK-UHFFFAOYSA-N	-1	0	353.371	2.707	50	0		FFAARM
CCc1ccc(C(=O)[O-])cc1S(=O)(=O)N1CCc2cc(OC)ccc21	ZINC000058494665	221120631	/nfs/dbraw/zinc/12/06/31/221120631.db2.gz	SVSVNLOEPPUOCR-UHFFFAOYSA-N	-1	0	361.419	2.707	50	0		FFAARM
CC[C@@H](C)N(Cc1ccsc1)C(=O)Cc1nn2c([n-]1)nc(C)cc2=O	ZINC000063848381	221144063	/nfs/dbraw/zinc/14/40/63/221144063.db2.gz	RNJCHCUIOQLIKO-GFCCVEGCSA-N	-1	0	359.455	2.570	50	0		FFAARM
COc1ccc([N-]S(=O)(=O)c2ccc(-c3nnc(C)o3)o2)cc1F	ZINC000065246206	221185694	/nfs/dbraw/zinc/18/56/94/221185694.db2.gz	BEVWAUNVDZIPGQ-UHFFFAOYSA-N	-1	0	353.331	2.587	50	0		FFAARM
O=C1NC[C@@H](c2ccccc2)Cc2[n-]c(-c3nc(-c4ccccn4)no3)nc21	ZINC000065432053	221218748	/nfs/dbraw/zinc/21/87/48/221218748.db2.gz	UHHZMKRRSNFNFY-ZDUSSCGKSA-N	-1	0	372.388	2.591	50	0		FFAARM
Cc1c(C(=O)[O-])sc2ncnc(N(C)Cc3noc(CC(C)C)n3)c12	ZINC000067642237	221264518	/nfs/dbraw/zinc/26/45/18/221264518.db2.gz	WTEODBFWHKCYKS-UHFFFAOYSA-N	-1	0	361.427	2.916	50	0		FFAARM
CC(C)(C)OC(=O)N1C[C@H](n2cc(-c3ccccc3)nn2)C[C@H]1C(=O)[O-]	ZINC000071257082	221336701	/nfs/dbraw/zinc/33/67/01/221336701.db2.gz	ADNVHPPFKNQHHE-HIFRSBDPSA-N	-1	0	358.398	2.580	50	0		FFAARM
COc1ccc(NC(=O)C2CCC2)c(NC(=O)[C@@H]2[C@H](C(=O)[O-])C2(C)C)c1	ZINC000071284125	221339245	/nfs/dbraw/zinc/33/92/45/221339245.db2.gz	MOJLNDNFKCVSHA-LSDHHAIUSA-N	-1	0	360.410	2.729	50	0		FFAARM
CC1(C)[C@H](C(=O)[O-])[C@H]1C(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1	ZINC000071288309	221340167	/nfs/dbraw/zinc/34/01/67/221340167.db2.gz	RTRMKBSREUZDMA-STQMWFEESA-N	-1	0	350.802	2.528	50	0		FFAARM
CN(C)c1ccc(-c2cc(C(=O)[O-])cc(S(=O)(=O)NC3CC3)c2)cc1	ZINC000071748550	221359967	/nfs/dbraw/zinc/35/99/67/221359967.db2.gz	GPKPBQXXFFZONQ-UHFFFAOYSA-N	-1	0	360.435	2.559	50	0		FFAARM
COc1ccccc1CN(C)c1nccc(-c2cc(C(=O)[O-])ccn2)n1	ZINC000071762743	221369635	/nfs/dbraw/zinc/36/96/35/221369635.db2.gz	QWBWTBZAOSCZHC-UHFFFAOYSA-N	-1	0	350.378	2.882	50	0		FFAARM
CSc1ccccc1C(=O)N1CCCn2nc(CCC(=O)[O-])cc2C1	ZINC000072429417	221519972	/nfs/dbraw/zinc/51/99/72/221519972.db2.gz	UKPQMPLABGHABG-UHFFFAOYSA-N	-1	0	359.451	2.668	50	0		FFAARM
COc1ccc(C)cc1S(=O)(=O)[N-]c1ccc2c(c1)CCC(=O)N2C	ZINC000009828255	132381415	/nfs/dbraw/zinc/38/14/15/132381415.db2.gz	LHUOZURANJXTQD-UHFFFAOYSA-N	-1	0	360.435	2.713	50	0		FFAARM
Cc1nn(C)cc1-c1cc(C(F)(F)F)nc(N2CCC(C(=O)[O-])CC2)n1	ZINC000002554407	132383744	/nfs/dbraw/zinc/38/37/44/132383744.db2.gz	LICIBPPTMBEYGT-UHFFFAOYSA-N	-1	0	369.347	2.505	50	0		FFAARM
Cc1oc(CN(C)C(=O)CCN2C(=O)CCc3ccccc32)cc1C(=O)[O-]	ZINC000299751748	136122232	/nfs/dbraw/zinc/12/22/32/136122232.db2.gz	ROHHYJQOLZJZPJ-UHFFFAOYSA-N	-1	0	370.405	2.614	50	0		FFAARM
O=C([O-])C1(NC(=O)CCNC(=O)c2ccc(F)cc2Cl)CCCCC1	ZINC000095350695	221850728	/nfs/dbraw/zinc/85/07/28/221850728.db2.gz	BQBFKOPUZDOGGA-UHFFFAOYSA-N	-1	0	370.808	2.503	50	0		FFAARM
O=C([O-])C1CCC(NC(=O)Cc2cc(Cl)c3c(c2)OCCCO3)CC1	ZINC000095970506	221983049	/nfs/dbraw/zinc/98/30/49/221983049.db2.gz	QNMLTLRDKJNXNW-UHFFFAOYSA-N	-1	0	367.829	2.803	50	0		FFAARM
Cc1nc(N2CCCC2)nc(C)c1[N-]S(=O)(=O)c1ccccc1F	ZINC000096098620	222022450	/nfs/dbraw/zinc/02/24/50/222022450.db2.gz	INDOIEGJCIUOPG-UHFFFAOYSA-N	-1	0	350.419	2.634	50	0		FFAARM
O=C(/C=C\c1ccc(N2CCCC2=O)cc1)NC1(C(=O)[O-])CCCCC1	ZINC000096297812	222113790	/nfs/dbraw/zinc/11/37/90/222113790.db2.gz	DNQSGCCJZVQADL-FLIBITNWSA-N	-1	0	356.422	2.730	50	0		FFAARM
CCc1ccc(-n2c(=O)c3[n-][nH]n(Cc4cccc(OC)c4)c=3c2=O)cc1	ZINC000101168035	222265737	/nfs/dbraw/zinc/26/57/37/222265737.db2.gz	FLHXHDCMVVSUNQ-MSOLQXFVSA-N	-1	0	364.405	2.751	50	0		FFAARM
CCOC(=O)c1ccc(NC(=O)c2c([O-])c3ccccc3n(C)c2=O)cc1	ZINC000100534682	222247146	/nfs/dbraw/zinc/24/71/46/222247146.db2.gz	XHSYHACTNCTGHJ-UHFFFAOYSA-N	-1	0	366.373	2.673	50	0		FFAARM
CCOc1ccc(NC(=O)c2c([O-])c3cccc4c3n(c2=O)CC4)cc1	ZINC000100621284	222248033	/nfs/dbraw/zinc/24/80/33/222248033.db2.gz	HQOUXTYTGFDYAC-UHFFFAOYSA-N	-1	0	350.374	2.914	50	0		FFAARM
CCOc1ccc(-n2c(=O)c3[n-][nH]n(Cc4cccc(C)c4)c=3c2=O)cc1	ZINC000101167838	222264633	/nfs/dbraw/zinc/26/46/33/222264633.db2.gz	APEKABPSHXGTFT-ROUUACIJSA-N	-1	0	364.405	2.887	50	0		FFAARM
Cc1nc2[n-]c(NC(=O)c3ccc(Cl)cc3Cl)nn2c(=O)c1Cl	ZINC000101414685	222274189	/nfs/dbraw/zinc/27/41/89/222274189.db2.gz	MONFYYPUOSWRQR-UHFFFAOYSA-N	-1	0	372.599	2.939	50	0		FFAARM
Cc1nc(C)c(S(=O)(=O)[N-]C(=O)[C@@H](C)OC2CCCCCC2)s1	ZINC000121743117	222521666	/nfs/dbraw/zinc/52/16/66/222521666.db2.gz	WACZVCHKSAOMFN-LLVKDONJSA-N	-1	0	360.501	2.693	50	0		FFAARM
O=C([N-]C1=NN=C(c2ccc(Br)cc2)CS1)C(F)(F)F	ZINC000001428759	506262223	/nfs/dbraw/zinc/26/22/23/506262223.db2.gz	VBQQAUCTQOSDHS-UHFFFAOYSA-N	-1	0	366.162	2.935	50	0		FFAARM
O=C([O-])COc1ccc(S(=O)(=O)Nc2ccc(F)cc2Cl)cc1	ZINC000032586129	506266868	/nfs/dbraw/zinc/26/68/68/506266868.db2.gz	SSGAFTVBWNRGRG-UHFFFAOYSA-N	-1	0	359.762	2.743	50	0		FFAARM
COC(=O)[C@]([N-]c1ccccc1F)(NC(=O)OC(C)C)C(F)(F)F	ZINC000002272569	506276130	/nfs/dbraw/zinc/27/61/30/506276130.db2.gz	LCOJADXEPHDQPB-ZDUSSCGKSA-N	-1	0	352.284	2.804	50	0		FFAARM
CCOC(=O)c1c2c(sc1NC(=O)/C=C/C(=O)[O-])CO[C@H](C(C)C)C2	ZINC000002355662	506277633	/nfs/dbraw/zinc/27/76/33/506277633.db2.gz	OSCOUEYRVLSPSU-QRGHLMKCSA-N	-1	0	367.423	2.601	50	0		FFAARM
Cc1cccc(C)c1NC(=O)c1sc2[nH]c(=O)c(C(=O)[O-])cc2c1N	ZINC000002343569	506277936	/nfs/dbraw/zinc/27/79/36/506277936.db2.gz	ZUCOPSGCNKSNET-UHFFFAOYSA-N	-1	0	357.391	2.739	50	0		FFAARM
O=C([O-])[C@@H]1CC(=O)CN1C(=O)OCC1c2ccccc2-c2ccccc21	ZINC000002385646	506278409	/nfs/dbraw/zinc/27/84/09/506278409.db2.gz	MDDIUNABQLYFNA-SFHVURJKSA-N	-1	0	351.358	2.664	50	0		FFAARM
Cc1nn(C)cc1S(=O)(=O)[N-]c1nc2ccc(OC(F)F)cc2s1	ZINC000002804060	506295238	/nfs/dbraw/zinc/29/52/38/506295238.db2.gz	ZQFODVHKKXJDSL-UHFFFAOYSA-N	-1	0	374.394	2.740	50	0		FFAARM
CC(=O)Nc1cc(C(=O)[O-])ccc1S(=O)(=O)c1ccc(Cl)cc1	ZINC000003018303	506307597	/nfs/dbraw/zinc/30/75/97/506307597.db2.gz	NLIOLKVEJDGEKR-UHFFFAOYSA-N	-1	0	353.783	2.829	50	0		FFAARM
COc1cccc(NC(=O)c2ccccc2N(C)C(=O)CCC(=O)[O-])c1	ZINC000003282545	506318751	/nfs/dbraw/zinc/31/87/51/506318751.db2.gz	OFHIRORZOFMRIC-UHFFFAOYSA-N	-1	0	356.378	2.775	50	0		FFAARM
Cc1oc(-c2ccno2)cc1S(=O)(=O)[N-]c1ccc2c(c1)OCCO2	ZINC000032971348	506320347	/nfs/dbraw/zinc/32/03/47/506320347.db2.gz	YPBHCNJKSVGLNR-UHFFFAOYSA-N	-1	0	362.363	2.815	50	0		FFAARM
COc1ccc(-n2c(=O)c3[n-][nH]n(-c4ccc(C)cc4)c=3c2=O)cc1OC	ZINC000033114676	506337021	/nfs/dbraw/zinc/33/70/21/506337021.db2.gz	HEMYIGNNRKIKML-SJORKVTESA-N	-1	0	366.377	2.510	50	0		FFAARM
O=C([O-])[C@H]1CC=CC[C@H]1C(=O)NCCc1csc(-c2cccnc2)n1	ZINC000004167059	506364037	/nfs/dbraw/zinc/36/40/37/506364037.db2.gz	FHDIIOLXXLEGLF-CABCVRRESA-N	-1	0	357.435	2.531	50	0		FFAARM
O=C1N[C@]([N-]c2nccs2)(C(F)(F)F)C(=O)N1CCc1ccccc1	ZINC000004301870	506369908	/nfs/dbraw/zinc/36/99/08/506369908.db2.gz	QRSJJXZBGGJTJF-AWEZNQCLSA-N	-1	0	370.356	2.813	50	0		FFAARM
O=c1c2[n-][nH]n(Cc3ccccc3F)c=2c(=O)n1-c1ccc(F)c(F)c1	ZINC000004483761	506377757	/nfs/dbraw/zinc/37/77/57/506377757.db2.gz	QXDPHBZEKHPVHZ-CABCVRRESA-N	-1	0	360.295	2.597	50	0		FFAARM
O=C([O-])[C@H](NC(=O)COc1ccc(F)cc1)C12CC3CC(CC(C3)C1)C2	ZINC000004660929	506385916	/nfs/dbraw/zinc/38/59/16/506385916.db2.gz	JNQNLSSFEOEBJH-HLJROMEYSA-N	-1	0	361.413	2.990	50	0	biogenic	FFAARM
C[C@@H](C1CC1)N(C)S(=O)(=O)c1cc(C(=O)[O-])sc1Br	ZINC000036785292	506418309	/nfs/dbraw/zinc/41/83/09/506418309.db2.gz	PWQDKAKZLGDVBH-LURJTMIESA-N	-1	0	368.274	2.628	50	0		FFAARM
O=c1nc(Cn2cc(C(F)(F)F)cc(Cl)c2=O)[n-]c2ccsc21	ZINC000005179965	506426964	/nfs/dbraw/zinc/42/69/64/506426964.db2.gz	TWTAFJDRZVDJHL-UHFFFAOYSA-N	-1	0	361.732	2.867	50	0		FFAARM
COc1ccc(CN2C(=O)[C@@]([O-])(C(F)(F)F)N=C2c2ccccc2)cc1	ZINC000005324309	506435226	/nfs/dbraw/zinc/43/52/26/506435226.db2.gz	VHTJTDNSMZKGIV-QGZVFWFLSA-N	-1	0	364.323	2.735	50	0		FFAARM
COc1ccc(C)cc1S(=O)(=O)[N-]c1cccc(N2CCCC2=O)c1	ZINC000005329438	506435811	/nfs/dbraw/zinc/43/58/11/506435811.db2.gz	IOYRRYOXROEVPS-UHFFFAOYSA-N	-1	0	360.435	2.931	50	0		FFAARM
COc1ccc(S(=O)(=O)[N-]c2c(C)nn(C)c2C)cc1Br	ZINC000005602515	506449642	/nfs/dbraw/zinc/44/96/42/506449642.db2.gz	BRCXSYCZRVTGMK-UHFFFAOYSA-N	-1	0	374.260	2.609	50	0		FFAARM
O=C([O-])[C@@H]1C2CCC(CC2)[C@@H]1C(=O)N1CCN(CCc2ccccc2)CC1	ZINC000006742629	506501839	/nfs/dbraw/zinc/50/18/39/506501839.db2.gz	XIVKBHMAJIFYJK-GHBBCFCZSA-N	-1	0	370.493	2.510	50	0		FFAARM
CCOc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccc(F)cc4)c=3c2=O)cc1	ZINC000006770459	506505256	/nfs/dbraw/zinc/50/52/56/506505256.db2.gz	CBWKXJJKOMGWPP-IAGOWNOFSA-N	-1	0	368.368	2.718	50	0		FFAARM
CCOc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccccc4F)c=3c2=O)cc1	ZINC000006770450	506505491	/nfs/dbraw/zinc/50/54/91/506505491.db2.gz	XQXWODUDKCZOQL-DLBZAZTESA-N	-1	0	368.368	2.718	50	0		FFAARM
Cc1csc2nc(C)c(S(=O)(=O)[N-]c3ccc(C)c(F)c3)c(=O)n12	ZINC000006823569	506510713	/nfs/dbraw/zinc/51/07/13/506510713.db2.gz	IRLVYNOWGBMBLX-UHFFFAOYSA-N	-1	0	367.427	2.621	50	0		FFAARM
CC(C)(C)NS(=O)(=O)c1ccc(C(=O)[N-]c2c(F)cccc2F)o1	ZINC000041750779	506545740	/nfs/dbraw/zinc/54/57/40/506545740.db2.gz	XFPYEDJBXTUQLY-UHFFFAOYSA-N	-1	0	358.366	2.887	50	0		FFAARM
CC(=O)c1cccc(S(=O)(=O)[N-]c2ccccc2N2CCCC2=O)c1	ZINC000007726648	506585783	/nfs/dbraw/zinc/58/57/83/506585783.db2.gz	KGSQYNGEMYRRFM-UHFFFAOYSA-N	-1	0	358.419	2.817	50	0		FFAARM
O=C(NC[C@H]1CCCO1)c1ccccc1[N-]S(=O)(=O)Cc1ccccc1	ZINC000007728496	506586449	/nfs/dbraw/zinc/58/64/49/506586449.db2.gz	NRDYQUCAFULNBC-MRXNPFEDSA-N	-1	0	374.462	2.537	50	0		FFAARM
COC(=O)c1c(=O)c2ccccc2[n-]c1SCC(=O)NC1CCCCC1	ZINC000009300314	506688847	/nfs/dbraw/zinc/68/88/47/506688847.db2.gz	JMFLNNAYTMRAFM-UHFFFAOYSA-N	-1	0	374.462	2.856	50	0		FFAARM
O=C(NCc1ccncc1)c1ccc([N-]S(=O)(=O)c2cccs2)cc1	ZINC000010052262	506724557	/nfs/dbraw/zinc/72/45/57/506724557.db2.gz	MOEXLQJQXOFILG-UHFFFAOYSA-N	-1	0	373.459	2.874	50	0		FFAARM
O=C(CSc1nncc(=O)[n-]1)Nc1ccc(Cl)cc1C(F)(F)F	ZINC000011905431	506801919	/nfs/dbraw/zinc/80/19/19/506801919.db2.gz	SYVAEOZLBXOOCV-UHFFFAOYSA-N	-1	0	364.736	2.568	50	0		FFAARM
COC(=O)C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)[O-]	ZINC000044460329	506847693	/nfs/dbraw/zinc/84/76/93/506847693.db2.gz	HSOKCYGOTGVDHL-KRWDZBQOSA-N	-1	0	369.373	2.541	50	0		FFAARM
O=C([O-])[C@@H]1CCC(=O)N(Cc2ccccc2)[C@@H]1c1ccc2c(c1)OCO2	ZINC000012336760	506851691	/nfs/dbraw/zinc/85/16/91/506851691.db2.gz	QZLGYHOJUHNZKB-DNVCBOLYSA-N	-1	0	353.374	2.980	50	0		FFAARM
Cc1c(F)cccc1NS(=O)(=O)c1ccc2c(c1)NC(=O)[C@H](C)O2	ZINC000012372501	506855415	/nfs/dbraw/zinc/85/54/15/506855415.db2.gz	CMHHMHQZDVRLAZ-JTQLQIEISA-N	-1	0	350.371	2.654	50	0		FFAARM
CC(C)(C)C(=O)COC(=O)c1cc2ccccc2cc1[N-]S(C)(=O)=O	ZINC000012548447	506875647	/nfs/dbraw/zinc/87/56/47/506875647.db2.gz	GEDHKINKQUIKKI-UHFFFAOYSA-N	-1	0	363.435	2.983	50	0		FFAARM
O=C(Nc1ccc(N2CCCS2(=O)=O)cc1)c1ccc([O-])c(Cl)c1	ZINC000024927945	507448786	/nfs/dbraw/zinc/44/87/86/507448786.db2.gz	AOZWSXCQUNMACM-UHFFFAOYSA-N	-1	0	366.826	2.838	50	0		FFAARM
Cc1ccc([N-]S(C)(=O)=O)c(C(=O)NCc2ccccc2Cl)c1	ZINC000024964323	507452615	/nfs/dbraw/zinc/45/26/15/507452615.db2.gz	WBCSMWNPWYLRRX-UHFFFAOYSA-N	-1	0	352.843	2.950	50	0		FFAARM
Cc1nccn1CCCC(=O)N1CC[C@@H](Cc2cccc(C(=O)[O-])c2)C1	ZINC000072137220	507754678	/nfs/dbraw/zinc/75/46/78/507754678.db2.gz	UYGFYDRPWHSJLV-KRWDZBQOSA-N	-1	0	355.438	2.761	50	0		FFAARM
CCn1nc(C)c(C(=O)N2CC[C@H](Cc3cccc(C(=O)[O-])c3)C2)c1C	ZINC000072155874	507762566	/nfs/dbraw/zinc/76/25/66/507762566.db2.gz	ONLLUQYBBUZSEI-MRXNPFEDSA-N	-1	0	355.438	2.923	50	0		FFAARM
CCOc1ccc(-c2ccnc(N[C@H]3CCCC[C@@H]3O)n2)cc1C(=O)[O-]	ZINC000072411110	507785338	/nfs/dbraw/zinc/78/53/38/507785338.db2.gz	VXXARYPZXVVYHA-HOTGVXAUSA-N	-1	0	357.410	2.956	50	0		FFAARM
Cc1ccoc1C(=O)N1CCC(C(=O)[O-])(n2cnc3ccccc32)CC1	ZINC000072412064	507786457	/nfs/dbraw/zinc/78/64/57/507786457.db2.gz	DEBQHBUHXZBHQZ-UHFFFAOYSA-N	-1	0	353.378	2.654	50	0		FFAARM
Cc1nc(CN2CCC(C(=O)[O-])(n3ccc(-c4ccco4)n3)CC2)co1	ZINC000072426631	507788248	/nfs/dbraw/zinc/78/82/48/507788248.db2.gz	YAXCHERFHIPJFL-UHFFFAOYSA-N	-1	0	356.382	2.515	50	0		FFAARM
Cn1c2ccccc2c2cc(CC(=O)N3CCOC[C@@H]3CC(=O)[O-])ccc21	ZINC000072426310	507788385	/nfs/dbraw/zinc/78/83/85/507788385.db2.gz	UWUFSMTXGNCGJA-HNNXBMFYSA-N	-1	0	366.417	2.576	50	0		FFAARM
Cc1ccc(OC2(C(=O)[O-])CCN(C(=O)C[C@@H]3C=CCC3)CC2)c(C)n1	ZINC000072481226	507797534	/nfs/dbraw/zinc/79/75/34/507797534.db2.gz	LMKJMQGRNALTNM-MRXNPFEDSA-N	-1	0	358.438	2.879	50	0		FFAARM
CN(Cc1nc(=O)c2sccc2[n-]1)C(=O)c1nc(Cl)ccc1Cl	ZINC000030032073	507801432	/nfs/dbraw/zinc/80/14/32/507801432.db2.gz	IHENHOMORREVRX-UHFFFAOYSA-N	-1	0	369.233	2.959	50	0		FFAARM
CCn1cc(S(=O)(=O)Nc2cc(OC)ccc2Cl)cc1C(=O)[O-]	ZINC000089305637	507828162	/nfs/dbraw/zinc/82/81/62/507828162.db2.gz	KZGXGIOPWJXABG-UHFFFAOYSA-N	-1	0	358.803	2.669	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)c2cc(=O)c3ccccc3o2)C[C@H]1c1ccccc1	ZINC000091636305	507999051	/nfs/dbraw/zinc/99/90/51/507999051.db2.gz	UTLVKYIRCYUKFQ-JKSUJKDBSA-N	-1	0	363.369	2.733	50	0		FFAARM
CC1(C)Cc2c(cnn2-c2ccc(F)cc2)[C@@H](NC(=O)c2cc(=O)[nH][n-]2)C1	ZINC000091894968	508022408	/nfs/dbraw/zinc/02/24/08/508022408.db2.gz	DNNCQYIESBAHSI-HNNXBMFYSA-N	-1	0	369.400	2.884	50	0		FFAARM
COc1cc(C)c(S(=O)(=O)[N-]c2cnc(N3CCCC3)nc2)cc1C	ZINC000075162105	508086739	/nfs/dbraw/zinc/08/67/39/508086739.db2.gz	XQSNJBLELAXEBX-UHFFFAOYSA-N	-1	0	362.455	2.503	50	0		FFAARM
Cc1noc(C)c1N(C)S(=O)(=O)c1cc(C(=O)[O-])ccc1C(C)C	ZINC000080782072	508102833	/nfs/dbraw/zinc/10/28/33/508102833.db2.gz	RORMTKYPUDEHEH-UHFFFAOYSA-N	-1	0	352.412	2.938	50	0		FFAARM
C[C@H](NC(=O)c1nn(-c2ccccc2C(F)(F)F)cc1[O-])[C@@H]1CCCO1	ZINC000095356832	508175292	/nfs/dbraw/zinc/17/52/92/508175292.db2.gz	RDTARVLMQGKLPT-HZMBPMFUSA-N	-1	0	369.343	2.894	50	0		FFAARM
CCc1cc(C(=O)N2CCC[C@@H](c3ccc(C(=O)[O-])cc3)C2)cc(=O)[nH]1	ZINC000095372094	508178779	/nfs/dbraw/zinc/17/87/79/508178779.db2.gz	YCPRFZBLXWBOEX-OAHLLOKOSA-N	-1	0	354.406	2.655	50	0		FFAARM
C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N1CCC[C@H](c2nnn[n-]2)C1	ZINC000095432773	508185009	/nfs/dbraw/zinc/18/50/09/508185009.db2.gz	BOFLRDAYHMWEKU-KGLIPLIRSA-N	-1	0	357.458	2.671	50	0		FFAARM
CCOc1cccc2cc(C(=O)Nc3cccc(C(=O)[O-])c3O)c(=O)oc21	ZINC000095471146	508187815	/nfs/dbraw/zinc/18/78/15/508187815.db2.gz	NYXKPLNJIGEPJY-UHFFFAOYSA-N	-1	0	369.329	2.848	50	0		FFAARM
CCC1CCC(NC(=O)Cc2cc3ccccc3[nH]c2=O)(C(=O)[O-])CC1	ZINC000095989554	508200633	/nfs/dbraw/zinc/20/06/33/508200633.db2.gz	LHMLEIVYQSRUOZ-UHFFFAOYSA-N	-1	0	356.422	2.610	50	0		FFAARM
Cc1ccc(S(=O)(=O)[N-]c2cccc(Cl)c2S(C)(=O)=O)s1	ZINC000095995698	508200932	/nfs/dbraw/zinc/20/09/32/508200932.db2.gz	YJIPRPLOGNJUJX-UHFFFAOYSA-N	-1	0	365.885	2.914	50	0		FFAARM
C[C@H](C(F)(F)F)S(=O)(=O)[N-]c1ccc(OCC(F)(F)F)nc1	ZINC000096003485	508202447	/nfs/dbraw/zinc/20/24/47/508202447.db2.gz	QRQCJAQIQVSJBM-ZCFIWIBFSA-N	-1	0	352.256	2.715	50	0		FFAARM
Cc1cc(C(=O)N2CCC[C@@H]2c2n[nH]c(=O)[n-]2)c2ccc(C)c(C)c2n1	ZINC000077319172	508299656	/nfs/dbraw/zinc/29/96/56/508299656.db2.gz	XSLLAAJXVWGGOD-OAHLLOKOSA-N	-1	0	351.410	2.549	50	0		FFAARM
Cc1cc(C)n(C[C@H](C)Nc2nccc(-c3cc(C(=O)[O-])ccn3)n2)n1	ZINC000077472617	508320711	/nfs/dbraw/zinc/32/07/11/508320711.db2.gz	RYZWWJBLYHXZDV-LBPRGKRZSA-N	-1	0	352.398	2.551	50	0		FFAARM
COc1ccc(F)cc1S(=O)(=O)NC[C@H]1CCCN1c1ccccc1	ZINC000211121647	509240518	/nfs/dbraw/zinc/24/05/18/509240518.db2.gz	KULCTUJVCZOOPN-MRXNPFEDSA-N	-1	0	364.442	2.782	50	0		FFAARM
COc1ccc(C[N@@H+](Cc2ccncc2)C[C@@H]2CCCO2)cc1C(=O)[O-]	ZINC000216143346	509258059	/nfs/dbraw/zinc/25/80/59/509258059.db2.gz	MHNUAYWXNSGHGZ-KRWDZBQOSA-N	-1	0	356.422	2.970	50	0		FFAARM
CCN(CC(=O)Nc1c(F)cccc1F)C(=O)c1ccc(C(=O)[O-])s1	ZINC000236904743	509529873	/nfs/dbraw/zinc/52/98/73/509529873.db2.gz	XJSGYXICFUCRAY-UHFFFAOYSA-N	-1	0	368.361	2.825	50	0		FFAARM
C[C@@H](Oc1ccccc1Br)C(=O)N1CCC(C(=O)[O-])CC1	ZINC000237538726	509673257	/nfs/dbraw/zinc/67/32/57/509673257.db2.gz	HVJOPQMLVOMJSW-SNVBAGLBSA-N	-1	0	356.216	2.540	50	0		FFAARM
Cc1ccccc1[C@H](CC(=O)[O-])NC(=O)[C@H]1CC(=O)Nc2cc(F)ccc21	ZINC000237657783	509702577	/nfs/dbraw/zinc/70/25/77/509702577.db2.gz	FGHCEKCYERRBTO-RDJZCZTQSA-N	-1	0	370.380	2.892	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)C[C@H]1CCCO1)c1ccc(Br)cc1	ZINC000237937257	509778090	/nfs/dbraw/zinc/77/80/90/509778090.db2.gz	WZSWPTNEPDCJCV-OLZOCXBDSA-N	-1	0	356.216	2.650	50	0		FFAARM
O=C([O-])C1(NC(=O)c2ccc(=O)n(Cc3ccccc3Cl)c2)CCCC1	ZINC000237970845	509789068	/nfs/dbraw/zinc/78/90/68/509789068.db2.gz	LHDNZZPUQNNEBH-UHFFFAOYSA-N	-1	0	374.824	2.677	50	0		FFAARM
O=C([O-])[C@H]1Cc2ccccc2CN1C(=O)C[C@H]1OCCc2ccccc21	ZINC000238030137	509803883	/nfs/dbraw/zinc/80/38/83/509803883.db2.gz	QKKHGQNSRYDBHG-RTBURBONSA-N	-1	0	351.402	2.729	50	0		FFAARM
O=C([O-])CCN(C[C@H]1CCCO1)C(=O)/C=C/c1cccc2cccnc12	ZINC000238104986	509821604	/nfs/dbraw/zinc/82/16/04/509821604.db2.gz	LLNTUQXXGFKTJB-KBOKABMXSA-N	-1	0	354.406	2.730	50	0		FFAARM
Cc1cc(C(=O)N2CC[C@@H](C(=O)[O-])C2)c2cc(Br)ccc2n1	ZINC000178257227	510512470	/nfs/dbraw/zinc/51/24/70/510512470.db2.gz	DJXMOGBYTCOEOY-SNVBAGLBSA-N	-1	0	363.211	2.852	50	0		FFAARM
CCc1ccc(S(=O)(=O)[N-]c2cnn(C[C@@H]3CCCCO3)c2)s1	ZINC000390827919	512911223	/nfs/dbraw/zinc/91/12/23/512911223.db2.gz	MAXZZCMWVNVNMP-ZDUSSCGKSA-N	-1	0	355.485	2.877	50	0		FFAARM
Cc1nc(CC(C)C)sc1C(=O)N(CCC(=O)[O-])C1CCOCC1	ZINC000408513310	513083098	/nfs/dbraw/zinc/08/30/98/513083098.db2.gz	ONYMQICOUGMWAQ-UHFFFAOYSA-N	-1	0	354.472	2.746	50	0		FFAARM
N=c1[n-]nc(CCNC(=O)N2CCCCC[C@@H]2c2cccc(F)c2)s1	ZINC000584892127	518526631	/nfs/dbraw/zinc/52/66/31/518526631.db2.gz	KXEPHCCOMAXYDJ-CQSZACIVSA-N	-1	0	363.462	3.129	50	0		FFAARM
C=CCOc1ccc(C(=O)NCc2cccc(OCC(=O)[O-])c2)cc1OC	ZINC000095425473	519027250	/nfs/dbraw/zinc/02/72/50/519027250.db2.gz	GIKVHABACCYQAY-UHFFFAOYSA-N	-1	0	371.389	2.653	50	0		FFAARM
Cn1c(C(=O)N(CCC(=O)[O-])C2CCOCC2)ccc1-c1ccc(F)cc1	ZINC000583650586	519360695	/nfs/dbraw/zinc/36/06/95/519360695.db2.gz	MXDWMPXVCVMCQD-UHFFFAOYSA-N	-1	0	374.412	2.927	50	0		FFAARM
CCOc1cc(C(=O)N[C@H]2CCc3ccccc32)ccc1OCC(=O)[O-]	ZINC000268933947	520668195	/nfs/dbraw/zinc/66/81/95/520668195.db2.gz	ZSUVFUHRPNNEKU-INIZCTEOSA-N	-1	0	355.390	2.966	50	0		FFAARM
Cc1oc(CNC(=O)c2cc(Cl)c3c(c2)OCCO3)cc1C(=O)[O-]	ZINC000299744053	534545072	/nfs/dbraw/zinc/54/50/72/534545072.db2.gz	QMEBAGXTMIDTIC-UHFFFAOYSA-N	-1	0	351.742	2.641	50	0		FFAARM
COc1cc(C2(C(=O)N3CCO[C@H](CC(=O)[O-])C3)CCCC2)ccc1C	ZINC000269023301	522304694	/nfs/dbraw/zinc/30/46/94/522304694.db2.gz	JHFZZXYBAAECDI-MRXNPFEDSA-N	-1	0	361.438	2.518	50	0		FFAARM
CC[C@H](Cc1ccccc1Br)C(=O)N1CC[C@H](C(=O)[O-])C1	ZINC000269174707	522314752	/nfs/dbraw/zinc/31/47/52/522314752.db2.gz	JFTXSXGVGIJUMI-YPMHNXCESA-N	-1	0	354.244	2.951	50	0		FFAARM
O=C([O-])[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccc(Br)cn1	ZINC000217413354	526291634	/nfs/dbraw/zinc/29/16/34/526291634.db2.gz	TXNDPVMTFHCJFB-ICCXJUOJSA-N	-1	0	353.216	2.702	50	0		FFAARM
CCOc1ccc2cc(C(=O)N(CCC(=O)[O-])C[C@@H]3CCCO3)[nH]c2c1	ZINC000299749335	528623287	/nfs/dbraw/zinc/62/32/87/528623287.db2.gz	JZEUXTHADDHCJZ-HNNXBMFYSA-N	-1	0	360.410	2.663	50	0		FFAARM
COc1ccccc1N1CCN(c2ncc(C(=O)[O-])c(C(C)C)n2)CC1	ZINC000169751153	537072104	/nfs/dbraw/zinc/07/21/04/537072104.db2.gz	PHTQIDWIFCWXEH-UHFFFAOYSA-N	-1	0	356.426	2.633	50	0		FFAARM
CCCCNC(=O)c1c([O-])c2cccnc2n(-c2cccc(OC)c2)c1=O	ZINC000101722526	570822556	/nfs/dbraw/zinc/82/25/56/570822556.db2.gz	NFAMHOFBQIVBSV-UHFFFAOYSA-N	-1	0	367.405	2.630	50	0		FFAARM
O=C([O-])C[C@@H]1CN(C(=O)c2csc(-c3cccc(Cl)c3)n2)CCO1	ZINC000238199680	570864940	/nfs/dbraw/zinc/86/49/40/570864940.db2.gz	WWDYDXPVBAPECM-GFCCVEGCSA-N	-1	0	366.826	2.779	50	0		FFAARM
Cc1cc(=O)[nH]c(-c2cccc([N-]S(=O)(=O)c3ccccc3F)c2)n1	ZINC000047328442	570885203	/nfs/dbraw/zinc/88/52/03/570885203.db2.gz	WHSDPHUAACGPRD-UHFFFAOYSA-N	-1	0	359.382	2.685	50	0		FFAARM
CCOC(=O)CN(C)c1ccc(NC(=O)c2ccccc2)cc1C(=O)[O-]	ZINC000046053506	570922091	/nfs/dbraw/zinc/92/20/91/570922091.db2.gz	FYDOQWQOBQWBOK-UHFFFAOYSA-N	-1	0	356.378	2.636	50	0		FFAARM
CCC(=O)N1CCCN(C(=O)c2cc(C)cc(Br)c2[O-])CC1	ZINC000084718655	571097955	/nfs/dbraw/zinc/09/79/55/571097955.db2.gz	BCCQNLGMJQFKTL-UHFFFAOYSA-N	-1	0	369.259	2.548	50	0		FFAARM
C[C@@](CC(=O)[O-])(C(=O)Nc1ccc2c(c1)C(=O)NCC2)C1CCCCC1	ZINC000169988591	571260318	/nfs/dbraw/zinc/26/03/18/571260318.db2.gz	MXXUIPNSJDTYDG-FQEVSTJZSA-N	-1	0	358.438	2.972	50	0		FFAARM
CC[C@@H](C)N(CC(=O)[O-])C(=O)c1csc(I)c1	ZINC000123377824	728658159	/nfs/dbraw/zinc/65/81/59/728658159.db2.gz	USKRXDZLBUYIPD-SSDOTTSWSA-N	-1	0	367.208	2.678	50	0		FFAARM
C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCC[C@H](CCC(=O)[O-])C1	ZINC000263098269	729679368	/nfs/dbraw/zinc/67/93/68/729679368.db2.gz	ILXGTQCKTUQOMD-CHWSQXEVSA-N	-1	0	366.845	2.562	50	0		FFAARM
Cc1nc(S(=O)(=O)N2CCC[C@H](C(=O)[O-])C2)c(-c2ccccc2)s1	ZINC000663286249	732409297	/nfs/dbraw/zinc/40/92/97/732409297.db2.gz	QAALEYUEDBHLTJ-ZDUSSCGKSA-N	-1	0	366.464	2.604	50	0		FFAARM
Cc1ccc(-n2[n-]c(C(=O)N[C@H](CC(F)(F)F)C3CC3)cc2=O)cc1	ZINC000888092664	734011055	/nfs/dbraw/zinc/01/10/55/734011055.db2.gz	OQKBTGXONUAPQM-CQSZACIVSA-N	-1	0	353.344	2.935	50	0		FFAARM
O=C([O-])c1ccc(C(=O)Nc2cccc(NC(=O)[C@@H]3CCCO3)c2)cc1	ZINC000002880709	966687660	/nfs/dbraw/zinc/68/76/60/966687660.db2.gz	PCZRIWQYMATSJL-INIZCTEOSA-N	-1	0	354.362	2.755	50	0		FFAARM
C[C@@H]1Oc2c(cccc2C(=O)N2CC[C@@H](C(=O)[O-])c3ccccc32)NC1=O	ZINC000669435603	984589728	/nfs/dbraw/zinc/58/97/28/984589728.db2.gz	LHXICFSQTQVXBD-WCQYABFASA-N	-1	0	366.373	2.625	50	0		FFAARM
COc1ccc(/C=C/C(=O)N2Cc3ccccc3C[C@@H]2C(=O)[O-])cc1OC	ZINC000583650548	994938307	/nfs/dbraw/zinc/93/83/07/994938307.db2.gz	HPTHGFNMTDIXDO-SYJIQKIWSA-N	-1	0	367.401	2.755	50	0		FFAARM
CCn1c(=O)c(C(=O)Nc2ccsc2C(=O)OC)c([O-])c2ccccc21	ZINC000005445135	1012688914	/nfs/dbraw/zinc/68/89/14/1012688914.db2.gz	FPVWOKPUGDGPLR-UHFFFAOYSA-N	-1	0	372.402	2.827	50	0		FFAARM
Cc1cccc(OC2(C(=O)[O-])CCN(C(=O)c3cccc(C)n3)CC2)c1	ZINC000072411809	1019892699	/nfs/dbraw/zinc/89/26/99/1019892699.db2.gz	OIYJNSJSOFNCKH-UHFFFAOYSA-N	-1	0	354.406	2.837	50	0		FFAARM
O=C([O-])[C@@H]1CC2(CN1C(=O)C1CC1)CCN(c1nc3ccccc3o1)CC2	ZINC000072438738	1019896227	/nfs/dbraw/zinc/89/62/27/1019896227.db2.gz	USRPMRFUCPVMPF-HNNXBMFYSA-N	-1	0	369.421	2.510	50	0		FFAARM
CC(C)(C)n1nnc(C(=O)N[C@@H](CC(=O)[O-])c2ccc3ccccc3c2)n1	ZINC000659151002	1025957972	/nfs/dbraw/zinc/95/79/72/1025957972.db2.gz	HBCGEOXYWHMZDG-HNNXBMFYSA-N	-1	0	367.409	2.527	50	0		FFAARM
O=C([O-])c1cc(O)cc(C(=O)N2CCC([C@H](O)c3cccs3)CC2)c1	ZINC001506399220	1059491217	/nfs/dbraw/zinc/49/12/17/1059491217.db2.gz	KYUGGLFPSPUSNM-INIZCTEOSA-N	-1	0	361.419	2.738	50	0		FFAARM
Cc1[nH]c(C(=O)N(Cc2ccccn2)C[C@@H]2CCCO2)c(C)c1C(=O)[O-]	ZINC001506423233	1059511368	/nfs/dbraw/zinc/51/13/68/1059511368.db2.gz	WZXGVQHRCPPZNG-HNNXBMFYSA-N	-1	0	357.410	2.546	50	0		FFAARM
CCOc1cc(C)c(Cl)cc1S(=O)(=O)N1CCC[C@H](C(=O)[O-])C1	ZINC001506431760	1059516226	/nfs/dbraw/zinc/51/62/26/1059516226.db2.gz	YCIHHYCPHNORLT-NSHDSACASA-N	-1	0	361.847	2.532	50	0		FFAARM
CCn1c2ncc(C(=O)[O-])cc2nc1N1CCC[C@H]1c1nc(C(C)C)no1	ZINC001529104359	1062163316	/nfs/dbraw/zinc/16/33/16/1062163316.db2.gz	OFJMBYNHVPUZMN-ZDUSSCGKSA-N	-1	0	370.413	2.997	50	0		FFAARM
O=C([O-])c1ccc(Br)c(S(=O)(=O)N2CCCCCC2)c1	ZINC000000753317	219318020	/nfs/dbraw/zinc/31/80/20/219318020.db2.gz	RGJPQOSOUONEOK-UHFFFAOYSA-N	-1	0	362.245	2.712	50	0		FFAARM
Cc1ccc(C)c(OCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)[O-])c1	ZINC000000790585	219321827	/nfs/dbraw/zinc/32/18/27/219321827.db2.gz	XARTUSSXSHKXQV-SFHVURJKSA-N	-1	0	366.417	2.976	50	0		FFAARM
CCC[C@@H](C)C(=O)Nc1ccc(S(=O)(=O)[N-]c2nccc(C)n2)cc1	ZINC000000892633	219337840	/nfs/dbraw/zinc/33/78/40/219337840.db2.gz	VYLJKBHIINZIPE-GFCCVEGCSA-N	-1	0	362.455	2.961	50	0		FFAARM
O=C1NC(=O)c2cc([N-]S(=O)(=O)c3cc(Cl)ccc3Cl)ccc21	ZINC000001052728	219359366	/nfs/dbraw/zinc/35/93/66/219359366.db2.gz	JYYJBKRMCIHZCJ-UHFFFAOYSA-N	-1	0	371.201	2.678	50	0		FFAARM
O=C(NCc1ccc(F)cc1)c1c([O-])c2cccc3c2n(c1=O)CCC3	ZINC000001293775	219393578	/nfs/dbraw/zinc/39/35/78/219393578.db2.gz	RQTQSQARFRXFEZ-UHFFFAOYSA-N	-1	0	352.365	2.722	50	0		FFAARM
COc1ccc2c(c1OC)C(=O)N(c1cccc(/C=C/C(=O)[O-])c1)C2=O	ZINC000001458803	219407166	/nfs/dbraw/zinc/40/71/66/219407166.db2.gz	METZUJJKTOHAGT-RMKNXTFCSA-N	-1	0	353.330	2.602	50	0		FFAARM
Cc1cc(C)c(S(=O)(=O)NC[C@@H](CCC(=O)[O-])C(F)(F)F)c(C)c1	ZINC000001802376	219419134	/nfs/dbraw/zinc/41/91/34/219419134.db2.gz	NXVBIDWCYZNJET-GFCCVEGCSA-N	-1	0	367.389	2.933	50	0		FFAARM
Cc1coc2cc3oc(=O)c(CC(=O)N[C@H](C(=O)[O-])C(C)C)c(C)c3cc12	ZINC000002154817	219429739	/nfs/dbraw/zinc/42/97/39/219429739.db2.gz	XGBGZWIFZKNMDM-SFHVURJKSA-N	-1	0	371.389	2.924	50	0	biogenic	FFAARM
CC(=O)N[C@H](CC(=O)N1CCCC[C@H]1CCC(=O)[O-])c1ccc(C)cc1	ZINC000236717189	222904194	/nfs/dbraw/zinc/90/41/94/222904194.db2.gz	OLKCOEHOGZWTKF-ZWKOTPCHSA-N	-1	0	360.454	2.808	50	0		FFAARM
C[C@@H]1C[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)[O-]	ZINC000237508522	222908154	/nfs/dbraw/zinc/90/81/54/222908154.db2.gz	FSLHKMSHTJQJMU-YKHWKNEFSA-N	-1	0	365.227	2.698	50	0		FFAARM
C[C@@H]1CC[C@H](CCC(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)[O-])O1	ZINC000237540643	222908626	/nfs/dbraw/zinc/90/86/26/222908626.db2.gz	PUHCAAQJQWXZCP-ZLENFMNRSA-N	-1	0	362.401	2.767	50	0		FFAARM
CCCCC(=O)[N-]S(=O)(=O)c1ccc(NC(=O)c2ccccc2)cc1	ZINC000002689528	219456775	/nfs/dbraw/zinc/45/67/75/219456775.db2.gz	DDAYBEVSCZDDIK-UHFFFAOYSA-N	-1	0	360.435	2.934	50	0		FFAARM
C[C@@H](Oc1ccc2ccc(=O)oc2c1)C(=O)NC[C@H]1CC[C@H](C(=O)[O-])CC1	ZINC000245240730	222947128	/nfs/dbraw/zinc/94/71/28/222947128.db2.gz	SCMRAVQXCAHESR-UMVBOHGHSA-N	-1	0	373.405	2.568	50	0	biogenic	FFAARM
Cc1ccc2nc(-c3ccccc3NC(=O)CCC(=O)[O-])c(=O)[nH]c2c1	ZINC000004386690	219572653	/nfs/dbraw/zinc/57/26/53/219572653.db2.gz	VCFANLMZYOFFLN-UHFFFAOYSA-N	-1	0	351.362	2.702	50	0		FFAARM
Cc1ccccc1CN(CC(=O)[O-])S(=O)(=O)c1ccc(Cl)cc1	ZINC000006234574	219721144	/nfs/dbraw/zinc/72/11/44/219721144.db2.gz	GFFYBVUCIKXUKO-UHFFFAOYSA-N	-1	0	353.827	2.924	50	0		FFAARM
COc1ccccc1[N-]S(=O)(=O)c1ccc2c(c1)CCN2C(=O)C1CC1	ZINC000006730413	219763371	/nfs/dbraw/zinc/76/33/71/219763371.db2.gz	SPLNJXAGDPHOSE-UHFFFAOYSA-N	-1	0	372.446	2.795	50	0		FFAARM
O=C([O-])[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)CCc1nc(C2CCCC2)no1	ZINC000299744586	223079212	/nfs/dbraw/zinc/07/92/12/223079212.db2.gz	PHFMUJDIPFZISY-ZNMIVQPWSA-N	-1	0	361.442	2.904	50	0		FFAARM
Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)N1CC[C@@H](C(=O)[O-])C1	ZINC000299741574	223079503	/nfs/dbraw/zinc/07/95/03/223079503.db2.gz	GMPCGFCIVYTUEA-CQSZACIVSA-N	-1	0	361.829	2.748	50	0		FFAARM
CCc1ccc(OC)c(S(=O)(=O)[N-]c2ccc3c(c2)CC(=O)N3C)c1	ZINC000009572752	219883086	/nfs/dbraw/zinc/88/30/86/219883086.db2.gz	IPWTZCPGXDZSHA-UHFFFAOYSA-N	-1	0	360.435	2.577	50	0		FFAARM
CCCc1nnc(SCc2nc(-c3ccsc3)no2)n1CC(=O)[O-]	ZINC000012791736	220030532	/nfs/dbraw/zinc/03/05/32/220030532.db2.gz	UTFPBFPAZLUPDD-UHFFFAOYSA-N	-1	0	365.440	2.719	50	0		FFAARM
CN(CCOc1ccc(Cl)cc1)S(=O)(=O)c1ccc(C(=O)[O-])cc1	ZINC000012992937	220049403	/nfs/dbraw/zinc/04/94/03/220049403.db2.gz	FOCABDBBEUXZJI-UHFFFAOYSA-N	-1	0	369.826	2.738	50	0		FFAARM
CCc1ccc(S(=O)(=O)Nc2cc3c(cc2C(=O)[O-])OCCO3)cc1	ZINC000013090254	220057373	/nfs/dbraw/zinc/05/73/73/220057373.db2.gz	ZCYIRKYNEFYUKF-UHFFFAOYSA-N	-1	0	363.391	2.519	50	0		FFAARM
COc1ccccc1CNC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)[O-]	ZINC000013236902	220062613	/nfs/dbraw/zinc/06/26/13/220062613.db2.gz	IDOPFGHMSXHKRF-KRWDZBQOSA-N	-1	0	367.405	2.672	50	0		FFAARM
COc1cccc(CC(=O)N2CCC(C(=O)[O-])(c3ccccc3)CC2)c1	ZINC000013185563	220061418	/nfs/dbraw/zinc/06/14/18/220061418.db2.gz	LMXUIVVAJZLGIL-UHFFFAOYSA-N	-1	0	353.418	2.883	50	0		FFAARM
COc1ccc(/C=C/C(=O)[O-])cc1S(=O)(=O)N1c2ccccc2C[C@H]1C	ZINC000013366976	220066033	/nfs/dbraw/zinc/06/60/33/220066033.db2.gz	BYEISBXPTKAUKC-AORWBKJGSA-N	-1	0	373.430	2.933	50	0		FFAARM
COc1ccc(CCC(=O)NCc2ccc(OC)c(C(=O)[O-])c2)cc1OC	ZINC000013392596	220066788	/nfs/dbraw/zinc/06/67/88/220066788.db2.gz	VUVMHMZAVZXWKL-UHFFFAOYSA-N	-1	0	373.405	2.660	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)c1cccc(N2CCCC2=O)c1)c1ccccc1	ZINC000013427905	220067448	/nfs/dbraw/zinc/06/74/48/220067448.db2.gz	YNTFWXQJZNCNPP-KRWDZBQOSA-N	-1	0	352.390	2.759	50	0		FFAARM
O=C([O-])[C@H]1CC=CC[C@H]1C(=O)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000013737114	220092653	/nfs/dbraw/zinc/09/26/53/220092653.db2.gz	MKUFWNNCCCXWQI-SJORKVTESA-N	-1	0	362.857	2.651	50	0		FFAARM
O=C(C[C@H]1SC(=O)[N-]C1=O)N1CCC[C@@H]1c1nc2ccccc2s1	ZINC000014083381	220104978	/nfs/dbraw/zinc/10/49/78/220104978.db2.gz	NSPAHKJXFDMAOC-ZYHUDNBSSA-N	-1	0	361.448	2.702	50	0		FFAARM
CCCc1cc(=O)n2[n-]c(COC)c(-c3ccc(OC)c(OC)c3)c2n1	ZINC000016661400	220189400	/nfs/dbraw/zinc/18/94/00/220189400.db2.gz	UPCLMYPDQGQYMR-UHFFFAOYSA-N	-1	0	357.410	2.806	50	0		FFAARM
NC(=O)c1c(NC(=O)CC2(CC(=O)[O-])CCCC2)sc2c1CCC2	ZINC000017072722	220201665	/nfs/dbraw/zinc/20/16/65/220201665.db2.gz	CUFRXFKWDPVDPT-UHFFFAOYSA-N	-1	0	350.440	2.699	50	0		FFAARM
O=C([N-]n1c(=O)c2c3c(sc2[nH]c1=S)CCCC3)c1ccccn1	ZINC000017073988	220204077	/nfs/dbraw/zinc/20/40/77/220204077.db2.gz	TXONTOWWUKWHDK-UHFFFAOYSA-N	-1	0	358.448	2.778	50	0		FFAARM
Cc1ccc([N-]S(=O)(=O)c2cc3c(cc2Cl)NC(=O)CO3)cc1F	ZINC000021108606	220352160	/nfs/dbraw/zinc/35/21/60/220352160.db2.gz	XWDCHSDARUSACO-UHFFFAOYSA-N	-1	0	370.789	2.919	50	0		FFAARM
Cc1ccc(C)c([N-]S(=O)(=O)c2ccc(-c3ccc(=O)[nH]n3)s2)c1	ZINC000021531493	220359830	/nfs/dbraw/zinc/35/98/30/220359830.db2.gz	DTUAPSBDVJKDIE-UHFFFAOYSA-N	-1	0	361.448	2.916	50	0		FFAARM
CC1(C)c2sc(=O)[nH]c2S[C@@H](C(=O)[O-])[C@H]1C(=O)c1ccc(F)cc1	ZINC000032594637	220666269	/nfs/dbraw/zinc/66/62/69/220666269.db2.gz	UWUHFWYLCGSROY-MWLCHTKSSA-N	-1	0	367.423	2.911	50	0		FFAARM
COc1ccc(C(N)=O)cc1[N-]S(=O)(=O)c1cc(Cl)ccc1C	ZINC000048356330	221010072	/nfs/dbraw/zinc/01/00/72/221010072.db2.gz	MMSQTYSTQALEMW-UHFFFAOYSA-N	-1	0	354.815	2.557	50	0		FFAARM
CCCOc1cc(Cl)c(CN[C@H](C)c2n[nH]c(=O)[n-]2)cc1OCC	ZINC000055054738	221057701	/nfs/dbraw/zinc/05/77/01/221057701.db2.gz	ZUBAEDXGIZDNJO-SNVBAGLBSA-N	-1	0	354.838	2.790	50	0		FFAARM
COc1ccc(C)cc1[N-]S(=O)(=O)c1ccc(CCNC(C)=O)s1	ZINC000058171765	221102765	/nfs/dbraw/zinc/10/27/65/221102765.db2.gz	IGRVXXUBCYUXHU-UHFFFAOYSA-N	-1	0	368.480	2.545	50	0		FFAARM
CCS(=O)(=O)c1ccc([O-])c(NC(=O)Cn2ccc3ccccc32)c1	ZINC000058185265	221104280	/nfs/dbraw/zinc/10/42/80/221104280.db2.gz	PRSATPLCBUZQPU-UHFFFAOYSA-N	-1	0	358.419	2.779	50	0		FFAARM
O=S(=O)([N-]c1ccn(CCc2ccncc2)n1)c1ccc(Cl)cc1	ZINC000058183389	221104313	/nfs/dbraw/zinc/10/43/13/221104313.db2.gz	JRWABHVKMLQDOE-UHFFFAOYSA-N	-1	0	362.842	2.975	50	0		FFAARM
O=C([O-])CCC(=O)N1N=C(c2ccc3c(c2)OCO3)C[C@@H]1c1ccccc1	ZINC000058196779	221105546	/nfs/dbraw/zinc/10/55/46/221105546.db2.gz	GNPPGEGZYWMWFN-MRXNPFEDSA-N	-1	0	366.373	2.958	50	0		FFAARM
Cc1cc(S(=O)(=O)Nc2cccc(Cl)c2)ccc1OCC(=O)[O-]	ZINC000063476247	221141932	/nfs/dbraw/zinc/14/19/32/221141932.db2.gz	LOLAMZHUIOJPFG-UHFFFAOYSA-N	-1	0	355.799	2.913	50	0		FFAARM
CSc1ccc([N-]S(=O)(=O)c2c(C)nc3sc(C)nn32)cc1	ZINC000065183671	221175215	/nfs/dbraw/zinc/17/52/15/221175215.db2.gz	QTOKVOJVTLFLNV-UHFFFAOYSA-N	-1	0	354.482	2.930	50	0		FFAARM
CCc1nc2sc(C)nn2c1S(=O)(=O)[N-]c1cc(F)ccc1F	ZINC000065183909	221176199	/nfs/dbraw/zinc/17/61/99/221176199.db2.gz	JUJROABRZFKQIP-UHFFFAOYSA-N	-1	0	358.395	2.741	50	0		FFAARM
CC(=O)N1CCc2sc(S(=O)(=O)[N-]c3ccccc3C)cc2C1	ZINC000065196111	221178827	/nfs/dbraw/zinc/17/88/27/221178827.db2.gz	WQLZXSOMDQYUSF-UHFFFAOYSA-N	-1	0	350.465	2.762	50	0		FFAARM
Cc1cc(C)cc([N-]S(=O)(=O)c2cc3n(c2)CCN(C(C)C)C3=O)c1	ZINC000065254750	221188425	/nfs/dbraw/zinc/18/84/25/221188425.db2.gz	HMUANAVGIZZCDS-UHFFFAOYSA-N	-1	0	361.467	2.770	50	0		FFAARM
Cc1ccc2nc(CCCNC(=O)c3ccccc3NCC(=O)[O-])oc2c1	ZINC000065431806	221218704	/nfs/dbraw/zinc/21/87/04/221218704.db2.gz	RDUTYDDAZNCZBX-UHFFFAOYSA-N	-1	0	367.405	2.995	50	0		FFAARM
C[C@H](c1nnc(SCC(=O)[O-])n1-c1ccc(F)cc1F)n1cccn1	ZINC000065398425	221211696	/nfs/dbraw/zinc/21/16/96/221211696.db2.gz	MEJSCZZKSZGXSS-SECBINFHSA-N	-1	0	365.365	2.528	50	0		FFAARM
CN(C)C(=O)c1ccc(NC(=O)[C@@H]2CC=CC[C@@H]2C(=O)[O-])cc1Cl	ZINC000067456642	221254126	/nfs/dbraw/zinc/25/41/26/221254126.db2.gz	CXWODBOEGWUBHB-NEPJUHHUSA-N	-1	0	350.802	2.647	50	0		FFAARM
Cc1c(-c2nnc(SCC(=O)[O-])n2[C@@H](C)c2ccccc2)cnn1C	ZINC000067675630	221269471	/nfs/dbraw/zinc/26/94/71/221269471.db2.gz	HHHICFQLVOUQAY-NSHDSACASA-N	-1	0	357.439	2.773	50	0		FFAARM
Cc1ccc(C(=O)N2CCc3c(c(C(=O)[O-])nn3CC3CC3)C2)cc1F	ZINC000067955634	221309326	/nfs/dbraw/zinc/30/93/26/221309326.db2.gz	JTNRROPIECVVKV-UHFFFAOYSA-N	-1	0	357.385	2.637	50	0		FFAARM
O=C([O-])c1ccccc1CC(=O)Nc1nnc(-c2ccccc2O)s1	ZINC000071286587	221340158	/nfs/dbraw/zinc/34/01/58/221340158.db2.gz	LIZRMKPGPRVUSP-UHFFFAOYSA-N	-1	0	355.375	2.790	50	0		FFAARM
COc1ccc(CNC(=O)C[C@@H]2OCCc3ccccc32)cc1C(=O)[O-]	ZINC000299747767	533588713	/nfs/dbraw/zinc/58/87/13/533588713.db2.gz	DZCDIFGSIAIKSL-SFHVURJKSA-N	-1	0	355.390	2.714	50	0		FFAARM
O=C([O-])[C@@H]1CC[C@H](C(=O)N2CCN(c3ccc(F)c(Cl)c3)CC2)C1	ZINC000097797271	132231029	/nfs/dbraw/zinc/23/10/29/132231029.db2.gz	PLUMKZCKALLUSJ-NWDGAFQWSA-N	-1	0	354.809	2.629	50	0		FFAARM
O=C([O-])[C@@H]1C2CCC(CC2)[C@@H]1C(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000006715357	132833949	/nfs/dbraw/zinc/83/39/49/132833949.db2.gz	NPRFPORHLJRTSB-JOCCRWCTSA-N	-1	0	360.429	2.611	50	0		FFAARM
O=C([O-])[C@@]1(Cc2ccc(F)cc2F)CCCN(c2ncnc3nc[nH]c32)C1	ZINC000071750639	136140219	/nfs/dbraw/zinc/14/02/19/136140219.db2.gz	SUJJACXPMSWFLD-GOSISDBHSA-N	-1	0	373.363	2.545	50	0		FFAARM
COc1cccc2c1OC[C@]1(C(=O)[O-])CN(C(=O)c3ccc(C)s3)C[C@H]21	ZINC000095531778	221958787	/nfs/dbraw/zinc/95/87/87/221958787.db2.gz	CDWOTZHLJOYODO-BFUOFWGJSA-N	-1	0	373.430	2.768	50	0		FFAARM
COC(=O)C[C@H](c1ccccc1Cl)c1c([O-])nc2ccccn2c1=O	ZINC000096117310	222032985	/nfs/dbraw/zinc/03/29/85/222032985.db2.gz	JGQPTQSLKXOXQC-GFCCVEGCSA-N	-1	0	358.781	2.749	50	0		FFAARM
O=c1c2[n-][nH]n(-c3ccc(F)cc3)c=2c(=O)n1-c1ccc2c(c1)CCC2	ZINC000096500407	222123076	/nfs/dbraw/zinc/12/30/76/222123076.db2.gz	AOJNWZILBPWJHN-DLBZAZTESA-N	-1	0	350.353	2.812	50	0		FFAARM
O=C([O-])Cn1nc(Cc2cccs2)nc1-c1scc2c1OCCO2	ZINC000097244113	222170632	/nfs/dbraw/zinc/17/06/32/222170632.db2.gz	KZPFJSPWSOSYHX-UHFFFAOYSA-N	-1	0	363.420	2.515	50	0		FFAARM
COc1cc(C(=O)[O-])cc(C(=O)N2CCC(O)(c3ccc(F)cc3)CC2)c1	ZINC000097657205	222203338	/nfs/dbraw/zinc/20/33/38/222203338.db2.gz	KRYHVGYVZZFVBE-UHFFFAOYSA-N	-1	0	373.380	2.656	50	0		FFAARM
Cc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccc(F)cc4)c=3c2=O)cc1C	ZINC000101168221	222264565	/nfs/dbraw/zinc/26/45/65/222264565.db2.gz	YCENAKLSGQJLSJ-SJORKVTESA-N	-1	0	352.369	2.936	50	0		FFAARM
CCc1ccc(-n2c(=O)c3[n-][nH]n(Cc4cccc(F)c4)c=3c2=O)cc1	ZINC000101418365	222274056	/nfs/dbraw/zinc/27/40/56/222274056.db2.gz	MUUSZAKUFURIBS-IAGOWNOFSA-N	-1	0	352.369	2.882	50	0		FFAARM
CCOc1ccc(OC(=O)c2ccc3c(c2)[n-]c(=S)n(C)c3=O)cc1	ZINC000102756720	222307848	/nfs/dbraw/zinc/30/78/48/222307848.db2.gz	UPCUGIJQXAWYLQ-UHFFFAOYSA-N	-1	0	356.403	2.840	50	0		FFAARM
COc1ccc(C(=O)[O-])cc1NC(=S)NC(=O)c1ccccc1OC	ZINC000001159251	506252199	/nfs/dbraw/zinc/25/21/99/506252199.db2.gz	CBYYBVGXYUFMMH-UHFFFAOYSA-N	-1	0	360.391	2.529	50	0		FFAARM
Cc1c(C)c2ccc(OCC(=O)NCCCCCC(=O)[O-])cc2oc1=O	ZINC000002137529	506271819	/nfs/dbraw/zinc/27/18/19/506271819.db2.gz	JPPKPDUGZLBDJJ-UHFFFAOYSA-N	-1	0	361.394	2.550	50	0	biogenic	FFAARM
CCc1cc(=O)oc2c(C)c(O[C@H](C)C(=O)N3CCC[C@H]3C(=O)[O-])ccc12	ZINC000002105068	506271903	/nfs/dbraw/zinc/27/19/03/506271903.db2.gz	HIQXOQJXNWRHBJ-DOMZBBRYSA-N	-1	0	373.405	2.507	50	0		FFAARM
CCCCn1c2ccccc2c([O-])c(C(=O)NCc2cccnc2)c1=O	ZINC000002272123	506276607	/nfs/dbraw/zinc/27/66/07/506276607.db2.gz	JCCJRTJGNGCQQR-UHFFFAOYSA-N	-1	0	351.406	2.832	50	0		FFAARM
CCCCn1c(=O)c(C(=O)Nc2ncccc2O)c([O-])c2ccccc21	ZINC000002267755	506276987	/nfs/dbraw/zinc/27/69/87/506276987.db2.gz	OMVOXANSURAWNS-UHFFFAOYSA-N	-1	0	353.378	2.860	50	0		FFAARM
O=C([O-])/C=C/C(=O)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1	ZINC000002628650	506285521	/nfs/dbraw/zinc/28/55/21/506285521.db2.gz	KLDMMECPASVURS-ZHACJKMWSA-N	-1	0	365.364	2.935	50	0		FFAARM
COc1ccc(-c2nnc(SCC(=O)Nc3ccccc3)[n-]c2=O)cc1	ZINC000032778620	506293910	/nfs/dbraw/zinc/29/39/10/506293910.db2.gz	KTTJVVSUKMTMNQ-UHFFFAOYSA-N	-1	0	368.418	2.984	50	0		FFAARM
Cc1c(S(=O)(=O)[N-]c2nc3ccc(OC(F)F)cc3s2)cnn1C	ZINC000002804042	506294284	/nfs/dbraw/zinc/29/42/84/506294284.db2.gz	GABPNQSSRDANRT-UHFFFAOYSA-N	-1	0	374.394	2.740	50	0		FFAARM
CCOC(=O)N[C@@]([N-]c1ccccc1F)(C(=O)OCC)C(F)(F)F	ZINC000003138059	506310957	/nfs/dbraw/zinc/31/09/57/506310957.db2.gz	TZRHBYAQEKENMX-ZDUSSCGKSA-N	-1	0	352.284	2.805	50	0		FFAARM
O=C([O-])CCCN1C(=O)[C@H]2[C@@H](C1=O)C1c3ccccc3C2c2ccccc21	ZINC000004134933	506361070	/nfs/dbraw/zinc/36/10/70/506361070.db2.gz	NNUJYUGKZMAOCH-KHSMEXAKSA-N	-1	0	361.397	2.743	50	0		FFAARM
CS(=O)(=O)c1cccc(S(=O)(=O)[N-]c2nc3ccccc3s2)c1	ZINC000004270530	506367759	/nfs/dbraw/zinc/36/77/59/506367759.db2.gz	JZZYOLDGQQKLCS-UHFFFAOYSA-N	-1	0	368.461	2.501	50	0		FFAARM
Cc1ccc(NC(=O)CSC2=Nc3ccccc3S(=O)(=O)[N-]2)cc1	ZINC000004306484	506369371	/nfs/dbraw/zinc/36/93/71/506369371.db2.gz	ALDDKCSKWIJXPL-UHFFFAOYSA-N	-1	0	361.448	2.837	50	0		FFAARM
O=C([O-])c1ccccc1C(=O)NC[C@H](O)COc1ccc2ccccc2c1	ZINC000004351230	506372705	/nfs/dbraw/zinc/37/27/05/506372705.db2.gz	VUGJFKSCACJREA-INIZCTEOSA-N	-1	0	365.385	2.708	50	0		FFAARM
CCCNC(=O)C(=C([O-])c1ccc(F)cc1)n1cc(Cl)ccc1=O	ZINC000004435568	506376820	/nfs/dbraw/zinc/37/68/20/506376820.db2.gz	OFWJDMTWPAHYJN-HNNXBMFYSA-N	-1	0	350.777	2.591	50	0		FFAARM
O=C([O-])CCCn1cc(NC(=O)COc2ccc3ccccc3c2)cn1	ZINC000004744826	506391054	/nfs/dbraw/zinc/39/10/54/506391054.db2.gz	AYVAODMBRKFCRJ-UHFFFAOYSA-N	-1	0	353.378	2.919	50	0		FFAARM
CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)/C=C/C(=O)[O-])c2C(N)=O)C1	ZINC000004894622	506402612	/nfs/dbraw/zinc/40/26/12/506402612.db2.gz	IFFHCVHIGTVBEE-XCODYQFDSA-N	-1	0	350.440	2.577	50	0		FFAARM
Cc1nn(Cc2ccc(C)cc2)c(C)c1NC(=O)c1nn(C)cc1C(=O)[O-]	ZINC000036615416	506408234	/nfs/dbraw/zinc/40/82/34/506408234.db2.gz	UCCJKCQOBSUJEN-UHFFFAOYSA-N	-1	0	367.409	2.541	50	0		FFAARM
CCOC(=O)c1ccc(Nc2nnc(Cc3ccc(C)cc3)c(=O)[n-]2)cc1	ZINC000005154435	506426222	/nfs/dbraw/zinc/42/62/22/506426222.db2.gz	ONFHZUGBAWFTMF-UHFFFAOYSA-N	-1	0	364.405	2.984	50	0		FFAARM
COc1ccc(C[C@H](C(=O)Nc2cc(C)cc(C)c2)c2nnn[n-]2)cc1	ZINC000005488744	506445649	/nfs/dbraw/zinc/44/56/49/506445649.db2.gz	OSCLOUIYZRSDAF-KRWDZBQOSA-N	-1	0	351.410	2.790	50	0		FFAARM
Cc1ccc(S(=O)(=O)Nc2ccccc2N2CCCC2=O)cc1C(=O)[O-]	ZINC000039996418	506457725	/nfs/dbraw/zinc/45/77/25/506457725.db2.gz	UYDYARSHRSMDFX-UHFFFAOYSA-N	-1	0	374.418	2.621	50	0		FFAARM
Cc1ccc(S(=O)(=O)Nc2ccccc2-n2cccn2)cc1C(=O)[O-]	ZINC000040088479	506464820	/nfs/dbraw/zinc/46/48/20/506464820.db2.gz	SYTCNHLENSDMEK-UHFFFAOYSA-N	-1	0	357.391	2.680	50	0		FFAARM
O=C([O-])CCC(=O)Nc1sc2c(c1C(=O)NC1CCCC1)CCC2	ZINC000006725745	506500495	/nfs/dbraw/zinc/50/04/95/506500495.db2.gz	QKIZWYUYPMSZND-UHFFFAOYSA-N	-1	0	350.440	2.713	50	0		FFAARM
O=S(=O)([N-]NC(=S)Nc1ccc(F)c(Cl)c1)c1ccccc1	ZINC000006885449	506513492	/nfs/dbraw/zinc/51/34/92/506513492.db2.gz	NNPIHMDFWZGSHV-UHFFFAOYSA-N	-1	0	359.835	2.659	50	0		FFAARM
CCOC(=O)c1c(C)n(C)c(C)c1S(=O)(=O)[N-]c1ccccc1C	ZINC000006887600	506513583	/nfs/dbraw/zinc/51/35/83/506513583.db2.gz	JDKOXGIXOZSLIP-UHFFFAOYSA-N	-1	0	350.440	2.928	50	0		FFAARM
Cc1c(Cl)cccc1[N-]S(=O)(=O)c1ccc(-c2ccc(=O)[nH]n2)o1	ZINC000006973978	506521738	/nfs/dbraw/zinc/52/17/38/506521738.db2.gz	CVMQCFJWGFDAEX-UHFFFAOYSA-N	-1	0	365.798	2.793	50	0		FFAARM
CCCNC(=O)c1ccccc1[N-]S(=O)(=O)c1ccc(C(C)=O)cc1	ZINC000007054539	506530499	/nfs/dbraw/zinc/53/04/99/506530499.db2.gz	ZZVIZUXHLVWWIX-UHFFFAOYSA-N	-1	0	360.435	2.830	50	0		FFAARM
O=C(CSc1ccc(F)cc1)OCc1nc(=O)c2sccc2[n-]1	ZINC000007738437	506586068	/nfs/dbraw/zinc/58/60/68/506586068.db2.gz	ZZHQRJBOABSZBP-UHFFFAOYSA-N	-1	0	350.396	2.959	50	0		FFAARM
CC(=O)c1ccc(S(=O)(=O)[N-]c2ccccc2N2CCCC2=O)cc1	ZINC000007726621	506586284	/nfs/dbraw/zinc/58/62/84/506586284.db2.gz	WFYVCFAARXGIIW-UHFFFAOYSA-N	-1	0	358.419	2.817	50	0		FFAARM
COc1cc(S(=O)(=O)[N-]c2ccccc2O)ccc1Br	ZINC000008132499	506625155	/nfs/dbraw/zinc/62/51/55/506625155.db2.gz	SZZCMISFFVGYBQ-UHFFFAOYSA-N	-1	0	358.213	2.964	50	0		FFAARM
CC(=O)Nc1ccc(-c2ccc(S(=O)(=O)[N-]c3ccn(C)n3)cc2)cc1	ZINC000008725718	506664599	/nfs/dbraw/zinc/66/45/99/506664599.db2.gz	SULHLGWKFYCUOU-UHFFFAOYSA-N	-1	0	370.434	2.846	50	0		FFAARM
O=C(C1CC1)N1CCc2ccc([N-]S(=O)(=O)c3cccs3)cc2C1	ZINC000008977349	506675818	/nfs/dbraw/zinc/67/58/18/506675818.db2.gz	VHDBXXOPFGTIOZ-UHFFFAOYSA-N	-1	0	362.476	2.844	50	0		FFAARM
CCN1CCc2c3ccccc3[nH]c2[C@H]1c1c(O)nc([O-])n(C(C)C)c1=O	ZINC000009042443	506680261	/nfs/dbraw/zinc/68/02/61/506680261.db2.gz	GNLQNDLTPGVJGS-QGZVFWFLSA-N	-1	0	368.437	2.684	50	0	biogenic	FFAARM
Cc1noc(C)c1CCC(=O)Nc1cc2c(cc1C(=O)[O-])OCCCO2	ZINC000009874877	506715469	/nfs/dbraw/zinc/71/54/69/506715469.db2.gz	LYFCQXMDTZQBCB-UHFFFAOYSA-N	-1	0	360.366	2.722	50	0		FFAARM
Cc1cc(=O)[nH]c2c(C)cc(S(=O)(=O)Nc3ccccc3C(=O)[O-])cc12	ZINC000010274251	506736039	/nfs/dbraw/zinc/73/60/39/506736039.db2.gz	XYOOXVFCCDBNAY-UHFFFAOYSA-N	-1	0	372.402	2.644	50	0		FFAARM
O=C1N[C@H](c2ccccc2)C(=C([O-])c2cccs2)[C@@](O)(C(F)(F)F)N1	ZINC000011859142	506799886	/nfs/dbraw/zinc/79/98/86/506799886.db2.gz	OXRRYKXYECAQSB-LALPHHSUSA-N	-1	0	370.352	2.852	50	0		FFAARM
CCc1cccc(NC(=O)CCC2=Nc3ccccc3S(=O)(=O)[N-]2)c1	ZINC000012415202	506861456	/nfs/dbraw/zinc/86/14/56/506861456.db2.gz	DPXCFXQLFIRQEW-UHFFFAOYSA-N	-1	0	357.435	2.990	50	0		FFAARM
O=C([O-])/C=C/c1ccc(S(=O)(=O)NCc2nccc3ccccc32)cc1	ZINC000012551283	506878402	/nfs/dbraw/zinc/87/84/02/506878402.db2.gz	YGEQXZGHWLNWPA-JXMROGBWSA-N	-1	0	368.414	2.811	50	0		FFAARM
CC1=C(C)C[C@H](C(=O)Nc2ccc(N3CCOCC3)cc2)[C@H](C(=O)[O-])C1	ZINC000017073969	507115540	/nfs/dbraw/zinc/11/55/40/507115540.db2.gz	KYZBFBFWBZDZAH-ZWKOTPCHSA-N	-1	0	358.438	2.909	50	0		FFAARM
COc1ccc2o/c(=N\c3cccc(/C=C/C(=O)[O-])c3)c(C(N)=O)cc2c1	ZINC000027520937	507662799	/nfs/dbraw/zinc/66/27/99/507662799.db2.gz	VCPQRAWZEZQVQH-QEDMENMASA-N	-1	0	364.357	2.871	50	0		FFAARM
CCC(=O)Nc1cccc(NS(=O)(=O)c2ccc(F)c(C(=O)[O-])c2)c1	ZINC000028248066	507715197	/nfs/dbraw/zinc/71/51/97/507715197.db2.gz	GWNGNRVUIRCIFP-UHFFFAOYSA-N	-1	0	366.370	2.673	50	0		FFAARM
O=C([O-])c1ccccc1[C@H]1CCN(C(=O)c2ccc(-n3cnnc3)cc2)C1	ZINC000072140406	507756132	/nfs/dbraw/zinc/75/61/32/507756132.db2.gz	UYOWOBOLEAXFKE-HNNXBMFYSA-N	-1	0	362.389	2.595	50	0		FFAARM
CC(C)c1ccc(-c2cc(NC(=O)c3nccnc3C(=O)[O-])n[nH]2)cc1	ZINC000072401353	507783188	/nfs/dbraw/zinc/78/31/88/507783188.db2.gz	UQZBAGPBPBPPFP-UHFFFAOYSA-N	-1	0	351.366	2.941	50	0		FFAARM
COc1ccc(C2=NO[C@](CC(=O)Nc3ccccc3)(C(=O)[O-])C2)cc1	ZINC000072405517	507784067	/nfs/dbraw/zinc/78/40/67/507784067.db2.gz	AGDQUIOIJKKYPD-LJQANCHMSA-N	-1	0	354.362	2.672	50	0		FFAARM
O=C([O-])c1ccc(C[C@@H]2CCN(C(=O)CCn3cc(Cl)cn3)C2)cc1	ZINC000072428063	507788868	/nfs/dbraw/zinc/78/88/68/507788868.db2.gz	GLRTUOCLEDUYAC-AWEZNQCLSA-N	-1	0	361.829	2.716	50	0		FFAARM
O=S(=O)([N-]c1c[nH]nc1-c1ccccn1)c1cccc2cccnc21	ZINC000089883965	507877896	/nfs/dbraw/zinc/87/78/96/507877896.db2.gz	HXKZKAUBEVFGRH-UHFFFAOYSA-N	-1	0	351.391	2.821	50	0		FFAARM
CC(C)n1[nH]c(=O)c2c1[nH]c1nc(=O)sc-1c2-c1ccc(C(=O)[O-])cc1	ZINC000079479119	507966228	/nfs/dbraw/zinc/96/62/28/507966228.db2.gz	ZAPLDZIJWCVEND-UHFFFAOYSA-N	-1	0	370.390	2.986	50	0		FFAARM
Cc1ncsc1CCC(=O)N1C[C@@H](c2ccc(F)cc2)[C@H](C(=O)[O-])C1	ZINC000091769716	508010854	/nfs/dbraw/zinc/01/08/54/508010854.db2.gz	QDWLVRCVZWCVEU-LSDHHAIUSA-N	-1	0	362.426	2.850	50	0		FFAARM
Cc1cccc(NC(=O)c2c[nH]nc2S(=O)(=O)[N-]c2ccccc2)c1	ZINC000075476401	508110136	/nfs/dbraw/zinc/11/01/36/508110136.db2.gz	SFLWNNXDWJCGHJ-UHFFFAOYSA-N	-1	0	356.407	2.771	50	0		FFAARM
CSc1ccc([C@H](C(=O)[O-])N2CCN(C(=O)c3ccco3)CC2)cc1	ZINC000095357303	508175597	/nfs/dbraw/zinc/17/55/97/508175597.db2.gz	PFXSSHFYKIARIB-MRXNPFEDSA-N	-1	0	360.435	2.585	50	0		FFAARM
COCCN1CCN([C@H](C(=O)[O-])c2cccc3c4ccccc4oc32)CC1	ZINC000095363727	508176753	/nfs/dbraw/zinc/17/67/53/508176753.db2.gz	LMSXUIPOSAQCEY-IBGZPJMESA-N	-1	0	368.433	2.976	50	0		FFAARM
O=C([O-])c1ccc([C@H]2CCCN(S(=O)(=O)N3CCCCCC3)C2)cc1	ZINC000095366804	508177400	/nfs/dbraw/zinc/17/74/00/508177400.db2.gz	IPCDBDORDKYXOV-KRWDZBQOSA-N	-1	0	366.483	2.685	50	0		FFAARM
Cc1nn(C)c(C)c1[C@H](C)C(=O)NC[C@@H](Cc1ccc(C)cc1)C(=O)[O-]	ZINC000095425426	508184808	/nfs/dbraw/zinc/18/48/08/508184808.db2.gz	HUTOUQWHIMVNBW-SUMWQHHRSA-N	-1	0	357.454	2.509	50	0		FFAARM
O=C([O-])[C@@H]1CCCN1CC(=O)N[C@@H](c1cccs1)c1ccc(F)cc1	ZINC000095428051	508184896	/nfs/dbraw/zinc/18/48/96/508184896.db2.gz	ZQVYTMHRVSPQDV-WMLDXEAASA-N	-1	0	362.426	2.642	50	0		FFAARM
Cc1c2ccc(C)cc2oc1C(=O)N1C[C@@H](C(=O)[O-])[C@H](c2ncc[nH]2)C1	ZINC000095505876	508192222	/nfs/dbraw/zinc/19/22/22/508192222.db2.gz	BBJGSRCZJBXXEI-ZIAGYGMSSA-N	-1	0	353.378	2.713	50	0		FFAARM
Cc1cc2ncc(C(=O)N(Cc3cccnc3)C3CCCCC3)c(=O)n2[n-]1	ZINC000102689020	508281994	/nfs/dbraw/zinc/28/19/94/508281994.db2.gz	IRMCQYJEPSMYMP-UHFFFAOYSA-N	-1	0	365.437	2.701	50	0		FFAARM
O=C([O-])Cn1ccc(NC(=O)[C@@H]2C[C@H]2c2ccccc2OC(F)(F)F)n1	ZINC000122720670	508577773	/nfs/dbraw/zinc/57/77/73/508577773.db2.gz	KWMVQTQGRNTUOG-WDEREUQCSA-N	-1	0	369.299	2.609	50	0		FFAARM
CC(C)(C)CCCC(=O)[N-]S(=O)(=O)c1cccc(-c2nnco2)c1	ZINC000159007562	508780126	/nfs/dbraw/zinc/78/01/26/508780126.db2.gz	ZWMHEUIBQFFUGN-UHFFFAOYSA-N	-1	0	351.428	2.758	50	0		FFAARM
O=C(c1ccc2[n-]c(=S)oc2c1)N1CCC([C@@H](O)C(F)(F)F)CC1	ZINC000131468706	508935620	/nfs/dbraw/zinc/93/56/20/508935620.db2.gz	YEHWAJBRQAUWFN-GFCCVEGCSA-N	-1	0	360.357	2.892	50	0		FFAARM
CC[C@@H](C)N(Cc1ccccc1)C(=O)c1cc(C)c2c(=O)[n-]c(=O)nc-2[nH]1	ZINC000151544689	509040649	/nfs/dbraw/zinc/04/06/49/509040649.db2.gz	QDDYFTRDGXDUMN-CYBMUJFWSA-N	-1	0	366.421	2.773	50	0		FFAARM
COc1ccccc1-n1cc(S(=O)(=O)[N-]c2c(C)noc2C2CC2)cn1	ZINC000126817112	509132630	/nfs/dbraw/zinc/13/26/30/509132630.db2.gz	BGPQBILSEAVVEI-UHFFFAOYSA-N	-1	0	374.422	2.856	50	0		FFAARM
O=C([O-])[C@H](NC(=O)c1nn(-c2ccccc2)c2c1CCC2)c1ccccc1	ZINC000156277685	509153699	/nfs/dbraw/zinc/15/36/99/509153699.db2.gz	MNHVMPKJTVEHIP-GOSISDBHSA-N	-1	0	361.401	2.917	50	0		FFAARM
CC(C)(C)c1noc(CCCC(=O)N2Cc3ccccc3C[C@H]2C(=O)[O-])n1	ZINC000236747770	509496350	/nfs/dbraw/zinc/49/63/50/509496350.db2.gz	RTEOEEIKAYQZHC-HNNXBMFYSA-N	-1	0	371.437	2.728	50	0		FFAARM
CCO[C@@H](C)c1nc(CC(=O)N2CCC[C@@H](CCC(=O)[O-])C2)cs1	ZINC000237031663	509555753	/nfs/dbraw/zinc/55/57/53/509555753.db2.gz	TUOXSMAGIRQADX-STQMWFEESA-N	-1	0	354.472	2.887	50	0		FFAARM
O=C([N-]S(=O)(=O)c1cccc(Cl)c1)c1csc([C@H]2CCCO2)n1	ZINC000165217011	509562971	/nfs/dbraw/zinc/56/29/71/509562971.db2.gz	IEAIYKCBQVQQJG-GFCCVEGCSA-N	-1	0	372.855	2.767	50	0		FFAARM
C[C@@]1(C(=O)[O-])CCN(C(=O)C2(c3ccc(Cl)cc3)CCOCC2)C1	ZINC000237642146	509699711	/nfs/dbraw/zinc/69/97/11/509699711.db2.gz	SJZNYEMZIWKESW-QGZVFWFLSA-N	-1	0	351.830	2.711	50	0		FFAARM
O=C(NC1(C(=O)NCC2CC2)CCCC1)c1ccc2[n-]c(=S)oc2c1	ZINC000170653336	509700896	/nfs/dbraw/zinc/70/08/96/509700896.db2.gz	DGDYYVSECMCFEJ-UHFFFAOYSA-N	-1	0	359.451	2.685	50	0		FFAARM
Cc1ccccc1-n1ncc(C(=O)N2CC[C@@H](C(=O)[O-])C2)c1C(F)(F)F	ZINC000237737679	509722487	/nfs/dbraw/zinc/72/24/87/509722487.db2.gz	XNVIEYLLYFXPIT-LLVKDONJSA-N	-1	0	367.327	2.746	50	0		FFAARM
Cc1c(C(=O)N(CCC(=O)[O-])C[C@H]2CCCO2)cnn1-c1ccccc1C	ZINC000237735983	509722599	/nfs/dbraw/zinc/72/25/99/509722599.db2.gz	SKHWVAZEARYKIY-MRXNPFEDSA-N	-1	0	371.437	2.585	50	0		FFAARM
O=C([O-])CC[C@H]1CCCN(C(=O)CCc2cnn(-c3ccccc3)c2)C1	ZINC000238007611	509797636	/nfs/dbraw/zinc/79/76/36/509797636.db2.gz	OIHYBHPPNZZYGY-MRXNPFEDSA-N	-1	0	355.438	2.908	50	0		FFAARM
O=C([O-])C[C@@H]1CN(C(=O)C2(c3cccc(C(F)(F)F)c3)CCC2)CCO1	ZINC000238195181	509832519	/nfs/dbraw/zinc/83/25/19/509832519.db2.gz	BUMKERHYGCCKQT-CQSZACIVSA-N	-1	0	371.355	2.829	50	0		FFAARM
Cc1cccc2[nH]c(CCN(C)CC(=O)Nc3cccc(C(=O)[O-])c3)nc21	ZINC000252495453	509844277	/nfs/dbraw/zinc/84/42/77/509844277.db2.gz	OQQHBXDMMGCGRI-UHFFFAOYSA-N	-1	0	366.421	2.683	50	0		FFAARM
CC[C@H](C(=O)[O-])N(c1ccc(Cl)c(C(F)(F)F)c1)S(C)(=O)=O	ZINC000242498522	509846809	/nfs/dbraw/zinc/84/68/09/509846809.db2.gz	HKFWELCOJPNKEW-SNVBAGLBSA-N	-1	0	359.753	2.988	50	0		FFAARM
COc1ccccc1[C@H]1CCC[N@@H+]1CCC(=O)N1CCC(C(=O)[O-])CC1	ZINC000244866572	509873715	/nfs/dbraw/zinc/87/37/15/509873715.db2.gz	VYMFTERATXILEU-QGZVFWFLSA-N	-1	0	360.454	2.545	50	0		FFAARM
O=C(c1ccc(-c2ccsc2)cc1)N1CCC(N2C(=O)COC2=O)CC1	ZINC000245060740	509877882	/nfs/dbraw/zinc/87/78/82/509877882.db2.gz	PZFMQXIIMUAESM-UHFFFAOYSA-N	-1	0	370.430	2.999	50	0		FFAARM
Cc1[nH]nc(-c2ccc(Cl)cc2)c1CC(=O)N1CCC(C(=O)[O-])CC1	ZINC000253411180	509879518	/nfs/dbraw/zinc/87/95/18/509879518.db2.gz	OHZQWULKYKUFLE-UHFFFAOYSA-N	-1	0	361.829	2.904	50	0		FFAARM
COc1ccc(-c2nnc(S(=O)(=O)Cc3cccc(C)c3)[n-]2)c(OC)c1	ZINC000195188790	510707353	/nfs/dbraw/zinc/70/73/53/510707353.db2.gz	XGAYGYJBIMFJAW-UHFFFAOYSA-N	-1	0	373.434	2.771	50	0		FFAARM
Cc1ccc(CN(C)CC(=O)N2CC[C@@](C(=O)[O-])(c3ccccc3)C2)cc1	ZINC000299797450	533870531	/nfs/dbraw/zinc/87/05/31/533870531.db2.gz	OGJXKJABNMJQEZ-QFIPXVFZSA-N	-1	0	366.461	2.682	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)c2ccc(-c3cc(F)c(F)c(F)c3)cc2)CCO1	ZINC000408513521	513083445	/nfs/dbraw/zinc/08/34/45/513083445.db2.gz	QBFLVEPTQMVLKW-HNNXBMFYSA-N	-1	0	365.307	2.697	50	0		FFAARM
C[C@]1(C(=O)[O-])C[C@H](O)CN1C(=O)OCC1c2ccccc2-c2ccccc21	ZINC000521398883	517714681	/nfs/dbraw/zinc/71/46/81/517714681.db2.gz	WSKXCJGRXYRWBH-YEJXKQKISA-N	-1	0	367.401	2.845	50	0		FFAARM
CC(C)(C(=O)[O-])C(=O)NCc1cc(Br)ccc1OC(F)F	ZINC000522060589	517972600	/nfs/dbraw/zinc/97/26/00/517972600.db2.gz	NPGSCOLGNKDRKG-UHFFFAOYSA-N	-1	0	366.158	2.778	50	0		FFAARM
O=C(NCc1n[nH]c(=O)[n-]1)N[C@@H]1CC2(CCCCC2)Oc2ccccc21	ZINC000584902870	518531894	/nfs/dbraw/zinc/53/18/94/518531894.db2.gz	YTCVOZMODACNER-CYBMUJFWSA-N	-1	0	357.414	2.536	50	0		FFAARM
O=C([O-])[C@@H](CNC(=O)[C@@H]1CC=CCC1)Oc1ccc(Br)cc1	ZINC000573252675	518577425	/nfs/dbraw/zinc/57/74/25/518577425.db2.gz	DKMOPKPPNQYRMS-BXUZGUMPSA-N	-1	0	368.227	2.754	50	0		FFAARM
O=C([O-])C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CCO1	ZINC000299753325	534504861	/nfs/dbraw/zinc/50/48/61/534504861.db2.gz	XVEZOBFPJUVZST-KGYLQXTDSA-N	-1	0	357.328	2.511	50	0		FFAARM
O=C([O-])[C@@H]1CCCN(C(=O)[C@H]2C[C@H]2c2cccc(Br)c2)C1	ZINC000299743125	534519177	/nfs/dbraw/zinc/51/91/77/534519177.db2.gz	LYDLREABJYIISG-XBFCOCLRSA-N	-1	0	352.228	2.876	50	0		FFAARM
CCc1nn(C)c(CC)c1S(=O)(=O)[N-]c1cccc(Cn2cccn2)c1	ZINC000089280038	522662634	/nfs/dbraw/zinc/66/26/34/522662634.db2.gz	JAWFCEUNOSYBQS-UHFFFAOYSA-N	-1	0	373.482	2.591	50	0		FFAARM
O=C([O-])[C@@H](CNC(=O)c1ccncc1Br)C1CCCCC1	ZINC000630265103	522749450	/nfs/dbraw/zinc/74/94/50/522749450.db2.gz	LOHDMVWJGREUEF-LBPRGKRZSA-N	-1	0	355.232	2.855	50	0		FFAARM
Cc1nn(-c2ccc(F)cc2F)c(C)c1C(=O)N1CCC[C@@H](C(=O)[O-])C1	ZINC000299743185	534801733	/nfs/dbraw/zinc/80/17/33/534801733.db2.gz	MLEKVVADPSJUPZ-GFCCVEGCSA-N	-1	0	363.364	2.704	50	0		FFAARM
Cc1cc(N2CCC(N3CCOC3=O)CC2)nc(-c2ccccc2[O-])n1	ZINC000091620044	525055631	/nfs/dbraw/zinc/05/56/31/525055631.db2.gz	SFQRXCGAXQNFPN-UHFFFAOYSA-N	-1	0	354.410	2.579	50	0		FFAARM
C[C@@H]1C[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)[O-]	ZINC000237441447	525478973	/nfs/dbraw/zinc/47/89/73/525478973.db2.gz	FSLHKMSHTJQJMU-UGQGEIBHSA-N	-1	0	365.227	2.698	50	0		FFAARM
Cc1nn(CC(C)C)c(Cl)c1/C=C/C(=O)N1CCC[C@@H](C(=O)[O-])C1	ZINC000299409656	534861244	/nfs/dbraw/zinc/86/12/44/534861244.db2.gz	PZDYYVKDECBORB-KTRBRXNASA-N	-1	0	353.850	2.837	50	0		FFAARM
Cc1c2ccc(C(F)(F)F)nc2sc1C(=O)N1CCO[C@@H](C(=O)[O-])C1	ZINC000178279990	525963061	/nfs/dbraw/zinc/96/30/61/525963061.db2.gz	LNEBPRQDZJHRJZ-SECBINFHSA-N	-1	0	374.340	2.549	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)c2c[nH]nc2C2CCCCC2)C[C@H]1c1ccccn1	ZINC000091643862	526286795	/nfs/dbraw/zinc/28/67/95/526286795.db2.gz	UXPZGWCJQJILML-HZPDHXFCSA-N	-1	0	368.437	2.793	50	0		FFAARM
Cc1oc(CN(C)C(=O)CC[C@H]2Cc3ccccc3NC2=O)cc1C(=O)[O-]	ZINC000268924639	526767319	/nfs/dbraw/zinc/76/73/19/526767319.db2.gz	DBCCXNPBGACLCF-AWEZNQCLSA-N	-1	0	370.405	2.836	50	0		FFAARM
O=C([N-]O[C@@H]1CCCCO1)[C@@H]1CC(=O)N(c2cccc3ccccc32)C1	ZINC000065513491	526851245	/nfs/dbraw/zinc/85/12/45/526851245.db2.gz	WEFSUUPGKYLXGH-DNVCBOLYSA-N	-1	0	354.406	2.767	50	0		FFAARM
COC(=O)C[C@@H](c1ccccc1)c1c(=O)nc2ccc(Cl)cn2c1[O-]	ZINC000205976979	570555107	/nfs/dbraw/zinc/55/51/07/570555107.db2.gz	PCFSMZNUDMTXJS-ZDUSSCGKSA-N	-1	0	358.781	2.749	50	0		FFAARM
Cc1ccc2c(c1)[nH]c(=NNC(=O)CCC(=O)[O-])nc2-c1ccccc1	ZINC000075110296	570609789	/nfs/dbraw/zinc/60/97/89/570609789.db2.gz	JXVOWXYURZKGOC-UHFFFAOYSA-N	-1	0	350.378	2.913	50	0		FFAARM
CCC(CC)(CNC(=O)c1ccc2[n-]c(=S)oc2c1)S(C)(=O)=O	ZINC000081484026	570960529	/nfs/dbraw/zinc/96/05/29/570960529.db2.gz	VURWMRCVKWAICX-UHFFFAOYSA-N	-1	0	356.469	2.824	50	0		FFAARM
O=C(OC1CCC([N-]C(=O)C(F)(F)F)CC1)c1ccc2c(c1)OCO2	ZINC000084452160	571086169	/nfs/dbraw/zinc/08/61/69/571086169.db2.gz	VBHRIRODPVFCHI-UHFFFAOYSA-N	-1	0	359.300	2.562	50	0		FFAARM
O=C([O-])c1cccc(C[C@@H]2CCN(C(=O)c3cn4ccsc4n3)C2)c1	ZINC000072144275	571172376	/nfs/dbraw/zinc/17/23/76/571172376.db2.gz	KPGWRRQAHOCARQ-ZDUSSCGKSA-N	-1	0	355.419	2.799	50	0		FFAARM
Cc1cccc(C[C@H](CNC(=O)c2ccc3c(c2)CCC(=O)N3)C(=O)[O-])c1	ZINC000123806202	571191022	/nfs/dbraw/zinc/19/10/22/571191022.db2.gz	ZUGOMWKBGGVHHO-QGZVFWFLSA-N	-1	0	366.417	2.553	50	0		FFAARM
COc1cc2c(c(OC)c1OC)[C@@H](c1ccc(C(=O)[O-])cc1)CC(=O)O2	ZINC000217992740	571351941	/nfs/dbraw/zinc/35/19/41/571351941.db2.gz	DUEXSCANESGBAU-GFCCVEGCSA-N	-1	0	358.346	2.852	50	0	biogenic	FFAARM
Cc1ccc(-n2nc(C(=O)N[C@H](C(=O)[O-])C(C)C)c3c2CCC3)c(F)c1	ZINC000236781691	600149993	/nfs/dbraw/zinc/14/99/93/600149993.db2.gz	FCNPAOFDPMOCKO-INIZCTEOSA-N	-1	0	359.401	2.648	50	0		FFAARM
C[C@@H](CCNC(=O)N1CCO[C@@H](C(=O)[O-])C1)c1cccc(C(F)(F)F)c1	ZINC000666534285	600997768	/nfs/dbraw/zinc/99/77/68/600997768.db2.gz	HRRCHMOAHIDFQO-SMDDNHRTSA-N	-1	0	374.359	2.694	50	0		FFAARM
Cc1cc(C(=O)[O-])c(F)c(S(=O)(=O)N(C)[C@@H](C)c2ccccn2)c1	ZINC000185136590	729342350	/nfs/dbraw/zinc/34/23/50/729342350.db2.gz	ATSGCMXPTWSMLF-NSHDSACASA-N	-1	0	352.387	2.609	50	0		FFAARM
CC(C)CCOc1ccc(NC(=O)N2CCO[C@H](C(=O)[O-])C2)c(F)c1	ZINC000653547364	731272264	/nfs/dbraw/zinc/27/22/64/731272264.db2.gz	ISWFEEPNQHGDAR-HNNXBMFYSA-N	-1	0	354.378	2.568	50	0		FFAARM
Cc1c(S(=O)(=O)[N-]c2ccc(C)cc2C(=O)C(F)(F)F)cnn1C	ZINC000585138332	845948456	/nfs/dbraw/zinc/94/84/56/845948456.db2.gz	FXJIXYKLFVALLZ-UHFFFAOYSA-N	-1	0	361.345	2.583	50	0		FFAARM
NC(=O)c1c2c(sc1NC(=O)[C@H]1CCCC[C@@H]1C(=O)[O-])CCCC2	ZINC000000355783	219304545	/nfs/dbraw/zinc/30/45/45/219304545.db2.gz	OFSGNJCEUBTMGV-UWVGGRQHSA-N	-1	0	350.440	2.555	50	0		FFAARM
Cc1ccc([N-]S(=O)(=O)c2cc(OCC(N)=O)c(C)cc2Cl)cc1	ZINC000000645306	219309542	/nfs/dbraw/zinc/30/95/42/219309542.db2.gz	ALQGKDCNTCKPHB-UHFFFAOYSA-N	-1	0	368.842	2.622	50	0		FFAARM
CCOc1ccc(N2C(=O)C[C@H](Sc3ncccc3C(=O)[O-])C2=O)cc1	ZINC000000945349	219344879	/nfs/dbraw/zinc/34/48/79/219344879.db2.gz	RQIPDDXUOYKDRZ-AWEZNQCLSA-N	-1	0	372.402	2.603	50	0		FFAARM
O=S(=O)([N-]c1nccs1)c1cnc(Cl)c(Br)c1	ZINC000001020473	219354030	/nfs/dbraw/zinc/35/40/30/219354030.db2.gz	UGPDLZRZDOLVEJ-UHFFFAOYSA-N	-1	0	354.638	2.755	50	0		FFAARM
CCOc1ccccc1N1C(=O)C[C@H](Sc2ncccc2C(=O)[O-])C1=O	ZINC000001058773	219360707	/nfs/dbraw/zinc/36/07/07/219360707.db2.gz	RQTOUFWQNMUXAE-AWEZNQCLSA-N	-1	0	372.402	2.603	50	0		FFAARM
CC[C@@]1(c2ccccc2)C(=O)[N-]C(=O)N(C(=O)c2ccccc2Cl)C1=O	ZINC000001214360	219389647	/nfs/dbraw/zinc/38/96/47/219389647.db2.gz	JHPRLOSLYKIZRC-LJQANCHMSA-N	-1	0	370.792	2.907	50	0		FFAARM
O=C([O-])CCCCCNC(=O)c1cccc(I)c1	ZINC000001795199	219418902	/nfs/dbraw/zinc/41/89/02/219418902.db2.gz	JDYDHGWUYUAFFY-UHFFFAOYSA-N	-1	0	361.179	2.666	50	0		FFAARM
Nc1c2cc(C(=O)[O-])c(=O)[nH]c2sc1C(=O)Nc1cccc(Cl)c1	ZINC000002336146	219438417	/nfs/dbraw/zinc/43/84/17/219438417.db2.gz	KOANXOPSGVZJJK-UHFFFAOYSA-N	-1	0	363.782	2.776	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)[C@@H]1CC(=O)Nc2ccccc21)c1ccc(F)cc1	ZINC000237953035	222912542	/nfs/dbraw/zinc/91/25/42/222912542.db2.gz	RFBAPSSIFUKBQD-ZBFHGGJFSA-N	-1	0	356.353	2.584	50	0		FFAARM
Cc1nc(C(=O)N(C[C@H](C)C(=O)[O-])C2CC2)nn1-c1ccc(Cl)cc1	ZINC000237477081	222908846	/nfs/dbraw/zinc/90/88/46/222908846.db2.gz	KNBNZSLNAVHYBF-JTQLQIEISA-N	-1	0	362.817	2.554	50	0		FFAARM
Cc1nc(COc2ccccc2/C=C/C(=O)N2CC[C@@H](C(=O)[O-])C2)cs1	ZINC000237738245	222910050	/nfs/dbraw/zinc/91/00/50/222910050.db2.gz	RTKZJQAFJPXUFJ-LQYUOIDQSA-N	-1	0	372.446	2.977	50	0		FFAARM
NC(=O)c1c(NC(=O)[C@H]2CC=CC[C@H]2C(=O)[O-])sc2c1CCCCC2	ZINC000004019129	219534474	/nfs/dbraw/zinc/53/44/74/219534474.db2.gz	MAVGXAKPWNROPG-WDEREUQCSA-N	-1	0	362.451	2.721	50	0		FFAARM
COc1cc2c(cc1OC)[C@@H](C(=O)[O-])[C@H](c1ccc(F)cc1)N(C)C2=O	ZINC000004563677	219586912	/nfs/dbraw/zinc/58/69/12/219586912.db2.gz	MIKLYYNEIZMHGU-SJORKVTESA-N	-1	0	359.353	2.838	50	0		FFAARM
O=C(CN1C(=O)c2ccccc2C1=O)Nc1cc(Cl)c([O-])c(Cl)c1	ZINC000004828562	219611322	/nfs/dbraw/zinc/61/13/22/219611322.db2.gz	OHAAEMUJHIIOJH-UHFFFAOYSA-N	-1	0	365.172	2.934	50	0		FFAARM
CCn1c2ccccc2c([O-])c(C(=O)Nc2cc([N+](C)=O)ccc2[O-])c1=O	ZINC000299738252	223077761	/nfs/dbraw/zinc/07/77/61/223077761.db2.gz	NCJVJNSHOJRRQR-UHFFFAOYSA-O	-1	0	368.369	2.725	50	0		FFAARM
Cc1cc(C)n(-c2ccc(C(=O)N3[C@@H]4CCCC[C@H]4C[C@H]3C(=O)[O-])cn2)n1	ZINC000299742339	223079763	/nfs/dbraw/zinc/07/97/63/223079763.db2.gz	BFRDHTVWBXNBED-UAGQMJEPSA-N	-1	0	368.437	2.742	50	0		FFAARM
CC(Nc1cccc(F)c1)=C1C(=O)[N-]C(=O)N(Cc2ccccc2)C1=O	ZINC000009108602	219874629	/nfs/dbraw/zinc/87/46/29/219874629.db2.gz	LXOYJWWYMTXPFR-FOWTUZBSSA-N	-1	0	353.353	2.790	50	0		FFAARM
CN(Cc1nc(=O)c2sccc2[n-]1)C(=O)COc1cccc(Cl)c1	ZINC000012816214	220033944	/nfs/dbraw/zinc/03/39/44/220033944.db2.gz	HTYAXSMGUBUPPV-UHFFFAOYSA-N	-1	0	363.826	2.675	50	0		FFAARM
NC(=O)c1c(NC(=O)C[C@@H](C(=O)[O-])c2ccccc2)sc2c1CCC2	ZINC000013254969	220062521	/nfs/dbraw/zinc/06/25/21/220062521.db2.gz	CGCNJQPAHJQHMX-GFCCVEGCSA-N	-1	0	358.419	2.533	50	0		FFAARM
COc1ccc([C@@H](CC(=O)[O-])NC(=O)CCc2ccccc2OC)cc1	ZINC000013188944	220060874	/nfs/dbraw/zinc/06/08/74/220060874.db2.gz	ZTXLRBBDKIGIBP-QGZVFWFLSA-N	-1	0	357.406	2.969	50	0		FFAARM
COc1ccc([C@@H](CC(=O)[O-])NC(=O)c2ccc(F)cc2F)cc1OC	ZINC000013182311	220061093	/nfs/dbraw/zinc/06/10/93/220061093.db2.gz	AIGPLWVOFQSYNY-CQSZACIVSA-N	-1	0	365.332	2.928	50	0		FFAARM
COc1ccc(-c2ccc(S(=O)(=O)N[C@@H](C(=O)[O-])C(C)C)cc2)cc1	ZINC000013778426	220094747	/nfs/dbraw/zinc/09/47/47/220094747.db2.gz	MDWFJTBWOFNAQX-QGZVFWFLSA-N	-1	0	363.435	2.750	50	0		FFAARM
COc1cccc(/C=C2\SC(=O)N(CCCC(=O)[O-])C2=O)c1OC	ZINC000013786688	220095071	/nfs/dbraw/zinc/09/50/71/220095071.db2.gz	DSNLIHMZAPXXMX-XFXZXTDPSA-N	-1	0	351.380	2.605	50	0		FFAARM
O=C1[N-]C(=O)N(Cc2ccccc2)C(=O)C1=C1C[C@@H](c2ccccc2)NN1	ZINC000016995094	220200514	/nfs/dbraw/zinc/20/05/14/220200514.db2.gz	MUBADWQPHFIWNO-DZHJMQLISA-N	-1	0	362.389	2.599	50	0		FFAARM
Cc1ccccc1NC(=O)CSc1nc([O-])cc(=O)n1-c1ccccc1	ZINC000017945701	220219881	/nfs/dbraw/zinc/21/98/81/220219881.db2.gz	RRFDDPLCCVYHPB-UHFFFAOYSA-N	-1	0	367.430	2.977	50	0		FFAARM
CCOC(=O)C1CCN(Cc2cc(=O)oc3cc([O-])c(Cl)cc23)CC1	ZINC000020573131	220333193	/nfs/dbraw/zinc/33/31/93/220333193.db2.gz	OMACYDQNEPEXRP-UHFFFAOYSA-N	-1	0	365.813	2.927	50	0		FFAARM
Cc1ccc([N-]S(=O)(=O)c2ccc(-c3ccc(=O)[nH]n3)s2)c(C)c1	ZINC000020574730	220333681	/nfs/dbraw/zinc/33/36/81/220333681.db2.gz	ASCKMYZLTLPSTM-UHFFFAOYSA-N	-1	0	361.448	2.916	50	0		FFAARM
Cc1cn2c(nc(C)c(S(=O)(=O)[N-]C3CCCCCCC3)c2=O)s1	ZINC000020922014	220346225	/nfs/dbraw/zinc/34/62/25/220346225.db2.gz	PTBIPMRDMMIRHS-UHFFFAOYSA-N	-1	0	369.512	2.764	50	0		FFAARM
CCOc1ccc([C@H](c2sc3nc(C)nn3c2[O-])N2CCOCC2)cc1	ZINC000022626645	220392869	/nfs/dbraw/zinc/39/28/69/220392869.db2.gz	FQNMWHYCTWMIET-OAHLLOKOSA-N	-1	0	374.466	2.625	50	0		FFAARM
Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)[C@@H]1CC=CC[C@@H]1C(=O)[O-]	ZINC000051185997	221034853	/nfs/dbraw/zinc/03/48/53/221034853.db2.gz	CHMPNBBRLRVAKS-CVEARBPZSA-N	-1	0	358.438	2.986	50	0		FFAARM
Cc1ccsc1CNc1ccc(C(=O)N2CCOC[C@H]2CC(=O)[O-])cc1	ZINC000055088968	221058440	/nfs/dbraw/zinc/05/84/40/221058440.db2.gz	OMOXUSMWAJNHGQ-MRXNPFEDSA-N	-1	0	374.462	2.984	50	0		FFAARM
Cc1cc(C(=O)[O-])c(O)c(S(=O)(=O)Nc2cc(Cl)ccc2F)c1	ZINC000058377208	221116969	/nfs/dbraw/zinc/11/69/69/221116969.db2.gz	LBEPDCPWKYWLEU-UHFFFAOYSA-N	-1	0	359.762	2.992	50	0		FFAARM
O=C([O-])c1cc2c(c(S(=O)(=O)Nc3ccc4c(c3)CCO4)c1)CCC2	ZINC000058381818	221117027	/nfs/dbraw/zinc/11/70/27/221117027.db2.gz	QPQBCGMZPGUOSJ-UHFFFAOYSA-N	-1	0	359.403	2.609	50	0		FFAARM
COc1ccc(C)cc1[N-]S(=O)(=O)c1cc2[nH]c(=O)[nH]c2cc1Cl	ZINC000064976578	221159311	/nfs/dbraw/zinc/15/93/11/221159311.db2.gz	IHSXQRUXWBCPLT-UHFFFAOYSA-N	-1	0	367.814	2.627	50	0		FFAARM
COC(=O)c1ccc([N-]S(=O)(=O)c2ccc(-c3ccno3)s2)cc1	ZINC000065031186	221164780	/nfs/dbraw/zinc/16/47/80/221164780.db2.gz	CREOALOEDKMQQJ-UHFFFAOYSA-N	-1	0	364.404	2.991	50	0		FFAARM
COc1ccccc1C[C@@H](C)N(C)C(=O)c1ccccc1NCC(=O)[O-]	ZINC000065403663	221214134	/nfs/dbraw/zinc/21/41/34/221214134.db2.gz	BSAYAOHMUCROKO-CQSZACIVSA-N	-1	0	356.422	2.895	50	0		FFAARM
Cc1cc(C(=O)[O-])c(O)c(S(=O)(=O)Nc2cccc(Cl)c2F)c1	ZINC000065497579	221227468	/nfs/dbraw/zinc/22/74/68/221227468.db2.gz	LAXZDXJHIYAPBI-UHFFFAOYSA-N	-1	0	359.762	2.992	50	0		FFAARM
Cc1cc(N(C)Cc2nc(=O)c3sccc3[n-]2)nc(-c2cccnc2)n1	ZINC000067724725	221276207	/nfs/dbraw/zinc/27/62/07/221276207.db2.gz	QMEQIVFTMOPVPP-UHFFFAOYSA-N	-1	0	364.434	2.781	50	0		FFAARM
O=C([O-])c1cccnc1N1CCOc2c(O)cc(-c3cccnc3)cc2C1	ZINC000067677600	221270749	/nfs/dbraw/zinc/27/07/49/221270749.db2.gz	AWKMQJZHIXNDRX-UHFFFAOYSA-N	-1	0	363.373	2.946	50	0		FFAARM
Cc1nn(CC(=O)[O-])c2c1[C@H](c1[nH]c3c(cccc3C)c1C)CC(=O)N2	ZINC000067805080	221289106	/nfs/dbraw/zinc/28/91/06/221289106.db2.gz	WOAKJKHZNYNUNJ-CYBMUJFWSA-N	-1	0	352.394	2.848	50	0		FFAARM
CC1(C)[C@H](C(=O)[O-])[C@H]1C(=O)Nc1ccc(C(=O)NC2CC2)c(Cl)c1	ZINC000071284840	221339071	/nfs/dbraw/zinc/33/90/71/221339071.db2.gz	YHKFJQXZXOEINQ-STQMWFEESA-N	-1	0	350.802	2.528	50	0		FFAARM
Cc1cc2nc(CN3CCO[C@H](c4ccc(Cl)cc4)C3)cc(=O)n2[n-]1	ZINC000071754116	221365595	/nfs/dbraw/zinc/36/55/95/221365595.db2.gz	QUWOKKUKZDXCPE-INIZCTEOSA-N	-1	0	358.829	2.558	50	0		FFAARM
O=C([O-])CCc1cc2n(n1)CCN(Cc1cc(C3CCCCC3)no1)C2	ZINC000072149971	221427583	/nfs/dbraw/zinc/42/75/83/221427583.db2.gz	XJLUBGOCBYWFQO-UHFFFAOYSA-N	-1	0	358.442	2.952	50	0		FFAARM
CCc1nccn1CCC(=O)N1CC[C@@H](Cc2ccc(C(=O)[O-])cc2)C1	ZINC000072420392	221510080	/nfs/dbraw/zinc/51/00/80/221510080.db2.gz	WCVFUECORJIQBP-INIZCTEOSA-N	-1	0	355.438	2.625	50	0		FFAARM
O=C([O-])C1(Oc2ccccc2)CCN(C(=O)CCc2cccnc2)CC1	ZINC000072426950	221515774	/nfs/dbraw/zinc/51/57/74/221515774.db2.gz	KWVZHHBZOSHXCU-UHFFFAOYSA-N	-1	0	354.406	2.539	50	0		FFAARM
Cc1nccnc1N1CCN(C(=O)c2c([O-])cc(Cl)cc2Cl)CC1	ZINC000332380733	258228050	/nfs/dbraw/zinc/22/80/50/258228050.db2.gz	GQIAYQYUXWUSEW-UHFFFAOYSA-N	-1	0	367.236	2.760	50	0		FFAARM
CN(C)c1cc(N2CCC[C@@](Cc3ccccc3F)(C(=O)[O-])C2)ncn1	ZINC000071523818	136139401	/nfs/dbraw/zinc/13/94/01/136139401.db2.gz	XAYSAMJTZPWKES-IBGZPJMESA-N	-1	0	358.417	2.596	50	0		FFAARM
Cc1ncc(C)c(N2CCC(C(=O)[O-])(n3ccc(-c4ccco4)n3)CC2)n1	ZINC000072473084	136148981	/nfs/dbraw/zinc/14/89/81/136148981.db2.gz	YDYXWRPCOFBTLG-UHFFFAOYSA-N	-1	0	367.409	2.630	50	0		FFAARM
CC[C@@H](NC(=O)c1ccc(N2CC(=O)N=C2[O-])cc1)c1nc(C)c(C)s1	ZINC000092001665	221826089	/nfs/dbraw/zinc/82/60/89/221826089.db2.gz	BPEZBHQOZITNFD-CQSZACIVSA-N	-1	0	372.450	2.697	50	0		FFAARM
COc1ccccc1C[C@H](CNC(=O)Cc1ccc(C)c(OC)c1)C(=O)[O-]	ZINC000095464097	221912290	/nfs/dbraw/zinc/91/22/90/221912290.db2.gz	AYDGNSLIEQXUOO-QGZVFWFLSA-N	-1	0	371.433	2.614	50	0		FFAARM
O=C([O-])C[C@@H]1c2ccccc2CCN1C(=O)c1cc(=O)[nH]c2ccccc21	ZINC000095520029	221944695	/nfs/dbraw/zinc/94/46/95/221944695.db2.gz	GTRBQKKMDQOPBV-GOSISDBHSA-N	-1	0	362.385	2.742	50	0		FFAARM
Cc1nc(CN2CCN([C@H](C(=O)[O-])c3cccc(C)c3F)CC2)cs1	ZINC000095520465	221947135	/nfs/dbraw/zinc/94/71/35/221947135.db2.gz	AJQKBTCHSONLFL-KRWDZBQOSA-N	-1	0	363.458	2.843	50	0		FFAARM
CC(NCc1ccc(F)cc1)=C1C(=O)[N-]C(=O)N(C2CCCCC2)C1=O	ZINC000101085061	222262424	/nfs/dbraw/zinc/26/24/24/222262424.db2.gz	UZEMNWNYKRIRQS-FOWTUZBSSA-N	-1	0	359.401	2.600	50	0		FFAARM
O=c1c2[n-][nH]n(Cc3cccc(Cl)c3)c=2c(=O)n1-c1ccc(F)cc1	ZINC000101167052	222263659	/nfs/dbraw/zinc/26/36/59/222263659.db2.gz	MRIWLHKSNCGDJN-GJZGRUSLSA-N	-1	0	358.760	2.973	50	0		FFAARM
COc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccc(Cl)cc4)c=3c2=O)cc1	ZINC000101167306	222264460	/nfs/dbraw/zinc/26/44/60/222264460.db2.gz	IQHMSWNFNCCDSA-CVEARBPZSA-N	-1	0	370.796	2.842	50	0		FFAARM
COc1cccc(Cn2[nH][n-]c3c(=O)n(-c4ccc(Cl)cc4)c(=O)c2=3)c1	ZINC000101167173	222264559	/nfs/dbraw/zinc/26/45/59/222264559.db2.gz	STYUSGHAVRJFAX-HOTGVXAUSA-N	-1	0	370.796	2.842	50	0		FFAARM
O=c1c2[n-][nH]n(Cc3cccc(F)c3)c=2c(=O)n1-c1ccc(F)c(F)c1	ZINC000101418124	222274268	/nfs/dbraw/zinc/27/42/68/222274268.db2.gz	NJSMIBPSWNKKPB-HUUCEWRRSA-N	-1	0	360.295	2.597	50	0		FFAARM
CCc1ccc(Cn2[nH][n-]c3c(=O)n(-c4ccc(OC)cc4)c(=O)c2=3)cc1	ZINC000101418021	222274485	/nfs/dbraw/zinc/27/44/85/222274485.db2.gz	KQUZKUDZMFKZDS-ZWKOTPCHSA-N	-1	0	364.405	2.751	50	0		FFAARM
Cc1ccccc1NC(=O)CSc1nc([O-])cc(=O)n1-c1ccccc1	ZINC000102536497	222300025	/nfs/dbraw/zinc/30/00/25/222300025.db2.gz	IKFAQNOPSCZTEH-UHFFFAOYSA-N	-1	0	367.430	2.977	50	0		FFAARM
Cc1nn(Cc2cccc(Cl)c2)cc1C(=O)N1CCCC[C@@H]1C(=O)[O-]	ZINC000128587544	222535981	/nfs/dbraw/zinc/53/59/81/222535981.db2.gz	UQURAOITPIFQQC-MRXNPFEDSA-N	-1	0	361.829	2.973	50	0		FFAARM
CC[C@@H](NC(=O)Cc1c(C)c2cc3c(C)coc3cc2oc1=O)C(=O)[O-]	ZINC000002104662	506272420	/nfs/dbraw/zinc/27/24/20/506272420.db2.gz	WNELPCFAEUUHGI-CQSZACIVSA-N	-1	0	357.362	2.678	50	0	biogenic	FFAARM
CCC[C@H](NC(=O)[C@@H](C)Oc1ccc2c(C)c(C)c(=O)oc2c1)C(=O)[O-]	ZINC000002148865	506272796	/nfs/dbraw/zinc/27/27/96/506272796.db2.gz	VLNIJXQNIVYZFO-DOMZBBRYSA-N	-1	0	361.394	2.547	50	0	biogenic	FFAARM
O=C([O-])C[C@H](C(=O)N(c1ccccc1)c1ccccc1)N1CCOCC1	ZINC000002246349	506275599	/nfs/dbraw/zinc/27/55/99/506275599.db2.gz	LSIICUZIHOSMKT-GOSISDBHSA-N	-1	0	354.406	2.527	50	0		FFAARM
CCOc1ccc(S(=O)(=O)[N-]c2nc3ccccc3nc2NC)cc1	ZINC000032667843	506276036	/nfs/dbraw/zinc/27/60/36/506276036.db2.gz	APQGKUFZDWUERG-UHFFFAOYSA-N	-1	0	358.423	2.871	50	0		FFAARM
CCN1CCCn2cc(S(=O)(=O)[N-]c3cccc(Cl)c3)cc2C1=O	ZINC000065258770	506277570	/nfs/dbraw/zinc/27/75/70/506277570.db2.gz	UMVIBRWOUYRBKH-UHFFFAOYSA-N	-1	0	367.858	2.808	50	0		FFAARM
O=C([O-])CCC(=O)CNC(=O)OCC1c2ccccc2-c2ccccc21	ZINC000002583310	506283042	/nfs/dbraw/zinc/28/30/42/506283042.db2.gz	OLPYMFLIIGLEOU-UHFFFAOYSA-N	-1	0	353.374	2.959	50	0		FFAARM
Cc1c(S(=O)(=O)[N-]c2ccc(OC(F)F)c(Cl)c2)cnn1C	ZINC000002792104	506293437	/nfs/dbraw/zinc/29/34/37/506293437.db2.gz	NJDNVSCDNUNOGZ-UHFFFAOYSA-N	-1	0	351.762	2.784	50	0		FFAARM
O=C([O-])c1ccc(F)cc1NC(=O)CSc1nnc(NC2CC2)s1	ZINC000032837652	506301378	/nfs/dbraw/zinc/30/13/78/506301378.db2.gz	GOKVUTFAFRNVGR-UHFFFAOYSA-N	-1	0	368.415	2.681	50	0		FFAARM
Cc1ccc(Cn2c(=O)c3cc(N4CCOCC4)ccc3[n-]c2=S)o1	ZINC000002976019	506305926	/nfs/dbraw/zinc/30/59/26/506305926.db2.gz	IKVUETCZVRQFJA-UHFFFAOYSA-N	-1	0	357.435	2.845	50	0		FFAARM
Cc1cc(=O)oc2cc(OCC(=O)Nc3ccc(O)c(C(=O)[O-])c3)ccc12	ZINC000004038781	506354664	/nfs/dbraw/zinc/35/46/64/506354664.db2.gz	OAEIFWRUWWMEQK-UHFFFAOYSA-N	-1	0	369.329	2.523	50	0	biogenic	FFAARM
CCOc1cc(/C=C2\NC(=O)[N-]C2=O)ccc1OCc1cccc(F)c1	ZINC000033286647	506353938	/nfs/dbraw/zinc/35/39/38/506353938.db2.gz	JHZOUUJJONNLNQ-DHDCSXOGSA-N	-1	0	356.353	2.984	50	0		FFAARM
O=C([O-])CSCC(=O)N1CCc2c3ccccc3[nH]c2[C@H]1C(F)(F)F	ZINC000004389896	506374387	/nfs/dbraw/zinc/37/43/87/506374387.db2.gz	ZKIBSSZBNRZUDP-HNNXBMFYSA-N	-1	0	372.368	2.974	50	0		FFAARM
CC[C@@H](NC(=O)c1ccccc1NC(=O)c1ccc(OC)cc1)C(=O)[O-]	ZINC000004817643	506397782	/nfs/dbraw/zinc/39/77/82/506397782.db2.gz	ICPRRRIOSWIIEG-OAHLLOKOSA-N	-1	0	356.378	2.541	50	0		FFAARM
COc1ccc(CCNC(=O)[C@@H]2CC(C)=C(C)C[C@@H]2C(=O)[O-])cc1OC	ZINC000004894537	506402218	/nfs/dbraw/zinc/40/22/18/506402218.db2.gz	UYOJBKFIFVXBNI-CVEARBPZSA-N	-1	0	361.438	2.810	50	0		FFAARM
NC(=O)c1c2[nH]c(=O)cc([O-])c2sc1SCCOc1ccccc1	ZINC000036359854	506402500	/nfs/dbraw/zinc/40/25/00/506402500.db2.gz	LZHBRSJZHJTPMT-UHFFFAOYSA-N	-1	0	362.432	2.565	50	0		FFAARM
O=C(CSc1nnc(Cc2cccnc2)c(=O)[n-]1)c1ccc(F)cc1	ZINC000036646242	506410521	/nfs/dbraw/zinc/41/05/21/506410521.db2.gz	QGARLKRECXAEGA-UHFFFAOYSA-N	-1	0	356.382	2.677	50	0		FFAARM
Cc1cc(C)cc(N2C[C@@H](C(=O)Nc3ccc(C(=O)[O-])cc3)CC2=O)c1	ZINC000005028135	506416297	/nfs/dbraw/zinc/41/62/97/506416297.db2.gz	SLRXALMNCVOLIJ-HNNXBMFYSA-N	-1	0	352.390	2.993	50	0		FFAARM
COC(=O)c1ccc(Nc2nnc(Cc3ccc(C)cc3)c(=O)[n-]2)cc1	ZINC000005154439	506425838	/nfs/dbraw/zinc/42/58/38/506425838.db2.gz	ODAHFRJFGGMPLG-UHFFFAOYSA-N	-1	0	350.378	2.594	50	0		FFAARM
Cc1ccc(C(=O)[C@@H](C)OC(=O)c2ccccc2[N-]S(C)(=O)=O)cc1	ZINC000005574117	506450152	/nfs/dbraw/zinc/45/01/52/506450152.db2.gz	ANEAMSJGPDBRNQ-CYBMUJFWSA-N	-1	0	361.419	2.795	50	0		FFAARM
Cc1oc2c(c1C)c(C)cc1oc(=O)c(CC(=O)N[C@@H](C)C(=O)[O-])c(C)c21	ZINC000006624072	506492731	/nfs/dbraw/zinc/49/27/31/506492731.db2.gz	HUZSUPMQXZVCLD-NSHDSACASA-N	-1	0	371.389	2.905	50	0	biogenic	FFAARM
COC(=O)N1CCCc2cc(NC(=O)[C@@H]3CC=CC[C@@H]3C(=O)[O-])ccc21	ZINC000006668247	506495444	/nfs/dbraw/zinc/49/54/44/506495444.db2.gz	KPFUFQIEFZZIBO-CABCVRRESA-N	-1	0	358.394	2.811	50	0		FFAARM
Cc1noc(C)c1CCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)[O-]	ZINC000008312553	506642068	/nfs/dbraw/zinc/64/20/68/506642068.db2.gz	CBVKXAASWJHTCS-KRWDZBQOSA-N	-1	0	355.394	2.517	50	0		FFAARM
COC(=O)c1sccc1S(=O)(=O)[N-]c1ccc(OC(F)F)cc1	ZINC000008746749	506666263	/nfs/dbraw/zinc/66/62/63/506666263.db2.gz	XJKHJKZPQOOADJ-UHFFFAOYSA-N	-1	0	363.363	2.937	50	0		FFAARM
CC(=O)N1CCc2ccc([N-]S(=O)(=O)c3ccc(F)cc3F)cc2C1	ZINC000008976895	506676303	/nfs/dbraw/zinc/67/63/03/506676303.db2.gz	IAKZWVFZBUUCHP-UHFFFAOYSA-N	-1	0	366.389	2.670	50	0		FFAARM
CCCCN1C(=O)[N-]C(=O)C(=C(CC)Nc2ccc(NC(C)=O)cc2)C1=O	ZINC000009245829	506687966	/nfs/dbraw/zinc/68/79/66/506687966.db2.gz	OVAXHIWKDDLRED-FOCLMDBBSA-N	-1	0	372.425	2.600	50	0		FFAARM
Cc1nc(CSCC(=O)Nn2c(=S)[n-]nc2-c2ccco2)cs1	ZINC000009447727	506697622	/nfs/dbraw/zinc/69/76/22/506697622.db2.gz	LHCBXFSRTNOTJQ-UHFFFAOYSA-N	-1	0	367.481	2.969	50	0		FFAARM
Cc1nn(C)cc1-c1cc(C(F)(F)F)c2c(C)nn(CC(=O)[O-])c2n1	ZINC000012395242	506859663	/nfs/dbraw/zinc/85/96/63/506859663.db2.gz	WYWZDUUJDLRUID-UHFFFAOYSA-N	-1	0	353.304	2.552	50	0		FFAARM
COc1cc(S(=O)(=O)Nc2ccc(C)cc2F)cc(C(=O)[O-])c1OC	ZINC000045946427	507049910	/nfs/dbraw/zinc/04/99/10/507049910.db2.gz	UHQZIRFJPTZYTI-UHFFFAOYSA-N	-1	0	369.370	2.650	50	0		FFAARM
CCc1nc2sc([C@H](c3ccc(F)cc3)N3CCOCC3)c([O-])n2n1	ZINC000022854218	507315216	/nfs/dbraw/zinc/31/52/16/507315216.db2.gz	JJUTZYMAYNOINH-AWEZNQCLSA-N	-1	0	362.430	2.620	50	0		FFAARM
COc1cccc(-n2c(=O)c3[n-][nH]n(-c4cc(C)cc(C)c4)c=3c2=O)c1	ZINC000023125738	507331773	/nfs/dbraw/zinc/33/17/73/507331773.db2.gz	DIHZGIPQQNGOFB-IAGOWNOFSA-N	-1	0	350.378	2.810	50	0		FFAARM
COc1ccc(C(=O)[O-])cc1S(=O)(=O)N1CCCc2cccc(F)c21	ZINC000025473767	507503327	/nfs/dbraw/zinc/50/33/27/507503327.db2.gz	GLAOIHCTXBRCCS-UHFFFAOYSA-N	-1	0	365.382	2.674	50	0		FFAARM
COC(=O)c1sc(SCC(=O)[O-])c(NC(=O)c2ccccc2)c1N	ZINC000027562619	507663930	/nfs/dbraw/zinc/66/39/30/507663930.db2.gz	KSVSWVHFUKEKDV-UHFFFAOYSA-N	-1	0	366.420	2.546	50	0		FFAARM
CCn1nc(C)c(C(=O)N2CC[C@@H](Cc3cccc(C(=O)[O-])c3)C2)c1C	ZINC000072155875	507763280	/nfs/dbraw/zinc/76/32/80/507763280.db2.gz	ONLLUQYBBUZSEI-INIZCTEOSA-N	-1	0	355.438	2.923	50	0		FFAARM
COc1cc(-n2cc(C(=O)[O-])c3ccccc3c2=O)cc(OC)c1OC	ZINC000072220552	507770894	/nfs/dbraw/zinc/77/08/94/507770894.db2.gz	VOBNJHBEVPVOHM-UHFFFAOYSA-N	-1	0	355.346	2.715	50	0		FFAARM
Cc1cnn(C2(C(=O)[O-])CCN(C(=O)c3cc4ccccc4o3)CC2)c1	ZINC000072421347	507787702	/nfs/dbraw/zinc/78/77/02/507787702.db2.gz	BNMKNWHSHIFFLX-UHFFFAOYSA-N	-1	0	353.378	2.654	50	0		FFAARM
Cc1ccccc1OC1(C(=O)[O-])CCN(C(=O)c2ccncc2F)CC1	ZINC000072463197	507794171	/nfs/dbraw/zinc/79/41/71/507794171.db2.gz	HPFWXNFBZKRDSW-UHFFFAOYSA-N	-1	0	358.369	2.668	50	0		FFAARM
Cc1ccc(C(=O)N2C[C@@H](c3ccc4c(c3)OCO4)[C@H](C(=O)[O-])C2)cc1F	ZINC000091708136	508004188	/nfs/dbraw/zinc/00/41/88/508004188.db2.gz	SMCPBHRPZAWQQV-LSDHHAIUSA-N	-1	0	371.364	2.803	50	0		FFAARM
Cc1cc(N2CC[C@@]3(C2)CCCN(C)C3=O)nc(-c2ccccc2[O-])n1	ZINC000091756227	508008917	/nfs/dbraw/zinc/00/89/17/508008917.db2.gz	CFBVQIOOXLPENT-HXUWFJFHSA-N	-1	0	352.438	2.606	50	0		FFAARM
CC[C@H](NC(=O)c1ccc(N2CC(=O)N=C2[O-])cc1)c1nc(C)c(C)s1	ZINC000092001663	508031273	/nfs/dbraw/zinc/03/12/73/508031273.db2.gz	BPEZBHQOZITNFD-AWEZNQCLSA-N	-1	0	372.450	2.697	50	0		FFAARM
O=S(=O)([N-]c1cnc2ccccc2n1)c1ccc2c(c1)OCCCO2	ZINC000075106762	508083114	/nfs/dbraw/zinc/08/31/14/508083114.db2.gz	XMEHKNBBVKMVCT-UHFFFAOYSA-N	-1	0	357.391	2.592	50	0		FFAARM
C=CCn1c(SCC(=O)[O-])nc2sc3c(c2c1=O)C[C@H](C)CC3	ZINC000075271509	508092829	/nfs/dbraw/zinc/09/28/29/508092829.db2.gz	PUAPYRRSVWJYOF-SECBINFHSA-N	-1	0	350.465	2.946	50	0		FFAARM
CCOC(=O)c1[nH]c(C)c(S(=O)(=O)[N-]c2cc(C)ccc2OC)c1C	ZINC000075348049	508100574	/nfs/dbraw/zinc/10/05/74/508100574.db2.gz	JTHRYUJITUYARV-UHFFFAOYSA-N	-1	0	366.439	2.926	50	0		FFAARM
Cc1nc(CCNC(=O)c2cc(-c3ccccc3)on2)sc1C(=O)[O-]	ZINC000095359647	508176273	/nfs/dbraw/zinc/17/62/73/508176273.db2.gz	ZPPGCNYMJWTZPC-UHFFFAOYSA-N	-1	0	357.391	2.777	50	0		FFAARM
CCn1c(C)cc(C(=O)N2C[C@@H]3c4ccccc4OC[C@]3(C(=O)[O-])C2)c1C	ZINC000095369137	508178145	/nfs/dbraw/zinc/17/81/45/508178145.db2.gz	NBHQFXXNCCUKIN-DYESRHJHSA-N	-1	0	368.433	2.828	50	0		FFAARM
COc1cc(C(=O)N(C)Cc2cc(C(=O)[O-])c(C)o2)cc(OC)c1OC	ZINC000095425058	508184857	/nfs/dbraw/zinc/18/48/57/508184857.db2.gz	BPGMKEQZEBRPRU-UHFFFAOYSA-N	-1	0	363.366	2.584	50	0		FFAARM
COc1ccc(CCC(=O)NC[C@@H](Cc2ccccc2)C(=O)[O-])cc1F	ZINC000095425295	508184910	/nfs/dbraw/zinc/18/49/10/508184910.db2.gz	DWPQSESGSASIDD-MRXNPFEDSA-N	-1	0	359.397	2.827	50	0		FFAARM
Cc1c(Cl)cc(C(=O)N2Cc3nc[nH]c3C[C@@H]2C(=O)[O-])cc1Cl	ZINC000095496583	508188876	/nfs/dbraw/zinc/18/88/76/508188876.db2.gz	QMWGUSQJWMDRLS-CYBMUJFWSA-N	-1	0	354.193	2.677	50	0		FFAARM
Cc1ccnc([N-]S(=O)(=O)c2cc(Br)c(C)cc2C)c1	ZINC000095946073	508198763	/nfs/dbraw/zinc/19/87/63/508198763.db2.gz	NEPUPEOTNFKFIL-UHFFFAOYSA-N	-1	0	355.257	3.570	50	0		FFAARM
O=C([O-])C[C@H]1c2ccccc2CCN1C(=O)c1cc(=O)[nH]c2ccccc21	ZINC000095520030	508194032	/nfs/dbraw/zinc/19/40/32/508194032.db2.gz	GTRBQKKMDQOPBV-SFHVURJKSA-N	-1	0	362.385	2.742	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)c1ccc(NC(=O)c2cccs2)cc1)C1CC1	ZINC000095970327	508199947	/nfs/dbraw/zinc/19/99/47/508199947.db2.gz	CHYJEKLMTLORRL-CQSZACIVSA-N	-1	0	358.419	2.984	50	0		FFAARM
COc1ccc(C(=O)N2CCS[C@@H]3CCCC[C@@H]32)cc1OCC(=O)[O-]	ZINC000095989968	508200746	/nfs/dbraw/zinc/20/07/46/508200746.db2.gz	SPPXFQRKUYDBCN-XJKSGUPXSA-N	-1	0	365.451	2.659	50	0		FFAARM
O=C(c1ccccc1)N1CCc2nc3cc(-c4ccccc4)[n-]n3c(=O)c2C1	ZINC000097151624	508220043	/nfs/dbraw/zinc/22/00/43/508220043.db2.gz	QJWQHSRBPACBPD-UHFFFAOYSA-N	-1	0	370.412	2.888	50	0		FFAARM
O=C([O-])c1ccc(NS(=O)(=O)N2CCCCC2)cc1C(F)(F)F	ZINC000120314584	508971560	/nfs/dbraw/zinc/97/15/60/508971560.db2.gz	ZOAWYCGHPXUZSB-UHFFFAOYSA-N	-1	0	352.334	2.546	50	0		FFAARM
O=S(=O)([N-][C@H](c1cccnc1)C1CCOCC1)c1c(F)cccc1F	ZINC000225624128	509380153	/nfs/dbraw/zinc/38/01/53/509380153.db2.gz	MTGNSORHOHVPNV-INIZCTEOSA-N	-1	0	368.405	2.806	50	0		FFAARM
CC(C)[S@@](=O)c1ccc(C(=O)N2CCC[C@@H](CCC(=O)[O-])C2)cc1	ZINC000236696295	509482959	/nfs/dbraw/zinc/48/29/59/509482959.db2.gz	LBCDLKXXRPZFQB-LFPIHBKWSA-N	-1	0	351.468	2.920	50	0		FFAARM
CCOc1ccc(-c2nc(CC(=O)N3CC[C@@H](C(=O)[O-])C3)cs2)cc1	ZINC000236869711	509519552	/nfs/dbraw/zinc/51/95/52/509519552.db2.gz	HUILBNKVXUANDI-CYBMUJFWSA-N	-1	0	360.435	2.684	50	0		FFAARM
CC[C@H](C)N(CC(=O)[O-])C(=O)c1ccc(CN2C[C@@H](C)O[C@@H](C)C2)cc1	ZINC000236933307	509535787	/nfs/dbraw/zinc/53/57/87/509535787.db2.gz	FMMZQOGSPVUYJX-HRCADAONSA-N	-1	0	362.470	2.621	50	0		FFAARM
CN(Cc1ccc(C(=O)[O-])cc1)C(=O)CC[C@H]1Cc2ccccc2NC1=O	ZINC000237024294	509553550	/nfs/dbraw/zinc/55/35/50/509553550.db2.gz	YFHASXORNJPLPH-KRWDZBQOSA-N	-1	0	366.417	2.934	50	0		FFAARM
CC(C)c1nnc([N-]S(=O)(=O)c2ccc3c(c2)OCCCO3)s1	ZINC000267615226	509566910	/nfs/dbraw/zinc/56/69/10/509566910.db2.gz	DNMHHASYDCCLDT-UHFFFAOYSA-N	-1	0	355.441	2.624	50	0		FFAARM
O=C([O-])[C@@H]1CCCN(C(=O)C2CCN(c3nc4ccccc4s3)CC2)C1	ZINC000165380480	509569100	/nfs/dbraw/zinc/56/91/00/509569100.db2.gz	OCSFIRVUOAKSQQ-CQSZACIVSA-N	-1	0	373.478	2.836	50	0		FFAARM
COc1ccc(Cl)cc1N1CC[C@@H](NC(=O)CC(C)(C)C(=O)[O-])C1	ZINC000237102339	509572312	/nfs/dbraw/zinc/57/23/12/509572312.db2.gz	BIZWRTQKWBPHCV-GFCCVEGCSA-N	-1	0	354.834	2.544	50	0		FFAARM
COc1ccc(Br)c(C(=O)N(C[C@@H](C)C(=O)[O-])C2CC2)c1	ZINC000237316205	509619047	/nfs/dbraw/zinc/61/90/47/509619047.db2.gz	BRCXSIAUWOPUFA-SECBINFHSA-N	-1	0	356.216	2.783	50	0		FFAARM
Cc1cc(=O)n2nc(CSc3ncnc4sc5c(c43)CCC5)[n-]c2n1	ZINC000170595582	509673461	/nfs/dbraw/zinc/67/34/61/509673461.db2.gz	ADARYMCTEQQWEU-UHFFFAOYSA-N	-1	0	370.463	2.512	50	0		FFAARM
Cc1nn(Cc2ccc(F)cc2)c(Cl)c1C(=O)N1CC[C@@H](C(=O)[O-])C1	ZINC000237604153	509687945	/nfs/dbraw/zinc/68/79/45/509687945.db2.gz	KNDRBDVDQSWSEM-GFCCVEGCSA-N	-1	0	365.792	2.579	50	0		FFAARM
C[C@@]1(C(=O)[O-])CCN(C(=O)C2(c3ccccc3Cl)CCOCC2)C1	ZINC000237642775	509700043	/nfs/dbraw/zinc/70/00/43/509700043.db2.gz	HRYVLPAAMKWHIB-QGZVFWFLSA-N	-1	0	351.830	2.711	50	0		FFAARM
O=C([O-])c1csc(CNC(=O)C2=Cc3cc(Cl)ccc3OC2)n1	ZINC000173656148	509703711	/nfs/dbraw/zinc/70/37/11/509703711.db2.gz	MOVDYUKRPCVOAL-UHFFFAOYSA-N	-1	0	350.783	2.587	50	0		FFAARM
Cc1nn(-c2ccc(F)cc2)c(Cl)c1C(=O)N1CC[C@@](C)(C(=O)[O-])C1	ZINC000237768594	509730249	/nfs/dbraw/zinc/73/02/49/509730249.db2.gz	WDABVDQIAOMZIJ-QGZVFWFLSA-N	-1	0	365.792	2.910	50	0		FFAARM
O=C([O-])CN(C(=O)[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F)C1CCOCC1	ZINC000238103545	509821467	/nfs/dbraw/zinc/82/14/67/509821467.db2.gz	OUAFEDIYTWENKY-ZIAGYGMSSA-N	-1	0	371.355	2.901	50	0		FFAARM
O=C([O-])CCN(C[C@H]1CCCO1)C(=O)c1cc(F)cc(Br)c1	ZINC000238105810	509822267	/nfs/dbraw/zinc/82/22/67/509822267.db2.gz	SCAAGDIVSUMMFK-CYBMUJFWSA-N	-1	0	374.206	2.684	50	0		FFAARM
O=C([O-])CN(Cc1ccc(C(F)(F)F)cc1)C(=O)[C@@H]1CC12CCOCC2	ZINC000238131730	509826158	/nfs/dbraw/zinc/82/61/58/509826158.db2.gz	VUTAVUHDOZHDFJ-AWEZNQCLSA-N	-1	0	371.355	2.935	50	0		FFAARM
Cc1cc([C@@H]2CCCCN2CC(=O)Nc2nc(C)c(C(=O)[O-])s2)no1	ZINC000240128285	509839645	/nfs/dbraw/zinc/83/96/45/509839645.db2.gz	IPIUIFGAQSJSQS-LBPRGKRZSA-N	-1	0	364.427	2.612	50	0		FFAARM
COc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)NC(C)C)cc2)c(F)c1	ZINC000241124328	509842575	/nfs/dbraw/zinc/84/25/75/509842575.db2.gz	JHJJIEGJPZGQFH-UHFFFAOYSA-N	-1	0	366.414	2.773	50	0		FFAARM
Cc1nc(CN(C)CC(=O)Nc2ccc(Cl)c(C(=O)[O-])c2)cs1	ZINC000252509064	509847869	/nfs/dbraw/zinc/84/78/69/509847869.db2.gz	YBYBVJSZJZVKQB-UHFFFAOYSA-N	-1	0	353.831	2.874	50	0		FFAARM
COc1cc(S(=O)(=O)[N-]c2ccnn2Cc2ccc(C)o2)ccc1F	ZINC000252536346	509850714	/nfs/dbraw/zinc/85/07/14/509850714.db2.gz	IFKWWQMUXPNKKG-UHFFFAOYSA-N	-1	0	365.386	2.781	50	0		FFAARM
CCOC(=O)c1ccc2nc(NC(=O)[C@@H]3CC[C@H](C(=O)[O-])C3)sc2c1	ZINC000253473059	509884120	/nfs/dbraw/zinc/88/41/20/509884120.db2.gz	REMWYSZLJZYGFU-ZJUUUORDSA-N	-1	0	362.407	2.912	50	0		FFAARM
CCO[C@H]1C[C@](NC(=O)c2ccc(-n3ccc(C)n3)cc2)(C(=O)[O-])C1(C)C	ZINC000262837735	510434063	/nfs/dbraw/zinc/43/40/63/510434063.db2.gz	SVOFYEKXNSZSPW-JXFKEZNVSA-N	-1	0	371.437	2.569	50	0		FFAARM
O=C([O-])[C@@H](CNC(=O)c1ccc2c(c1)OCCCO2)c1ccc(F)cc1	ZINC000262963323	510497384	/nfs/dbraw/zinc/49/73/84/510497384.db2.gz	RXKZYOUGVVJVLL-HNNXBMFYSA-N	-1	0	359.353	2.585	50	0		FFAARM
C[C@H](c1ccccc1)N1C[C@H](C(=O)NCc2ccc(C(=O)[O-])s2)CC1=O	ZINC000263164958	510592941	/nfs/dbraw/zinc/59/29/41/510592941.db2.gz	ISBHIUOAQJEANN-TZMCWYRMSA-N	-1	0	372.446	2.672	50	0		FFAARM
COc1ccc(S(=O)(=O)N2CC3(CC3)c3ccccc32)cc1CC(=O)[O-]	ZINC000271602774	511259305	/nfs/dbraw/zinc/25/93/05/511259305.db2.gz	INPBJTTXJIQTDM-UHFFFAOYSA-N	-1	0	373.430	2.563	50	0		FFAARM
Cc1ccc(CN(C)CC(=O)N2CC[C@](C(=O)[O-])(c3ccccc3)C2)cc1	ZINC000299797441	533870035	/nfs/dbraw/zinc/87/00/35/533870035.db2.gz	OGJXKJABNMJQEZ-JOCHJYFZSA-N	-1	0	366.461	2.682	50	0		FFAARM
Cc1cc(C(=O)N[C@H](C)c2n[nH]c(CC(=O)[O-])n2)sc1-c1ccccc1	ZINC000426622896	513997728	/nfs/dbraw/zinc/99/77/28/513997728.db2.gz	GCWPSMMPYTUHBJ-LLVKDONJSA-N	-1	0	370.434	2.960	50	0		FFAARM
O=C([O-])c1cccc(CNC(=O)c2ccc(OC3CCOCC3)cc2)c1	ZINC000532001603	516749524	/nfs/dbraw/zinc/74/95/24/516749524.db2.gz	SXHWDYMQJKHIRX-UHFFFAOYSA-N	-1	0	355.390	2.873	50	0		FFAARM
C[C@@H]1CN(Cc2ccccc2NC(=O)c2ccc(C(=O)[O-])nc2)C[C@@H](C)O1	ZINC000612566418	520024589	/nfs/dbraw/zinc/02/45/89/520024589.db2.gz	KRGMRPTUAGJCFB-ZIAGYGMSSA-N	-1	0	369.421	2.641	50	0		FFAARM
CCOc1c(Br)cc(C(=O)N2CCC[C@H]2C(=O)[O-])cc1OC	ZINC000262659634	520592041	/nfs/dbraw/zinc/59/20/41/520592041.db2.gz	MNEUDQLXZDAMPT-NSHDSACASA-N	-1	0	372.215	2.546	50	0		FFAARM
COc1cc(/C=C\C(=O)N2CCCC[C@@H]2C(=O)[O-])cc(Cl)c1OC	ZINC000606441052	521068651	/nfs/dbraw/zinc/06/86/51/521068651.db2.gz	KAMDWWBTXWJDNI-FMFIFOJESA-N	-1	0	353.802	2.836	50	0		FFAARM
COc1cccc([C@@H]2CN(C(=O)CCc3scnc3C)C[C@H]2C(=O)[O-])c1	ZINC000091321902	524120825	/nfs/dbraw/zinc/12/08/25/524120825.db2.gz	MCUNVQJCLNNMLY-JKSUJKDBSA-N	-1	0	374.462	2.720	50	0		FFAARM
COc1cccc(SCC(=O)N2C[C@@H](c3cccnc3)[C@H](C(=O)[O-])C2)c1	ZINC000091593742	526245051	/nfs/dbraw/zinc/24/50/51/526245051.db2.gz	UEZKSEYETZBARK-DLBZAZTESA-N	-1	0	372.446	2.509	50	0		FFAARM
Cc1cc(C(=O)N2CC[C@H](C(=O)[O-])C2)cc(C)c1OCc1cccnc1	ZINC000178273725	526259561	/nfs/dbraw/zinc/25/95/61/526259561.db2.gz	LMJWQNKOSSFMDR-INIZCTEOSA-N	-1	0	354.406	2.824	50	0		FFAARM
O=C([O-])c1ccc(CNC(=O)[C@@H]2C[C@@H]2c2ccc3c(c2)OCCO3)cc1	ZINC000268943900	526367919	/nfs/dbraw/zinc/36/79/19/526367919.db2.gz	NOZSCKXCFJBBJB-HZPDHXFCSA-N	-1	0	353.374	2.576	50	0		FFAARM
Cc1nc(COc2ccc(F)cc2)sc1C(=O)N1CC[C@H](C(=O)[O-])C1	ZINC000178263014	526906858	/nfs/dbraw/zinc/90/68/58/526906858.db2.gz	LQBXWXVBIUYMJZ-NSHDSACASA-N	-1	0	364.398	2.716	50	0		FFAARM
O=C(Nc1ccc(OC(F)(F)F)cc1)C([O-])=C1C(=O)Nc2ccccc21	ZINC000102232227	570829087	/nfs/dbraw/zinc/82/90/87/570829087.db2.gz	FBCBCDAOHNRICT-ZDUSSCGKSA-N	-1	0	364.279	2.829	50	0		FFAARM
COc1ccc(/C=N/NC(=O)c2cccc(Cl)c2)c(C(=O)[O-])c1OC	ZINC000005176279	571271103	/nfs/dbraw/zinc/27/11/03/571271103.db2.gz	IGJWNJZKFUWNDE-DJKKODMXSA-N	-1	0	362.769	2.819	50	0		FFAARM
CC(C)(C)OC(=O)N1C[C@@H](Oc2ccc(F)c(F)c2F)C[C@H]1C(=O)[O-]	ZINC000203303641	571309536	/nfs/dbraw/zinc/30/95/36/571309536.db2.gz	LIWYLJRQBPNXCT-WPRPVWTQSA-N	-1	0	361.316	2.945	50	0		FFAARM
Cc1nn(C(C)(C)C)c2nc(C3CC3)cc(C(=O)N3CC[C@@H](C(=O)[O-])C3)c12	ZINC000178256850	597495918	/nfs/dbraw/zinc/49/59/18/597495918.db2.gz	HWDIVHFHNXCJKZ-CYBMUJFWSA-N	-1	0	370.453	2.919	50	0		FFAARM
Cc1cccc(Oc2ncccc2NC(=O)N2CCO[C@H](C(=O)[O-])C2)c1C	ZINC000669496603	600008621	/nfs/dbraw/zinc/00/86/21/600008621.db2.gz	OTBQOVCYAMVMDQ-INIZCTEOSA-N	-1	0	371.393	2.808	50	0		FFAARM
CCC(CC)(NC(=O)[C@@H]1CCCN(C(=O)c2cc(C)cc(C)c2)C1)C(=O)[O-]	ZINC000585083518	600928224	/nfs/dbraw/zinc/92/82/24/600928224.db2.gz	JJDRCIDVLVPPAU-MRXNPFEDSA-N	-1	0	374.481	2.915	50	0		FFAARM
C[C@H](CCNC(=O)N1CCO[C@H](C(=O)[O-])C1)c1cccc(C(F)(F)F)c1	ZINC000666534283	600997669	/nfs/dbraw/zinc/99/76/69/600997669.db2.gz	HRRCHMOAHIDFQO-RISCZKNCSA-N	-1	0	374.359	2.694	50	0		FFAARM
CCCC(=O)Nc1ccc(S(=O)(=O)[N-]c2nnc(CC)s2)cc1	ZINC000798258362	740317471	/nfs/dbraw/zinc/31/74/71/740317471.db2.gz	WLVNTHPRCHNYJH-UHFFFAOYSA-N	-1	0	354.457	2.640	50	0		FFAARM
Cc1nn(C)c2[n-]c(C(=O)N[C@H]3CCCc4cnn(C(C)C)c43)cc(=O)c12	ZINC000952874965	1011006159	/nfs/dbraw/zinc/00/61/59/1011006159.db2.gz	LWCZOXXGXNIQEQ-ZDUSSCGKSA-N	-1	0	368.441	2.567	50	0		FFAARM
O=C([O-])c1cccnc1N1CCC2(CC1)CN(Cc1ccsc1)CCO2	ZINC000952969124	1011027696	/nfs/dbraw/zinc/02/76/96/1011027696.db2.gz	PLVNRCQBOFSELP-UHFFFAOYSA-N	-1	0	373.478	2.713	50	0		FFAARM
COc1ccccc1NC(=O)c1c([O-])c2cccc3c2n(c1=O)CCC3	ZINC000005486242	1012717119	/nfs/dbraw/zinc/71/71/19/1012717119.db2.gz	NLGKUFDAIZZXCV-UHFFFAOYSA-N	-1	0	350.374	2.914	50	0		FFAARM
C[C@@H](NC(=O)Nc1cccnc1-c1cnn(C)c1)[C@@H]1C[C@H](C(=O)[O-])C1(C)C	ZINC000653544473	1024939885	/nfs/dbraw/zinc/93/98/85/1024939885.db2.gz	YXTKNRNNJASKRD-KWCYVHTRSA-N	-1	0	371.441	2.739	50	0		FFAARM
COc1ccc([C@@H](C(=O)[O-])N(C)Cc2noc(C3CCC3)n2)cc1OC	ZINC001506403985	1059496544	/nfs/dbraw/zinc/49/65/44/1059496544.db2.gz	DJDPDOBBBQNFBA-INIZCTEOSA-N	-1	0	361.398	2.612	50	0		FFAARM
CCOC(=O)[C@@]([N-]c1nc2ccccc2s1)(NC(C)=O)C(F)(F)F	ZINC000003138606	204079893	/nfs/dbraw/zinc/07/98/93/204079893.db2.gz	ZDOQDSDMFVXPCV-ZDUSSCGKSA-N	-1	0	361.345	2.666	50	0		FFAARM
Cc1c(NC(=O)[C@@H](C)Cn2cc(Br)cn2)cccc1C(=O)[O-]	ZINC000002795298	204057954	/nfs/dbraw/zinc/05/79/54/204057954.db2.gz	CNXPYBNKZYOSCB-VIFPVBQESA-N	-1	0	366.215	2.927	50	0		FFAARM
CC(C)(C)c1ccc(S(=O)(=O)[N-]NC(=S)NC2CCCC2)cc1	ZINC000002853745	204062490	/nfs/dbraw/zinc/06/24/90/204062490.db2.gz	PUKRJUQRYOMBPY-UHFFFAOYSA-N	-1	0	355.529	2.584	50	0		FFAARM
O=C([O-])c1cccc(C(=O)Nc2cccc(NC(=O)[C@H]3CCCO3)c2)c1	ZINC000002879728	204064664	/nfs/dbraw/zinc/06/46/64/204064664.db2.gz	KFCQADYFMHHBFL-MRXNPFEDSA-N	-1	0	354.362	2.755	50	0		FFAARM
O=C([O-])[C@H]1CC=CC[C@H]1C(=O)N1CCN(C/C=C/c2ccccc2)CC1	ZINC000004179530	204125569	/nfs/dbraw/zinc/12/55/69/204125569.db2.gz	JLTLXEFNRIBPCX-APTSRADASA-N	-1	0	354.450	2.511	50	0		FFAARM
COc1cccc([C@H]2[C@H](C(=O)[O-])c3cc(OC)c(OC)cc3C(=O)N2C)c1	ZINC000004563432	204146542	/nfs/dbraw/zinc/14/65/42/204146542.db2.gz	OBUCYFWXYBYFPV-MSOLQXFVSA-N	-1	0	371.389	2.708	50	0		FFAARM
CC1=N/C(=C\c2ccc3c(c2)OCO3)C(=O)N1c1ccc(C(=O)[O-])cc1	ZINC000005343153	204203404	/nfs/dbraw/zinc/20/34/04/204203404.db2.gz	SEHQXKSMVZXHNX-NVNXTCNLSA-N	-1	0	350.330	2.920	50	0		FFAARM
CCc1ccc(NC(=O)[C@@H](Cc2cccc(OC)c2)c2nnn[n-]2)cc1	ZINC000005444921	204210098	/nfs/dbraw/zinc/21/00/98/204210098.db2.gz	HQFKHCPNNQLYMT-KRWDZBQOSA-N	-1	0	351.410	2.736	50	0		FFAARM
CC(C)(C)[C@H]1CCc2c(sc(NC(=O)/C=C/C(=O)[O-])c2C(N)=O)C1	ZINC000004894623	204173347	/nfs/dbraw/zinc/17/33/47/204173347.db2.gz	IFFHCVHIGTVBEE-UCUJLANTSA-N	-1	0	350.440	2.577	50	0		FFAARM
CSc1ccc(S(=O)(=O)N(CC(=O)[O-])c2ccc(C)cc2)cc1	ZINC000005022708	204184568	/nfs/dbraw/zinc/18/45/68/204184568.db2.gz	VIFVZVZVLRODGB-UHFFFAOYSA-N	-1	0	351.449	2.997	50	0		FFAARM
CC(C)C[C@H](NC(=O)/C(=C\c1ccccc1)NC(=O)c1ccco1)C(=O)[O-]	ZINC000005092882	204192175	/nfs/dbraw/zinc/19/21/75/204192175.db2.gz	RZEPHDIOWHZEQV-STTHAQSSSA-N	-1	0	370.405	2.666	50	0		FFAARM
CS(=O)(=O)[N-]c1ccccc1C(=O)NCCSCc1ccccc1	ZINC000006268617	204243035	/nfs/dbraw/zinc/24/30/35/204243035.db2.gz	YWFKWHFIOLVJLK-UHFFFAOYSA-N	-1	0	364.492	2.721	50	0		FFAARM
C[C@@H]1CCc2c(sc(NC(=O)CCC(=O)[O-])c2C(=O)NC2CC2)C1	ZINC000006731028	204263807	/nfs/dbraw/zinc/26/38/07/204263807.db2.gz	JECAMYWEUHYMDE-SECBINFHSA-N	-1	0	350.440	2.568	50	0		FFAARM
N=c1occ(C(=O)c2cc(F)ccc2[O-])cc1C(=O)NC1CCCCC1	ZINC000006828725	204274555	/nfs/dbraw/zinc/27/45/55/204274555.db2.gz	WBJNYAWMVKFICP-UHFFFAOYSA-N	-1	0	358.369	2.897	50	0		FFAARM
CC(=O)Nc1cc(C(=O)CSc2nnc(NC3CC3)s2)ccc1[O-]	ZINC000008192142	204321344	/nfs/dbraw/zinc/32/13/44/204321344.db2.gz	RHVQNQUXKMXCEK-UHFFFAOYSA-N	-1	0	364.452	2.751	50	0		FFAARM
Cc1ccc(S(=O)(=O)[N-]NC(=S)Nc2ccc(F)c(Cl)c2)cc1	ZINC000008318327	204326342	/nfs/dbraw/zinc/32/63/42/204326342.db2.gz	JJLJOQOSOPPGKF-UHFFFAOYSA-N	-1	0	373.862	2.967	50	0		FFAARM
Cc1ccc(C2=Nn3c(nnc3[C@H]3CCCO3)S[C@H]2CC(=O)[O-])cc1	ZINC000008428708	204331167	/nfs/dbraw/zinc/33/11/67/204331167.db2.gz	UPWGLMBITHDUMP-OLZOCXBDSA-N	-1	0	358.423	2.639	50	0		FFAARM
COC(=O)[C@]([N-]c1nc2ccc(C)cc2s1)(NC(C)=O)C(F)(F)F	ZINC000008997123	204351807	/nfs/dbraw/zinc/35/18/07/204351807.db2.gz	CMEKODSTGXFTTR-CYBMUJFWSA-N	-1	0	361.345	2.584	50	0		FFAARM
CC(=O)Nc1ccc(S(=O)(=O)Nc2cc(C(=O)[O-])ccc2Cl)cc1	ZINC000036398789	205016138	/nfs/dbraw/zinc/01/61/38/205016138.db2.gz	JPEZFNXFDASFCD-UHFFFAOYSA-N	-1	0	368.798	2.797	50	0		FFAARM
O=C([O-])CNC(=O)CCn1ccc2cc(OCc3ccccc3)ccc21	ZINC000040312853	205066277	/nfs/dbraw/zinc/06/62/77/205066277.db2.gz	CAWQJWDPXSAWFF-UHFFFAOYSA-N	-1	0	352.390	2.811	50	0	biogenic	FFAARM
COc1cccc2c1ccn2CCC(=O)N[C@@H](Cc1ccccc1)C(=O)[O-]	ZINC000040309576	205066865	/nfs/dbraw/zinc/06/68/65/205066865.db2.gz	JNEMPMCHSLVUBQ-KRWDZBQOSA-N	-1	0	366.417	2.852	50	0	biogenic	FFAARM
COc1ccc(S(=O)(=O)[N-]C(=O)[C@@H]2[C@H](C=C(C)C)C2(C)C)cc1OC	ZINC000042295066	205095578	/nfs/dbraw/zinc/09/55/78/205095578.db2.gz	WVMXLKXRMGDETI-BBRMVZONSA-N	-1	0	367.467	2.747	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)c1ccc2c(c1)NC(=O)CS2)c1cccs1	ZINC000299741654	205123667	/nfs/dbraw/zinc/12/36/67/205123667.db2.gz	ABRONSZMLVSRIH-LLVKDONJSA-N	-1	0	362.432	2.738	50	0		FFAARM
Cc1oc(CNC(=O)c2cc(C)ccc2N2CCCC2=O)cc1C(=O)[O-]	ZINC000299742284	205123742	/nfs/dbraw/zinc/12/37/42/205123742.db2.gz	AYUIPZZOFCEOQD-UHFFFAOYSA-N	-1	0	356.378	2.651	50	0		FFAARM
O=C([O-])c1cccc(CNC(=O)C[C@H]2Sc3ccccc3NC2=O)c1	ZINC000299744965	205125976	/nfs/dbraw/zinc/12/59/76/205125976.db2.gz	QHOUFIFPINEDFV-OAHLLOKOSA-N	-1	0	356.403	2.504	50	0		FFAARM
Cc1nn(-c2ccc(F)cc2F)c(C)c1C(=O)N1CC[C@@](C)(C(=O)[O-])C1	ZINC000299745792	205127370	/nfs/dbraw/zinc/12/73/70/205127370.db2.gz	SKWVWGWNAVTHBW-GOSISDBHSA-N	-1	0	363.364	2.704	50	0		FFAARM
Cc1cc(Cl)ccc1OCC(=O)N(CCC(=O)[O-])C1CCOCC1	ZINC000299748703	205128143	/nfs/dbraw/zinc/12/81/43/205128143.db2.gz	HXDXAAZVYYSRKS-UHFFFAOYSA-N	-1	0	355.818	2.510	50	0		FFAARM
COc1cccc([C@@H]2C[C@H]2C(=O)N2Cc3ccccc3C[C@H]2C(=O)[O-])c1	ZINC000299752526	205134381	/nfs/dbraw/zinc/13/43/81/205134381.db2.gz	ULZMIHVMFPFTQD-OTWHNJEPSA-N	-1	0	351.402	2.837	50	0		FFAARM
Cc1oc(CNC(=O)c2cccc(OC[C@@H]3CCCO3)c2)cc1C(=O)[O-]	ZINC000299749683	205130629	/nfs/dbraw/zinc/13/06/29/205130629.db2.gz	LHNKCIBSNFWFMU-HNNXBMFYSA-N	-1	0	359.378	2.774	50	0		FFAARM
Cc1ccccc1OCCN(C)C(=O)c1ccccc1[N-]S(C)(=O)=O	ZINC000052987258	205188521	/nfs/dbraw/zinc/18/85/21/205188521.db2.gz	VAACYZBASSGRNH-UHFFFAOYSA-N	-1	0	362.451	2.518	50	0		FFAARM
CCC(CC)n1c(=O)n(Cc2cncn2CC)c2cc(C(=O)[O-])cnc21	ZINC000055252661	205213566	/nfs/dbraw/zinc/21/35/66/205213566.db2.gz	ZCKSIOBTPHOODL-UHFFFAOYSA-N	-1	0	357.414	2.522	50	0		FFAARM
COc1ccc(NC(C)=O)c([N-]S(=O)(=O)c2cc(F)cc(F)c2)c1	ZINC000057121936	205235269	/nfs/dbraw/zinc/23/52/69/205235269.db2.gz	MDGKFPIQJFYZEQ-UHFFFAOYSA-N	-1	0	356.350	2.733	50	0		FFAARM
Cc1cccc(C)c1NS(=O)(=O)c1cc2c(c(C(=O)[O-])c1)OCCO2	ZINC000057116013	205235876	/nfs/dbraw/zinc/23/58/76/205235876.db2.gz	GHGMLZHZHNYCRM-UHFFFAOYSA-N	-1	0	363.391	2.574	50	0		FFAARM
Cc1cc([N-]S(=O)(=O)c2cc3n(c2)CCN(C(C)C)C3=O)ccc1F	ZINC000065254786	205329537	/nfs/dbraw/zinc/32/95/37/205329537.db2.gz	IVEGMDAZGJLLHD-UHFFFAOYSA-N	-1	0	365.430	2.601	50	0		FFAARM
CCc1ccc([N-]S(=O)(=O)c2cc(-c3ccc(=O)[nH]n3)cs2)cc1	ZINC000065119298	205317869	/nfs/dbraw/zinc/31/78/69/205317869.db2.gz	ZISHIEIHVHCWCK-UHFFFAOYSA-N	-1	0	361.448	2.862	50	0		FFAARM
COc1ccc([N-]S(=O)(=O)c2c(C)nc3sc(C)nn32)c(C)c1	ZINC000065183680	205322133	/nfs/dbraw/zinc/32/21/33/205322133.db2.gz	QFASYIPJWMDYHU-UHFFFAOYSA-N	-1	0	352.441	2.525	50	0		FFAARM
Cc1ccccc1-n1c(SCC(=O)[O-])nnc1[C@@H](O)c1ccccc1	ZINC000065461878	205351802	/nfs/dbraw/zinc/35/18/02/205351802.db2.gz	GQEYRFXCBBIONR-INIZCTEOSA-N	-1	0	355.419	2.834	50	0		FFAARM
CSCCC(=O)N1CCC(Oc2cc(C)ccc2F)(C(=O)[O-])CC1	ZINC000072463902	205557389	/nfs/dbraw/zinc/55/73/89/205557389.db2.gz	DGYFGUIGUXDKDB-UHFFFAOYSA-N	-1	0	355.431	2.712	50	0		FFAARM
Cc1cc(C)n(C[C@@H](C)Nc2nccc(-c3cc(C(=O)[O-])ccn3)n2)n1	ZINC000077472616	205604865	/nfs/dbraw/zinc/60/48/65/205604865.db2.gz	RYZWWJBLYHXZDV-GFCCVEGCSA-N	-1	0	352.398	2.551	50	0		FFAARM
Cc1ccccc1[C@@H]1CN(C(=O)c2ccc(C(C)C)[nH]c2=O)C[C@H]1C(=O)[O-]	ZINC000091390793	205671918	/nfs/dbraw/zinc/67/19/18/205671918.db2.gz	XPEULYGPNSEHSU-DLBZAZTESA-N	-1	0	368.433	2.747	50	0		FFAARM
Cc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccccc4F)c=3c2=O)cc1C	ZINC000101418493	205960246	/nfs/dbraw/zinc/96/02/46/205960246.db2.gz	NHOKGYZPFLDVRX-IAGOWNOFSA-N	-1	0	352.369	2.936	50	0		FFAARM
CN1c2ccsc2C([O-])=C(C(=O)Nc2ccc(F)cc2)S1(=O)=O	ZINC000100326307	205943831	/nfs/dbraw/zinc/94/38/31/205943831.db2.gz	FWDTVDKARXJLEZ-UHFFFAOYSA-N	-1	0	354.384	2.532	50	0		FFAARM
COc1cc(S(=O)(=O)Nc2cccc(C)c2)cc(C(=O)[O-])c1OC	ZINC000045946174	206079707	/nfs/dbraw/zinc/07/97/07/206079707.db2.gz	BAXZURDQDLBSEH-UHFFFAOYSA-N	-1	0	351.380	2.511	50	0		FFAARM
COc1ccc(Br)cc1CCC(=O)N1CC[C@](C)(C(=O)[O-])C1	ZINC000237122060	206086978	/nfs/dbraw/zinc/08/69/78/206086978.db2.gz	LWRZIVFKZASQEQ-INIZCTEOSA-N	-1	0	370.243	2.714	50	0		FFAARM
Cc1ccc(OCCC(=O)N2CCC(C(=O)[O-])CC2)c(Br)c1	ZINC000237700770	206106800	/nfs/dbraw/zinc/10/68/00/206106800.db2.gz	QUQGUWPFDMRZKR-UHFFFAOYSA-N	-1	0	370.243	2.850	50	0		FFAARM
Cn1c2ccccc2c(Cl)c1C(=O)N(CCC(=O)[O-])C[C@@H]1CCCO1	ZINC000237709680	206106966	/nfs/dbraw/zinc/10/69/66/206106966.db2.gz	ITTZBPUVEQNPLE-LBPRGKRZSA-N	-1	0	364.829	2.928	50	0		FFAARM
Cc1cc(C(=O)N2CCC[C@@H]2C(=O)[O-])cc(C)c1OCc1cccnc1	ZINC000237691352	206107898	/nfs/dbraw/zinc/10/78/98/206107898.db2.gz	WXPJZCPIGAOYNQ-QGZVFWFLSA-N	-1	0	354.406	2.967	50	0		FFAARM
C[C@@]1(C(=O)[O-])CCN(C(=O)c2cc3cc(Br)ccc3[nH]2)C1	ZINC000237656172	206108047	/nfs/dbraw/zinc/10/80/47/206108047.db2.gz	PSWOAYYGGZDWFU-OAHLLOKOSA-N	-1	0	351.200	2.867	50	0		FFAARM
Cc1cc(C(=O)N2CCO[C@H](CC(=O)[O-])C2)c(C)n1Cc1cccs1	ZINC000237701619	206108073	/nfs/dbraw/zinc/10/80/73/206108073.db2.gz	CWMLLNUNCWIPRI-CQSZACIVSA-N	-1	0	362.451	2.530	50	0		FFAARM
O=C([O-])CN(C(=O)/C=C/c1csc(Br)c1)C1CCOCC1	ZINC000238106928	206113212	/nfs/dbraw/zinc/11/32/12/206113212.db2.gz	URAVCTUEYTYRFV-OWOJBTEDSA-N	-1	0	374.256	2.616	50	0		FFAARM
O=C([O-])CCN(C(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1F)C1CCOCC1	ZINC000238067904	206113702	/nfs/dbraw/zinc/11/37/02/206113702.db2.gz	PEMYCTQANMGCPC-HUUCEWRRSA-N	-1	0	353.365	2.551	50	0		FFAARM
O=C([O-])c1ccc(S(=O)(=O)N[C@H]2CCCC[C@@H]2C(F)(F)F)c(F)c1	ZINC000225436589	206117524	/nfs/dbraw/zinc/11/75/24/206117524.db2.gz	XFUCACKIMWFIBN-ONGXEEELSA-N	-1	0	369.336	2.923	50	0		FFAARM
Cc1ccc2nc(C)c(C(=O)N(CCC(=O)[O-])C3CCOCC3)cc2c1	ZINC000237897662	206109797	/nfs/dbraw/zinc/10/97/97/206109797.db2.gz	YPTBAPDBWQMEMY-UHFFFAOYSA-N	-1	0	356.422	2.948	50	0		FFAARM
Cc1nc(-c2ccc(C)cc2C)sc1C(=O)N1CCO[C@@H](C(=O)[O-])C1	ZINC000237759513	206110363	/nfs/dbraw/zinc/11/03/63/206110363.db2.gz	RTVINNYSDKBKCI-CQSZACIVSA-N	-1	0	360.435	2.661	50	0		FFAARM
O=C([O-])CC[C@H]1CCCCN1C(=O)c1cn(-c2ccccc2Cl)nn1	ZINC000237996952	206111432	/nfs/dbraw/zinc/11/14/32/206111432.db2.gz	ZSOCDBHJKXLUSC-GFCCVEGCSA-N	-1	0	362.817	2.780	50	0		FFAARM
COc1ccc(CNC(=O)c2c([O-])c3cccc4c3n(c2=O)[C@@H](C)C4)cc1	ZINC000170624698	206133017	/nfs/dbraw/zinc/13/30/17/206133017.db2.gz	ORXCZQVCOZDLMS-LBPRGKRZSA-N	-1	0	364.401	2.763	50	0		FFAARM
COC(=O)c1ccc(/C=C2\C(=O)[N-]N(c3ccc(F)c(Cl)c3)C2=O)cc1	ZINC000002138304	206153393	/nfs/dbraw/zinc/15/33/93/206153393.db2.gz	GMDFXXMEAPDZAS-MDWZMJQESA-N	-1	0	374.755	2.727	50	0		FFAARM
Cc1coc2c1cc1c(C)c(CC(=O)N[C@@H](C)C(=O)[O-])c(=O)oc1c2C	ZINC000002098001	206152433	/nfs/dbraw/zinc/15/24/33/206152433.db2.gz	RDKQYLVLSAGKJJ-NSHDSACASA-N	-1	0	357.362	2.596	50	0	biogenic	FFAARM
COc1ccc(C)cc1S(=O)(=O)[N-]c1ccc(N2CCCC2=O)cc1	ZINC000005329178	206194502	/nfs/dbraw/zinc/19/45/02/206194502.db2.gz	LYNADZVSGXNCFI-UHFFFAOYSA-N	-1	0	360.435	2.931	50	0		FFAARM
CC1=C(C(=O)OCc2ccccc2)[C@@H](c2ccc(C(=O)[O-])cc2)NC(=O)N1	ZINC000006395301	206200492	/nfs/dbraw/zinc/20/04/92/206200492.db2.gz	YSAQVCCFVBYDAF-QGZVFWFLSA-N	-1	0	366.373	2.756	50	0		FFAARM
CC[C@H](NC(=O)Cc1c(C)c2c3occ(C)c3c(C)cc2oc1=O)C(=O)[O-]	ZINC000006624255	206203263	/nfs/dbraw/zinc/20/32/63/206203263.db2.gz	PWYUJWJDHJNQJB-ZDUSSCGKSA-N	-1	0	371.389	2.986	50	0	biogenic	FFAARM
O=S(=O)([N-]c1ccc(S(=O)(=O)C(F)F)cc1)c1cccc(F)c1	ZINC000007052856	206244010	/nfs/dbraw/zinc/24/40/10/206244010.db2.gz	ADNAOQMXPYIKFV-UHFFFAOYSA-N	-1	0	365.354	2.623	50	0		FFAARM
O=C(c1ccc2c(c1)[n-]c(=S)n(Cc1ccco1)c2=O)N1CCCC1	ZINC000014051393	206307641	/nfs/dbraw/zinc/30/76/41/206307641.db2.gz	CPUXOUUSNKHKEL-UHFFFAOYSA-N	-1	0	355.419	2.563	50	0		FFAARM
CCN1CCN([C@@H](c2sc3nc(C)nn3c2[O-])c2ccc(C)cc2)CC1	ZINC000022458799	206378500	/nfs/dbraw/zinc/37/85/00/206378500.db2.gz	JNTVYBKXFADFAV-MRXNPFEDSA-N	-1	0	371.510	2.840	50	0		FFAARM
CCOC(=O)c1ccc(S(=O)(=O)Nc2cc(C(=O)[O-])ccc2F)cc1	ZINC000024432907	206408774	/nfs/dbraw/zinc/40/87/74/206408774.db2.gz	VYGRBKLSRPQMPH-UHFFFAOYSA-N	-1	0	367.354	2.501	50	0		FFAARM
O=S(=O)([N-]c1nncn1Cc1ccccc1)c1cc(F)ccc1Cl	ZINC000225397873	206476708	/nfs/dbraw/zinc/47/67/08/206476708.db2.gz	XDGJWGFFPGZIIW-UHFFFAOYSA-N	-1	0	366.805	2.920	50	0		FFAARM
CCOC(=O)c1cccc(NC(=O)C2=C([O-])CN(c3ccccc3)C2=O)c1	ZINC000227163549	206520788	/nfs/dbraw/zinc/52/07/88/206520788.db2.gz	CIXJHINDEQJGJP-UHFFFAOYSA-N	-1	0	366.373	2.661	50	0		FFAARM
COc1cc(S(=O)(=O)N(C)c2cccc(C)c2)cc(C(=O)[O-])c1OC	ZINC000065667809	206525839	/nfs/dbraw/zinc/52/58/39/206525839.db2.gz	WEKMBJILVHVEHM-UHFFFAOYSA-N	-1	0	365.407	2.536	50	0		FFAARM
COc1ccc(CN2CC(=O)N(c3cccc(C)c3)C[C@H]2C)cc1C(=O)[O-]	ZINC000082133512	132196705	/nfs/dbraw/zinc/19/67/05/132196705.db2.gz	YKSHNXGTBQCHGD-OAHLLOKOSA-N	-1	0	368.433	2.939	50	0		FFAARM
Cn1c(=O)c2ccc(C(=O)N3CCCc4ccccc43)cc2[n-]c1=S	ZINC000102750907	132236240	/nfs/dbraw/zinc/23/62/40/132236240.db2.gz	GAQGBRBNJINZFR-UHFFFAOYSA-N	-1	0	351.431	2.815	50	0		FFAARM
Cc1cccc(N2CCC(C(=O)[O-])(n3ccc(-c4ccco4)n3)CC2)n1	ZINC000072411162	136145555	/nfs/dbraw/zinc/14/55/55/136145555.db2.gz	ISSJCNDZBNHMPC-UHFFFAOYSA-N	-1	0	352.394	2.927	50	0		FFAARM
Cc1ncnc(N2CCC(C(=O)[O-])(n3cnc4ccccc43)CC2)c1C	ZINC000072417968	136145699	/nfs/dbraw/zinc/14/56/99/136145699.db2.gz	UDBNQKGXGKKADO-UHFFFAOYSA-N	-1	0	351.410	2.523	50	0		FFAARM
COc1cccc(-c2nc3c(c4cc(OC)c(OC)cc42)C(=O)[N-]C3=O)c1	ZINC000000689997	506228478	/nfs/dbraw/zinc/22/84/78/506228478.db2.gz	ICBSEDPNQJJQAJ-UHFFFAOYSA-N	-1	0	364.357	2.811	50	0		FFAARM
COc1ccc(OC)c([C@H]2N[C@@H](C(=O)[O-])Cc3c4ccccc4[nH]c32)c1	ZINC000000754303	506230345	/nfs/dbraw/zinc/23/03/45/506230345.db2.gz	IQTPIYGSTAUKJL-VQIMIIECSA-N	-1	0	352.390	2.873	50	0	biogenic	FFAARM
O=C(Nc1ccc(S(=O)(=O)[N-]c2nccs2)cc1)c1ccncc1	ZINC000000944734	506240825	/nfs/dbraw/zinc/24/08/25/506240825.db2.gz	OPDGFJDKRIBNRI-UHFFFAOYSA-N	-1	0	360.420	2.591	50	0		FFAARM
CC(=O)Nc1ccc(S(=O)(=O)[N-]c2nnc(C(C)(C)C)s2)cc1	ZINC000000917296	506241025	/nfs/dbraw/zinc/24/10/25/506241025.db2.gz	QUQBPXUDNLUFHV-UHFFFAOYSA-N	-1	0	354.457	2.595	50	0		FFAARM
O=C([O-])c1cccc(NC(=O)c2cccc(NC(=O)[C@H]3CCCO3)c2)c1	ZINC000001059296	506246065	/nfs/dbraw/zinc/24/60/65/506246065.db2.gz	JPFPIKVARSCUCV-MRXNPFEDSA-N	-1	0	354.362	2.755	50	0		FFAARM
CCN1CCCn2cc(S(=O)(=O)[N-]c3ccc(C)c(C)c3)cc2C1=O	ZINC000065258783	506277692	/nfs/dbraw/zinc/27/76/92/506277692.db2.gz	CJULFNLBNQSGHI-UHFFFAOYSA-N	-1	0	361.467	2.772	50	0		FFAARM
Cc1c(C(=O)[O-])sc2[nH]c(C=Cc3ccc4c(c3)OCCO4)nc(=O)c12	ZINC000033581391	506359643	/nfs/dbraw/zinc/35/96/43/506359643.db2.gz	GDYXLPUSKYYJKL-HYXAFXHYSA-N	-1	0	370.386	2.933	50	0		FFAARM
C[C@H](C1CC1)N(C)S(=O)(=O)c1ccc(C(=O)[O-])cc1Br	ZINC000036785301	506417401	/nfs/dbraw/zinc/41/74/01/506417401.db2.gz	JYJLPKUKPGALMX-MRVPVSSYSA-N	-1	0	362.245	2.566	50	0		FFAARM
Cc1ccc2c(c1)C[C@@]1(CN2C)C(=O)[N-]C(=O)N(c2ccccc2C)C1=O	ZINC000009087710	506681773	/nfs/dbraw/zinc/68/17/73/506681773.db2.gz	PWOCMFZIMZKXHI-OAQYLSRUSA-N	-1	0	363.417	2.770	50	0		FFAARM
CC(C)Cn1c(=O)n(Cc2ccc(Cl)nc2)c2cc(C(=O)[O-])cnc21	ZINC000055575996	506784458	/nfs/dbraw/zinc/78/44/58/506784458.db2.gz	OJMDEOHIDRWTAH-UHFFFAOYSA-N	-1	0	360.801	2.649	50	0		FFAARM
COc1ccc(C(C)=O)cc1Cn1cnc2sc(C(=O)[O-])c(C)c2c1=O	ZINC000013417648	506941173	/nfs/dbraw/zinc/94/11/73/506941173.db2.gz	SHCUKEQQBHVLDT-UHFFFAOYSA-N	-1	0	372.402	2.724	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)c1cccc(CN2CCCC2=O)c1)c1cccs1	ZINC000013389957	506941244	/nfs/dbraw/zinc/94/12/44/506941244.db2.gz	BUERKIFPSGJBCW-HNNXBMFYSA-N	-1	0	372.446	2.816	50	0		FFAARM
O=C([O-])[C@H]1CC=CC[C@@H]1C(=O)Nc1ccccc1C(=O)N1CCCCC1	ZINC000013466556	506943985	/nfs/dbraw/zinc/94/39/85/506943985.db2.gz	XDRCEVQBCNZWTL-GJZGRUSLSA-N	-1	0	356.422	2.918	50	0		FFAARM
Cc1c(F)cccc1NS(=O)(=O)c1ccc(O)c(CCC(=O)[O-])c1	ZINC000015108529	507020525	/nfs/dbraw/zinc/02/05/25/507020525.db2.gz	LKNAGIKWVSQDND-UHFFFAOYSA-N	-1	0	353.371	2.658	50	0		FFAARM
O=C([O-])c1ccc(NC(=O)CCCc2nc(-c3cccnc3)no2)cc1	ZINC000021785754	507266977	/nfs/dbraw/zinc/26/69/77/507266977.db2.gz	OLRSEKFRUBQZNH-UHFFFAOYSA-N	-1	0	352.350	2.791	50	0		FFAARM
COC(=O)[C@H]([N-]S(=O)(=O)c1ccc(Cl)cc1F)c1ccccc1	ZINC000058265483	507396750	/nfs/dbraw/zinc/39/67/50/507396750.db2.gz	JMPRCWCCSSCARO-CQSZACIVSA-N	-1	0	357.790	2.672	50	0		FFAARM
O=C([O-])c1ccc(N[C@H]2CC(=O)N(Cc3ccc(Cl)cc3)C2=O)cc1	ZINC000025572202	507513901	/nfs/dbraw/zinc/51/39/01/507513901.db2.gz	DIJSRHHEGGTUOG-HNNXBMFYSA-N	-1	0	358.781	2.778	50	0		FFAARM
COc1cc(NS(=O)(=O)c2cc(C(=O)[O-])cc(F)c2C)cc(OC)c1	ZINC000060800339	507578444	/nfs/dbraw/zinc/57/84/44/507578444.db2.gz	AVMAMNSAXBNJGR-UHFFFAOYSA-N	-1	0	369.370	2.650	50	0		FFAARM
O=C([O-])CCC/C=C\C[C@H]1C(=O)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)Cc1ccccc1	ZINC000027640301	507673865	/nfs/dbraw/zinc/67/38/65/507673865.db2.gz	DXWJXQSQVUJRNS-YYWARMNLSA-N	-1	0	372.461	2.914	50	0	in-vitro	FFAARM
CC(C)NC(=O)c1ccc(NC(=O)[C@H]2[C@H](C(=O)[O-])C2(C)C)cc1Cl	ZINC000071286199	507700541	/nfs/dbraw/zinc/70/05/41/507700541.db2.gz	JHUGOOTYSSAQHB-CHWSQXEVSA-N	-1	0	352.818	2.774	50	0		FFAARM
COc1ccc(CN2CCO[C@H](Cc3ccc(F)cc3)C2)cc1C(=O)[O-]	ZINC000071745580	507708943	/nfs/dbraw/zinc/70/89/43/507708943.db2.gz	QCMLIINTYMLFBV-QGZVFWFLSA-N	-1	0	359.397	2.976	50	0		FFAARM
COCCNS(=O)(=O)c1cc(C(=O)[O-])cc(-c2ccccc2Cl)c1	ZINC000071764271	507714575	/nfs/dbraw/zinc/71/45/75/507714575.db2.gz	VHWUHUUDLPYQTF-UHFFFAOYSA-N	-1	0	369.826	2.630	50	0		FFAARM
CCc1ccc(C(=O)[O-])cc1NS(=O)(=O)c1ccc2c(c1)CCC(=O)N2	ZINC000072312988	507774903	/nfs/dbraw/zinc/77/49/03/507774903.db2.gz	VFYKQQQJSSRQLC-UHFFFAOYSA-N	-1	0	374.418	2.633	50	0		FFAARM
O=C([O-])c1ccnc(-c2ccnc(NC[C@H]3OCCc4ccccc43)n2)c1	ZINC000072418634	507786273	/nfs/dbraw/zinc/78/62/73/507786273.db2.gz	UGDMXCGCZNKZLZ-GOSISDBHSA-N	-1	0	362.389	2.963	50	0		FFAARM
O=C([O-])c1ccc(C[C@H]2CCN(C(=O)Cc3ccc(CO)cc3)C2)cc1	ZINC000072478695	507796916	/nfs/dbraw/zinc/79/69/16/507796916.db2.gz	AFNAZTNNDWMWNK-GOSISDBHSA-N	-1	0	353.418	2.511	50	0		FFAARM
CC(C)[C@H](C(=O)N1CCn2nc(CCC(=O)[O-])cc2C1)c1ccccc1	ZINC000072479342	507797407	/nfs/dbraw/zinc/79/74/07/507797407.db2.gz	IIEKNPSKJVZUSS-IBGZPJMESA-N	-1	0	355.438	2.682	50	0		FFAARM
CC(C)[C@H](NC(=O)c1c(F)cccc1F)C(=O)[N-]OCc1ccccc1	ZINC000031615818	507820793	/nfs/dbraw/zinc/82/07/93/507820793.db2.gz	VLHUWBXAPGAUIV-KRWDZBQOSA-N	-1	0	362.376	2.967	50	0		FFAARM
O=C([O-])CCC(=O)Nc1ccc2c(c1)[nH]cc2[C@H](C(=O)[O-])[NH+]1CCCCC1	ZINC000031818627	507821958	/nfs/dbraw/zinc/82/19/58/507821958.db2.gz	VYZVOYPXDMMIST-GOSISDBHSA-N	-1	0	373.409	2.583	50	0		FFAARM
Cc1nncn1-c1cccc([N-]S(=O)(=O)c2cccc(F)c2F)c1	ZINC000089740981	507860271	/nfs/dbraw/zinc/86/02/71/507860271.db2.gz	BPIUDXDDQUQGFY-UHFFFAOYSA-N	-1	0	350.350	2.655	50	0		FFAARM
Cc1cc(N2CCC[C@@]3(CNC(=O)O3)CC2)nc(-c2ccccc2[O-])n1	ZINC000091381697	507982749	/nfs/dbraw/zinc/98/27/49/507982749.db2.gz	RLEVIEXEUXOYHO-IBGZPJMESA-N	-1	0	354.410	2.627	50	0		FFAARM
O=C([O-])[C@]1(CC2CC2)CCCN(C(=O)c2ccc(-n3ccnc3)cc2)C1	ZINC000091445169	507987162	/nfs/dbraw/zinc/98/71/62/507987162.db2.gz	XBLDOIORRLEXFI-FQEVSTJZSA-N	-1	0	353.422	2.979	50	0		FFAARM
CN(C)c1ccccc1C(=O)N1C[C@@H](c2ccc(F)cc2)[C@H](C(=O)[O-])C1	ZINC000091518948	507990550	/nfs/dbraw/zinc/99/05/50/507990550.db2.gz	PUJQHMIJIYFCHZ-DLBZAZTESA-N	-1	0	356.397	2.832	50	0		FFAARM
Cc1ccc(-n2[n-]c(C(=O)N3CCC(C(F)(F)F)CC3)cc2=O)cc1	ZINC000074155988	507992723	/nfs/dbraw/zinc/99/27/23/507992723.db2.gz	AMMSFIVUKHKWJN-UHFFFAOYSA-N	-1	0	353.344	2.889	50	0		FFAARM
COCC[C@@]1(C(=O)[O-])CCCN(C(=O)c2csc3c2CCCC3)C1	ZINC000091625900	507997810	/nfs/dbraw/zinc/99/78/10/507997810.db2.gz	FHBOWTPIDIQLPI-SFHVURJKSA-N	-1	0	351.468	2.970	50	0		FFAARM
COc1ccc(F)cc1C(=O)N1C[C@@H](c2cccc(F)c2)[C@H](C(=O)[O-])C1	ZINC000091643635	507999608	/nfs/dbraw/zinc/99/96/08/507999608.db2.gz	GJWREMUIWYNHIH-JKSUJKDBSA-N	-1	0	361.344	2.914	50	0		FFAARM
CC1(C)Cc2c(cnn2-c2ccc(F)cc2)[C@H](NC(=O)c2cc(=O)[nH][n-]2)C1	ZINC000091894960	508022618	/nfs/dbraw/zinc/02/26/18/508022618.db2.gz	DNNCQYIESBAHSI-OAHLLOKOSA-N	-1	0	369.400	2.884	50	0		FFAARM
C=CCn1c(SCC(=O)[O-])nc2sc3c(c2c1=O)C[C@@H](C)CC3	ZINC000075271512	508092528	/nfs/dbraw/zinc/09/25/28/508092528.db2.gz	PUAPYRRSVWJYOF-VIFPVBQESA-N	-1	0	350.465	2.946	50	0		FFAARM
CC(=O)c1cccc([C@H](C(=O)[O-])N2CCN(Cc3cccc(F)c3)CC2)c1	ZINC000095356045	508174767	/nfs/dbraw/zinc/17/47/67/508174767.db2.gz	IBVPSXAMPRJRJJ-HXUWFJFHSA-N	-1	0	370.424	2.972	50	0		FFAARM
CC(C)Oc1ccc([C@H](C(=O)[O-])N2CCN(Cc3cccnc3)CC2)cc1	ZINC000095366784	508177787	/nfs/dbraw/zinc/17/77/87/508177787.db2.gz	SFDYXNVHQRJPRA-HXUWFJFHSA-N	-1	0	369.465	2.812	50	0		FFAARM
COc1ccc(Cn2cc([C@@H](C(=O)[O-])N(C)Cc3cccnc3)cn2)cc1	ZINC000095389460	508183432	/nfs/dbraw/zinc/18/34/32/508183432.db2.gz	WQXQHTNDFDEQMD-IBGZPJMESA-N	-1	0	366.421	2.593	50	0		FFAARM
O=C(NC1CCN(C(=O)c2cc(F)c([O-])c(F)c2)CC1)c1ccccc1	ZINC000095406695	508184162	/nfs/dbraw/zinc/18/41/62/508184162.db2.gz	NLQVFSKLQSOCJO-UHFFFAOYSA-N	-1	0	360.360	2.705	50	0		FFAARM
O=C([O-])COc1cccc(CNC(=O)c2sccc2Br)c1	ZINC000095425482	508185031	/nfs/dbraw/zinc/18/50/31/508185031.db2.gz	KHQRRRCYDLZOLR-UHFFFAOYSA-N	-1	0	370.224	2.904	50	0		FFAARM
COC(=O)c1[n-]c(=NC(=O)c2nc(C)sc2C)sc1CC(C)C	ZINC000095475508	508188368	/nfs/dbraw/zinc/18/83/68/508188368.db2.gz	JZKGMYJYWHBMDY-UHFFFAOYSA-N	-1	0	353.469	3.454	50	0		FFAARM
COc1ccc(Cn2[nH][n-]c3c(=O)n(-c4ccccc4Cl)c(=O)c2=3)cc1	ZINC000095481474	508188897	/nfs/dbraw/zinc/18/88/97/508188897.db2.gz	SKYKQGPQVIMSDX-HOTGVXAUSA-N	-1	0	370.796	2.842	50	0		FFAARM
COc1ccc(Br)cc1CC(=O)NCCCCCC(=O)[O-]	ZINC000095970348	508200200	/nfs/dbraw/zinc/20/02/00/508200200.db2.gz	WSFABVYQNGMCBO-UHFFFAOYSA-N	-1	0	358.232	2.761	50	0		FFAARM
CO[C@@H]1CCN(c2ccc([N-]S(=O)(=O)c3c(F)cccc3F)cc2)C1	ZINC000096122367	508206632	/nfs/dbraw/zinc/20/66/32/508206632.db2.gz	BLMMPJSXLDSNJK-CQSZACIVSA-N	-1	0	368.405	2.991	50	0		FFAARM
CCC(=O)N1CCc2c(=O)n3[n-]c(-c4ccccc4Cl)cc3nc2C1	ZINC000097161432	508220684	/nfs/dbraw/zinc/22/06/84/508220684.db2.gz	PUWWOHFWXRMLLF-UHFFFAOYSA-N	-1	0	356.813	2.638	50	0		FFAARM
C[C@H]1CCc2cc(F)cc3c([O-])c(C(=O)NCc4ccco4)c(=O)n1c23	ZINC000100663082	508239940	/nfs/dbraw/zinc/23/99/40/508239940.db2.gz	DQFXWNIWPSXMTC-JTQLQIEISA-N	-1	0	356.353	2.876	50	0		FFAARM
CCOc1ccc(Cn2[nH][n-]c3c(=O)n(-c4ccc(F)cc4)c(=O)c2=3)cc1	ZINC000101167795	508240909	/nfs/dbraw/zinc/24/09/09/508240909.db2.gz	HNBNATATXINMOD-IRXDYDNUSA-N	-1	0	368.368	2.718	50	0		FFAARM
CCc1ccc(-n2c(=O)c3[n-][nH]n(-c4cccc(OC)c4)c=3c2=O)cc1	ZINC000101260307	508241045	/nfs/dbraw/zinc/24/10/45/508241045.db2.gz	WPMHZJKBDGKCQS-SJORKVTESA-N	-1	0	350.378	2.755	50	0		FFAARM
COc1cccc(Cn2[nH][n-]c3c(=O)n(-c4ccccc4Cl)c(=O)c2=3)c1	ZINC000101418590	508241412	/nfs/dbraw/zinc/24/14/12/508241412.db2.gz	XASPKVNCZUBUGH-HOTGVXAUSA-N	-1	0	370.796	2.842	50	0		FFAARM
O=C([O-])c1ccnc(-c2ccnc(NCCOc3ccccc3F)n2)c1	ZINC000077341199	508302354	/nfs/dbraw/zinc/30/23/54/508302354.db2.gz	QUFGDBKIEOCZRF-UHFFFAOYSA-N	-1	0	354.341	2.867	50	0		FFAARM
Cc1cc([C@@H]2CCCCN2C(=O)c2cc(=O)n(-c3ccccc3)[n-]2)no1	ZINC000223199294	509331153	/nfs/dbraw/zinc/33/11/53/509331153.db2.gz	LWLVILVOGAQYID-KRWDZBQOSA-N	-1	0	352.394	2.829	50	0		FFAARM
O=C([O-])C(=O)NCCc1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1	ZINC000225608181	509379764	/nfs/dbraw/zinc/37/97/64/509379764.db2.gz	IMJKHJIUWDWQHQ-UHFFFAOYSA-N	-1	0	369.808	2.936	50	0		FFAARM
CC(C)c1cc(C(=O)N2CCC(C(=O)[O-])(c3ccccc3)CC2)nn1C	ZINC000236682934	509480233	/nfs/dbraw/zinc/48/02/33/509480233.db2.gz	ZLXQHJIXONNKNP-UHFFFAOYSA-N	-1	0	355.438	2.802	50	0		FFAARM
O=C([N-]S(=O)(=O)c1cccnc1)[C@@H](OC1CCCC1)c1ccccc1	ZINC000170620477	509683662	/nfs/dbraw/zinc/68/36/62/509683662.db2.gz	CYODYCPAJYFMLZ-KRWDZBQOSA-N	-1	0	360.435	2.587	50	0		FFAARM
Cc1ccc(CS(=O)(=O)[N-]C(=O)Cc2c[nH]c3ccccc23)c(F)c1	ZINC000252496675	509844143	/nfs/dbraw/zinc/84/41/43/509844143.db2.gz	POKJIRKBOLJPFT-UHFFFAOYSA-N	-1	0	360.410	2.804	50	0		FFAARM
O=C([O-])[C@@H]1CCN(C(=O)/C=C\c2ccc(OCc3ccccn3)cc2)C1	ZINC000255327828	509921679	/nfs/dbraw/zinc/92/16/79/509921679.db2.gz	TZHHWZDVUYKEAQ-CXOKCQFOSA-N	-1	0	352.390	2.607	50	0		FFAARM
CC(C)(C[C@H]1CCCN(C(=O)c2cc(F)c(F)c([O-])c2F)C1)C(N)=O	ZINC000295780090	511513779	/nfs/dbraw/zinc/51/37/79/511513779.db2.gz	CWZIZAKZHQJLAO-SECBINFHSA-N	-1	0	358.360	2.563	50	0		FFAARM
CCc1ccc(S(=O)(=O)[N-]c2cnn(C[C@H]3CCCCO3)c2)s1	ZINC000390827918	512911254	/nfs/dbraw/zinc/91/12/54/512911254.db2.gz	MAXZZCMWVNVNMP-CYBMUJFWSA-N	-1	0	355.485	2.877	50	0		FFAARM
FC(F)(F)COc1ncccc1CN=c1[n-]nc(-c2ccon2)s1	ZINC000555901941	517177035	/nfs/dbraw/zinc/17/70/35/517177035.db2.gz	TXQQYBDHTJJSKG-UHFFFAOYSA-N	-1	0	357.317	2.563	50	0		FFAARM
CCCCCCNC(C)=C1C(=O)[N-]C(=O)N(c2ccc(OC)cc2)C1=O	ZINC000020266607	520073599	/nfs/dbraw/zinc/07/35/99/520073599.db2.gz	ADUUALZVBIZCGE-DTQAZKPQSA-N	-1	0	359.426	2.722	50	0		FFAARM
O=C([O-])[C@H]1CCCN(C(=O)Cc2csc(CCC(F)(F)F)n2)C1	ZINC000630096600	522615961	/nfs/dbraw/zinc/61/59/61/522615961.db2.gz	CRHJVHQFQCLJHO-VIFPVBQESA-N	-1	0	350.362	2.504	50	0		FFAARM
COc1ccccc1[C@@H]1CN(C(=O)CCc2scnc2C)C[C@H]1C(=O)[O-]	ZINC000091643538	524758941	/nfs/dbraw/zinc/75/89/41/524758941.db2.gz	GRSDCQBSKABEAH-LSDHHAIUSA-N	-1	0	374.462	2.720	50	0		FFAARM
O=C([O-])[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)CCCc1ccc2c(c1)CC(=O)N2	ZINC000268958261	526292603	/nfs/dbraw/zinc/29/26/03/526292603.db2.gz	ZKQFHPKTPBHBIV-OLMNPRSZSA-N	-1	0	370.449	2.748	50	0		FFAARM
Cc1nn(-c2ccccc2)c(Cl)c1/C=C/C(=O)N1CC[C@H](C(=O)[O-])C1	ZINC000178267891	527546136	/nfs/dbraw/zinc/54/61/36/527546136.db2.gz	DLNIBFNUYGHJBE-GWJCSSMESA-N	-1	0	359.813	2.780	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)C[C@H]1CCCO1)c1cccc(Br)c1	ZINC000238129326	527624781	/nfs/dbraw/zinc/62/47/81/527624781.db2.gz	KXSSFYQDWFKMQP-CHWSQXEVSA-N	-1	0	356.216	2.650	50	0		FFAARM
CCSc1ccc([C@@H](C(=O)[O-])N2CCN(c3cnccn3)CC2)cc1	ZINC000095385877	535737789	/nfs/dbraw/zinc/73/77/89/535737789.db2.gz	LLLJAXQFGZJRDR-KRWDZBQOSA-N	-1	0	358.467	2.537	50	0		FFAARM
Cn1c(=O)c2ccc(C(=O)Nc3ccc4c(c3)CCC4)cc2[n-]c1=S	ZINC000102551924	570834243	/nfs/dbraw/zinc/83/42/43/570834243.db2.gz	VMGYELPQMQSTBW-UHFFFAOYSA-N	-1	0	351.431	2.963	50	0		FFAARM
COc1cccc(-n2[nH][n-]c3c(=O)n(-c4ccc5c(c4)CCC5)c(=O)c2=3)c1	ZINC000102818827	570839807	/nfs/dbraw/zinc/83/98/07/570839807.db2.gz	LZCXMLMRZMLRSJ-ZWKOTPCHSA-N	-1	0	362.389	2.682	50	0		FFAARM
O=C([N-]S(=O)(=O)Cc1ccc(Cl)nc1)[C@@H]1CSc2ccccc21	ZINC000118600222	571176416	/nfs/dbraw/zinc/17/64/16/571176416.db2.gz	XWGPNPNWXBIXKT-GFCCVEGCSA-N	-1	0	368.867	2.571	50	0		FFAARM
COc1ccc(OC)c2[nH]c(C(=O)N[C@@H](C(=O)[O-])c3ccccc3)cc21	ZINC000098031856	571311557	/nfs/dbraw/zinc/31/15/57/571311557.db2.gz	IWFKXMXHKHTPHT-MRXNPFEDSA-N	-1	0	354.362	2.741	50	0		FFAARM
O=S(=O)([N-]c1cnc2ccccc2c1)c1cnn(C2CCOCC2)c1	ZINC000137176418	728740165	/nfs/dbraw/zinc/74/01/65/728740165.db2.gz	COKVCPPVXJNLGA-UHFFFAOYSA-N	-1	0	358.423	2.584	50	0		FFAARM
O=C([O-])CCc1cc2n(n1)CCCN(C(=O)c1ccc(F)cc1Cl)C2	ZINC000072477328	845555537	/nfs/dbraw/zinc/55/55/37/845555537.db2.gz	OQFUVSVJXDENII-UHFFFAOYSA-N	-1	0	365.792	2.739	50	0		FFAARM
O=C([O-])c1cc2ncc(-c3cc(F)ccc3OC[C@@H]3CCOC3)cn2n1	ZINC000874970556	990783701	/nfs/dbraw/zinc/78/37/01/990783701.db2.gz	RYNCVWPDYXZDHI-LLVKDONJSA-N	-1	0	357.341	2.649	50	0		FFAARM
O=C([O-])[C@@H](Cc1nc2ccccc2[nH]1)Nc1nccc(-c2cccnc2)n1	ZINC000097551361	1012868057	/nfs/dbraw/zinc/86/80/57/1012868057.db2.gz	XEVVRZJQJABVCP-MRXNPFEDSA-N	-1	0	360.377	2.523	50	0		FFAARM
COc1ccc(C)cc1[C@@H](C(=O)[O-])N(C)Cc1nc(-c2ccncc2)no1	ZINC000055392997	1018397411	/nfs/dbraw/zinc/39/74/11/1018397411.db2.gz	PAAALHCQSZDWQA-KRWDZBQOSA-N	-1	0	368.393	2.706	50	0		FFAARM
Cc1cc(C(=O)N[C@H](CC(=O)[O-])c2ccccc2)ccc1N1CCOCC1	ZINC000647598750	1023096714	/nfs/dbraw/zinc/09/67/14/1023096714.db2.gz	WJCAIDSQLLSHSA-GOSISDBHSA-N	-1	0	368.433	2.777	50	0		FFAARM
Cn1c(N[C@H]2CCCN(C(=O)c3ccco3)C2)nc2cc(C(=O)[O-])ccc21	ZINC001506412797	1059500669	/nfs/dbraw/zinc/50/06/69/1059500669.db2.gz	FGLJWOMNFCFYNN-ZDUSSCGKSA-N	-1	0	368.393	2.581	50	0		FFAARM
CN(Cc1ccc2ncccc2c1)S(=O)(=O)c1ccccc1C(=O)[O-]	ZINC001506421471	1059509111	/nfs/dbraw/zinc/50/91/11/1059509111.db2.gz	JWDVXACMLVTDEQ-UHFFFAOYSA-N	-1	0	356.403	2.754	50	0		FFAARM
O=C([O-])CSc1nnc([C@H]2COc3ccccc3O2)n1-c1ccccc1	ZINC000000711293	203945190	/nfs/dbraw/zinc/94/51/90/203945190.db2.gz	BWVXIKFLTDGBIN-OAHLLOKOSA-N	-1	0	369.402	2.957	50	0		FFAARM
CC(C)(C)OC(=O)N1CCC(S(=O)(=O)c2ccccc2C(=O)[O-])CC1	ZINC000001495009	204011289	/nfs/dbraw/zinc/01/12/89/204011289.db2.gz	OFHZVQJKTJTTOH-UHFFFAOYSA-N	-1	0	369.439	2.558	50	0		FFAARM
O=C([O-])c1ccccc1NS(=O)(=O)c1ccc2c3c(cccc31)C(=O)N2	ZINC000002055805	204024867	/nfs/dbraw/zinc/02/48/67/204024867.db2.gz	TYNXIZLQXIBWGQ-UHFFFAOYSA-N	-1	0	368.370	2.905	50	0		FFAARM
CCOC(=O)N[C@@]([N-]c1ccc(F)cc1F)(C(=O)OCC)C(F)(F)F	ZINC000002271079	204031578	/nfs/dbraw/zinc/03/15/78/204031578.db2.gz	OZZBGHXKHSPKMK-ZDUSSCGKSA-N	-1	0	370.274	2.945	50	0		FFAARM
COc1ccc(CCNC(=O)C[C@H](Cc2ccccc2)C(=O)[O-])cc1OC	ZINC000002291125	204033200	/nfs/dbraw/zinc/03/32/00/204033200.db2.gz	LNSYHTUJWZZIST-KRWDZBQOSA-N	-1	0	371.433	2.696	50	0	biogenic	FFAARM
COc1ccc(C(=O)[O-])cc1S(=O)(=O)NCc1ccc(Cl)cc1	ZINC000003280968	204087023	/nfs/dbraw/zinc/08/70/23/204087023.db2.gz	DEIJFDZNLYJJDJ-UHFFFAOYSA-N	-1	0	355.799	2.525	50	0		FFAARM
COc1ccc(N2C(=O)C[C@H](Nc3ccc(C(=O)[O-])cc3)C2=O)cc1Cl	ZINC000002662396	204050818	/nfs/dbraw/zinc/05/08/18/204050818.db2.gz	PXJGEZBUFMDKHO-AWEZNQCLSA-N	-1	0	374.780	2.791	50	0		FFAARM
O=S(=O)([N-]c1ncn(Cc2ccc(Cl)cc2)n1)c1ccc(F)cc1	ZINC000002778309	204057009	/nfs/dbraw/zinc/05/70/09/204057009.db2.gz	ANJGBONAQXQGCS-UHFFFAOYSA-N	-1	0	366.805	2.920	50	0		FFAARM
Cc1ccc(S(=O)(=O)[N-]c2ccccc2C(=O)NC[C@H]2CCCO2)cc1	ZINC000004756777	204161317	/nfs/dbraw/zinc/16/13/17/204161317.db2.gz	QDIJTPUGGCTKBI-OAHLLOKOSA-N	-1	0	374.462	2.705	50	0		FFAARM
CCc1cccc(OCC(=O)Nc2cc(OC)c(OC)cc2C(=O)[O-])c1	ZINC000004823770	204166755	/nfs/dbraw/zinc/16/67/55/204166755.db2.gz	MDJLEOWPDPYOCQ-UHFFFAOYSA-N	-1	0	359.378	2.982	50	0		FFAARM
O=C([O-])c1ccccc1C(=O)NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000004351228	204133975	/nfs/dbraw/zinc/13/39/75/204133975.db2.gz	VUGJFKSCACJREA-MRXNPFEDSA-N	-1	0	365.385	2.708	50	0		FFAARM
CC(C)(C)OC(=O)N[C@@H](CCCNC(=O)OCc1ccccc1)C(=O)[O-]	ZINC000004521277	204144851	/nfs/dbraw/zinc/14/48/51/204144851.db2.gz	QYYCZJUFHDLLOJ-AWEZNQCLSA-N	-1	0	366.414	2.671	50	0		FFAARM
O=C([O-])COc1ccccc1-c1nc(=O)c2c3c(sc2[nH]1)CCCC3	ZINC000004945544	204179068	/nfs/dbraw/zinc/17/90/68/204179068.db2.gz	AYWCCVXTLIVDQR-UHFFFAOYSA-N	-1	0	356.403	2.994	50	0		FFAARM
COc1ccc([C@@H](CC(=O)N2CCCCC2)[N-]C(=O)C(F)(F)F)cc1	ZINC000005675919	204221231	/nfs/dbraw/zinc/22/12/31/204221231.db2.gz	HIEYOBWPKDNUNH-CQSZACIVSA-N	-1	0	358.360	2.817	50	0		FFAARM
O=C([O-])c1cc(Br)cc(S(=O)(=O)NCc2ccccc2)c1	ZINC000006344260	204246136	/nfs/dbraw/zinc/24/61/36/204246136.db2.gz	SYRWENWLQYOZNU-UHFFFAOYSA-N	-1	0	370.224	2.626	50	0		FFAARM
COc1ccc(OC)c([N-]S(=O)(=O)c2ccc(-n3cccn3)cc2)c1	ZINC000006887424	204280115	/nfs/dbraw/zinc/28/01/15/204280115.db2.gz	BMILGQYDSCESRK-UHFFFAOYSA-N	-1	0	359.407	2.690	50	0		FFAARM
Cc1ccc(S(=O)(=O)N(CC(=O)[O-])Cc2ccccc2Cl)cc1	ZINC000006814712	204273611	/nfs/dbraw/zinc/27/36/11/204273611.db2.gz	SXHYKZWGEXOCQC-UHFFFAOYSA-N	-1	0	353.827	2.924	50	0		FFAARM
O=C([O-])[C@@H]1C[C@H]1C(=O)Nc1ccc(C(O)(C(F)(F)F)C(F)(F)F)cc1	ZINC000006863209	204277253	/nfs/dbraw/zinc/27/72/53/204277253.db2.gz	QCBAODFXUVDXOG-RKDXNWHRSA-N	-1	0	371.233	2.658	50	0		FFAARM
CCOC(=O)c1c(C)n(C)c(C)c1S(=O)(=O)[N-]c1cccc(OC)c1	ZINC000006887588	204279507	/nfs/dbraw/zinc/27/95/07/204279507.db2.gz	TYJNNYBMYKSQPM-UHFFFAOYSA-N	-1	0	366.439	2.628	50	0		FFAARM
O=C1CCCN1c1ccccc1[N-]S(=O)(=O)c1ccc(F)c(F)c1	ZINC000007726696	204304587	/nfs/dbraw/zinc/30/45/87/204304587.db2.gz	WNYXVVLPRVAUGD-UHFFFAOYSA-N	-1	0	352.362	2.892	50	0		FFAARM
NC(=O)c1oc2ccccc2c1[N-]S(=O)(=O)c1ccccc1Cl	ZINC000007727578	204304942	/nfs/dbraw/zinc/30/49/42/204304942.db2.gz	UMYFKXTYOYOAGZ-UHFFFAOYSA-N	-1	0	350.783	2.986	50	0		FFAARM
COc1cc(S(=O)(=O)[N-]c2ncccc2C)ccc1Br	ZINC000008714969	204339992	/nfs/dbraw/zinc/33/99/92/204339992.db2.gz	DCGGMWTZUOZANF-UHFFFAOYSA-N	-1	0	357.229	2.962	50	0		FFAARM
CC(=O)c1ccccc1[N-]S(=O)(=O)c1ccc2c(c1)C[C@H](C)N2C(C)=O	ZINC000009338405	204364759	/nfs/dbraw/zinc/36/47/59/204364759.db2.gz	FHZYKVURSGEFCJ-LBPRGKRZSA-N	-1	0	372.446	2.988	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)Cc1ccc(N2CCCC2=O)cc1)c1ccccc1	ZINC000013427914	204531261	/nfs/dbraw/zinc/53/12/61/204531261.db2.gz	KADOFTKQSJBZFA-GOSISDBHSA-N	-1	0	366.417	2.688	50	0		FFAARM
NC(=O)c1c(-c2ccc(Cl)cc2)csc1NC(=O)CCC(=O)[O-]	ZINC000017073112	204646822	/nfs/dbraw/zinc/64/68/22/204646822.db2.gz	SPUNEJKSGVKYSU-UHFFFAOYSA-N	-1	0	352.799	2.971	50	0		FFAARM
Cc1n[nH]c(C)c1[C@@H](NC(=O)c1c(C)c2cc(F)ccc2n1C)C(=O)[O-]	ZINC000067650055	204919447	/nfs/dbraw/zinc/91/94/47/204919447.db2.gz	PGIHWRJMPHTUAF-OAHLLOKOSA-N	-1	0	358.373	2.521	50	0		FFAARM
C[C@@H]1Oc2ccc(S(=O)(=O)[N-]c3cccc4cccnc43)cc2NC1=O	ZINC000071538667	205029541	/nfs/dbraw/zinc/02/95/41/205029541.db2.gz	WXRDSSODIJILKK-NSHDSACASA-N	-1	0	369.402	2.755	50	0		FFAARM
COc1c(I)cc(Br)cc1C(=O)[O-]	ZINC000040564732	205071607	/nfs/dbraw/zinc/07/16/07/205071607.db2.gz	KEQKAEQOVTURLS-UHFFFAOYSA-N	-1	0	356.941	2.761	50	0		FFAARM
C[C@@H](CC(=O)N1CCO[C@@H](CC(=O)[O-])C1)c1ccccc1Br	ZINC000299742342	205123456	/nfs/dbraw/zinc/12/34/56/205123456.db2.gz	BFRRLAPYLVLXCX-RYUDHWBXSA-N	-1	0	370.243	2.645	50	0		FFAARM
COc1cccc([C@@H]2C[C@@H]2C(=O)NCc2ccc(OC)c(C(=O)[O-])c2)c1	ZINC000299752557	205134640	/nfs/dbraw/zinc/13/46/40/205134640.db2.gz	UOQSGCROFATVFO-HOTGVXAUSA-N	-1	0	355.390	2.822	50	0		FFAARM
O=C([O-])CCN(C[C@@H]1CCCO1)C(=O)[C@H]1C[C@H]1c1cc(F)ccc1F	ZINC000299753701	205134852	/nfs/dbraw/zinc/13/48/52/205134852.db2.gz	YZZHXJWSWDJHIW-YDHLFZDLSA-N	-1	0	353.365	2.551	50	0		FFAARM
CCOc1ccc2cc(C(=O)N(CCC(=O)[O-])C[C@H]3CCCO3)[nH]c2c1	ZINC000299749336	205130138	/nfs/dbraw/zinc/13/01/38/205130138.db2.gz	JZEUXTHADDHCJZ-OAHLLOKOSA-N	-1	0	360.410	2.663	50	0		FFAARM
Cc1cccc([C@H](NC(=O)CCC(=O)NC2CCCCCC2)C(=O)[O-])c1	ZINC000055183261	205210448	/nfs/dbraw/zinc/21/04/48/205210448.db2.gz	VCYGRTJLNGFSSD-IBGZPJMESA-N	-1	0	360.454	2.856	50	0		FFAARM
COCCOc1ccc([N-]S(=O)(=O)c2ccccc2OC)c(C)c1	ZINC000055643639	205221821	/nfs/dbraw/zinc/22/18/21/205221821.db2.gz	XWMNCNUUCNHFPC-UHFFFAOYSA-N	-1	0	351.424	2.830	50	0		FFAARM
O=C([O-])c1cc2c(c(S(=O)(=O)Nc3c(F)cccc3F)c1)CCC2	ZINC000055555329	205220421	/nfs/dbraw/zinc/22/04/21/205220421.db2.gz	IZEVVYFTFORBJX-UHFFFAOYSA-N	-1	0	353.346	2.953	50	0		FFAARM
CCc1nnc(-c2ccc(S(=O)(=O)[N-]c3cc(F)cc(F)c3)o2)o1	ZINC000065246254	205328744	/nfs/dbraw/zinc/32/87/44/205328744.db2.gz	LYFIPHDJHRXPFA-UHFFFAOYSA-N	-1	0	355.322	2.971	50	0		FFAARM
O=C(Cc1ccc(S(=O)(=O)[N-]c2ccccc2)s1)N1CCCC1	ZINC000064919688	205308994	/nfs/dbraw/zinc/30/89/94/205308994.db2.gz	VDBUUCSJFRKWNU-UHFFFAOYSA-N	-1	0	350.465	2.714	50	0		FFAARM
CCc1nc2sc(C)nn2c1S(=O)(=O)[N-]c1ccc(F)c(F)c1	ZINC000065183893	205322022	/nfs/dbraw/zinc/32/20/22/205322022.db2.gz	KEJHVIGEFZBUSV-UHFFFAOYSA-N	-1	0	358.395	2.741	50	0		FFAARM
O=C([O-])c1nnn(-c2cccc(OC(F)(F)F)c2)c1-c1ccncc1	ZINC000065288254	205334498	/nfs/dbraw/zinc/33/44/98/205334498.db2.gz	MFYCAEMVJCWPLT-UHFFFAOYSA-N	-1	0	350.256	2.926	50	0		FFAARM
Cc1cccc(-c2ncc(CN3CCCn4nc(C(=O)[O-])cc4C3)cn2)c1	ZINC000065373652	205340853	/nfs/dbraw/zinc/34/08/53/205340853.db2.gz	NCOTVIDQALSGCW-UHFFFAOYSA-N	-1	0	363.421	2.753	50	0		FFAARM
Cc1cccc(C)c1OC[C@H](C)NC(=O)c1ccccc1NCC(=O)[O-]	ZINC000065383254	205343512	/nfs/dbraw/zinc/34/35/12/205343512.db2.gz	WATJIICYBDWCEX-HNNXBMFYSA-N	-1	0	356.422	2.997	50	0		FFAARM
Cc1ccc(CN2C[C@H](C(=O)Nc3ccc(C(=O)[O-])cc3)CC2=O)cc1	ZINC000067244980	205367938	/nfs/dbraw/zinc/36/79/38/205367938.db2.gz	YWQZOTLGMRSAIV-MRXNPFEDSA-N	-1	0	352.390	2.680	50	0		FFAARM
Cc1n[nH]c(C)c1[C@H](NC(=O)c1c(C)c2cccc(C)c2n1C)C(=O)[O-]	ZINC000067690750	205384414	/nfs/dbraw/zinc/38/44/14/205384414.db2.gz	FVLQAIKEMUYCDQ-HNNXBMFYSA-N	-1	0	354.410	2.691	50	0		FFAARM
COc1ccc(C(=O)NC2CCCC2)cc1NC(=O)[C@H]1[C@H](C(=O)[O-])C1(C)C	ZINC000071287535	205424737	/nfs/dbraw/zinc/42/47/37/205424737.db2.gz	AWUJXOXSTGRUNI-HZPDHXFCSA-N	-1	0	374.437	2.663	50	0		FFAARM
COc1ccc(-c2cnc(CCC(=O)N3CC[C@@](C)(C(=O)[O-])C3)o2)cc1	ZINC000237443051	206104279	/nfs/dbraw/zinc/10/42/79/206104279.db2.gz	MLZJEMNUYQAREM-LJQANCHMSA-N	-1	0	358.394	2.606	50	0		FFAARM
C[C@H](CC(=O)N1CCO[C@H](CC(=O)[O-])C1)c1ccc(C(F)(F)F)cc1	ZINC000237538998	206105091	/nfs/dbraw/zinc/10/50/91/206105091.db2.gz	WGVZSJSKMQQKSZ-BXUZGUMPSA-N	-1	0	359.344	2.901	50	0		FFAARM
Cc1cc(C)n(Cc2ccc(C(=O)N(C[C@H](C)C(=O)[O-])C3CC3)cc2)n1	ZINC000237470473	206106044	/nfs/dbraw/zinc/10/60/44/206106044.db2.gz	KHEWCNYLVJCASD-ZDUSSCGKSA-N	-1	0	355.438	2.874	50	0		FFAARM
C[C@@H](Oc1ccc(F)cc1Br)C(=O)N1CCC(C(=O)[O-])CC1	ZINC000237485117	206106198	/nfs/dbraw/zinc/10/61/98/206106198.db2.gz	PHGYMSAUMYCZHJ-SECBINFHSA-N	-1	0	374.206	2.679	50	0		FFAARM
CN(C(=O)c1ccc(C(=O)[O-])o1)[C@@H]1CCN(c2ccccc2Cl)C1=O	ZINC000237279774	206095733	/nfs/dbraw/zinc/09/57/33/206095733.db2.gz	ODXHDAPMVXWBTI-GFCCVEGCSA-N	-1	0	362.769	2.509	50	0		FFAARM
O=C([O-])CCN(C[C@H]1CCCO1)C(=O)c1cc(Br)ccc1F	ZINC000238105385	206113153	/nfs/dbraw/zinc/11/31/53/206113153.db2.gz	QSMOQQXCMDIKKT-LLVKDONJSA-N	-1	0	374.206	2.684	50	0		FFAARM
O=C([O-])C1CCN(C(=O)[C@H]2C[C@@H]2c2cccc(Br)c2)CC1	ZINC000238029524	206113543	/nfs/dbraw/zinc/11/35/43/206113543.db2.gz	GSPSFIRDDMQGAD-KGLIPLIRSA-N	-1	0	352.228	2.876	50	0		FFAARM
O=C1c2ccccc2S(=O)(=O)[N-]N1CCOc1cccc2ccccc21	ZINC000121452754	206110074	/nfs/dbraw/zinc/11/00/74/206110074.db2.gz	BGQOAFQPCGBCOX-UHFFFAOYSA-N	-1	0	368.414	2.568	50	0		FFAARM
O=C([O-])CC[C@@H]1CCCCN1C(=O)c1cn(-c2ccccc2Cl)nn1	ZINC000237943305	206111088	/nfs/dbraw/zinc/11/10/88/206111088.db2.gz	ZSOCDBHJKXLUSC-LBPRGKRZSA-N	-1	0	362.817	2.780	50	0		FFAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)[C@@H]2COc3ccc(Cl)cc3C2)C1	ZINC000237963278	206111604	/nfs/dbraw/zinc/11/16/04/206111604.db2.gz	UYWQRDVXUKKWFN-JSGCOSHPSA-N	-1	0	351.830	2.995	50	0		FFAARM
O=C([O-])CC[C@H]1CCCCN1C(=O)c1ccc(CN2CCCC2=O)cc1	ZINC000237994364	206111911	/nfs/dbraw/zinc/11/19/11/206111911.db2.gz	BUHQPNKIRUVLSF-QGZVFWFLSA-N	-1	0	358.438	2.669	50	0		FFAARM
COc1cc(OC)c(NC(=O)c2cc(=O)n(-c3ccc(C)cc3)[n-]2)cc1F	ZINC000151029033	206152712	/nfs/dbraw/zinc/15/27/12/206152712.db2.gz	DFLNOJCYXOIMHH-UHFFFAOYSA-N	-1	0	371.368	2.883	50	0		FFAARM
CCc1cc(=O)oc2c(C)c(O[C@H](C)C(=O)N3CCC[C@@H]3C(=O)[O-])ccc12	ZINC000004064432	206166828	/nfs/dbraw/zinc/16/68/28/206166828.db2.gz	HIQXOQJXNWRHBJ-IUODEOHRSA-N	-1	0	373.405	2.507	50	0	biogenic	FFAARM
CCN(CC)C(=O)c1ccc([N-]S(=O)(=O)c2c(C)noc2C)cc1	ZINC000007054095	206206944	/nfs/dbraw/zinc/20/69/44/206206944.db2.gz	TUPCAZKHECIBNW-UHFFFAOYSA-N	-1	0	351.428	2.574	50	0		FFAARM
CC(C)[C@@H](NC(=O)[C@H]1CCN(c2cc(Cl)cc(Cl)c2)C1=O)C(=O)[O-]	ZINC000156333174	206222035	/nfs/dbraw/zinc/22/20/35/206222035.db2.gz	QAHIZXXELNEUIM-CHWSQXEVSA-N	-1	0	373.236	2.572	50	0		FFAARM
CC(C)C[C@H](NC(=O)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1)C(=O)[O-]	ZINC000170671486	206280342	/nfs/dbraw/zinc/28/03/42/206280342.db2.gz	FWPOJKCJEXQCOL-HNNXBMFYSA-N	-1	0	359.426	2.674	50	0		FFAARM
Cc1nc(C(C)C)sc1CNC(=O)c1cc(=O)n(-c2ccccc2)[n-]1	ZINC000220341514	206399678	/nfs/dbraw/zinc/39/96/78/206399678.db2.gz	YKCRZTFLHYOINF-UHFFFAOYSA-N	-1	0	356.451	2.984	50	0		FFAARM
O=C([O-])c1cc(N2CCC[C@@]3(CCC(=O)N(C4CCCC4)C3)C2)ccn1	ZINC000077437888	132185595	/nfs/dbraw/zinc/18/55/95/132185595.db2.gz	LHQLYDCOSHBJKA-HXUWFJFHSA-N	-1	0	357.454	2.931	50	0		FFAARM
O=C([O-])c1ccc(N2CCC[C@H](c3nccn3Cc3cccnc3)C2)nc1	ZINC000091651120	132203067	/nfs/dbraw/zinc/20/30/67/132203067.db2.gz	RCQQNOPZQOHWQG-KRWDZBQOSA-N	-1	0	363.421	2.804	50	0		FFAARM
O=C([O-])c1cccc(N2CCN(C(=O)C3(c4ccc(F)cc4)CC3)CC2)c1	ZINC000095510952	132213288	/nfs/dbraw/zinc/21/32/88/132213288.db2.gz	XBERYYRZDODCDC-UHFFFAOYSA-N	-1	0	368.408	2.904	50	0		FFAARM
CCOc1ccc(-c2ccnc(N3C[C@@H](C)O[C@@H](C)C3)n2)cc1C(=O)[O-]	ZINC000072419137	136145813	/nfs/dbraw/zinc/14/58/13/136145813.db2.gz	ZYEDFRLYUXRSIV-BETUJISGSA-N	-1	0	357.410	2.854	50	0		FFAARM
Cc1nc(-c2cccc(S(=O)(=O)[N-]c3ccc(Cl)cn3)c2)no1	ZINC000035556733	506388864	/nfs/dbraw/zinc/38/88/64/506388864.db2.gz	WULGWKGWOXLKEO-UHFFFAOYSA-N	-1	0	350.787	2.894	50	0		FFAARM
CCOC(=O)Cc1c(C(=O)OCC)[n-]c(C)c1C(=O)OCc1ccccc1	ZINC000001038893	506246225	/nfs/dbraw/zinc/24/62/25/506246225.db2.gz	SUOIGDNKOOZTNL-UHFFFAOYSA-N	-1	0	373.405	2.962	50	0		FFAARM
Cc1ccnc([N-]S(=O)(=O)c2ccc(NC(=O)c3ccccc3)cc2)n1	ZINC000001057365	506246243	/nfs/dbraw/zinc/24/62/43/506246243.db2.gz	FMZNRMQXABAWLU-UHFFFAOYSA-N	-1	0	368.418	2.838	50	0		FFAARM
CC(=O)Nc1cc(N2C(=O)c3ccc(C(=O)[O-])cc3C2=O)ccc1Cl	ZINC000001168636	506251211	/nfs/dbraw/zinc/25/12/11/506251211.db2.gz	UQBTUMGUOPPOBS-UHFFFAOYSA-N	-1	0	358.737	2.797	50	0		FFAARM
O=C([O-])COc1ccc(S(=O)(=O)Nc2cccc3c2CCCC3)cc1	ZINC000032586296	506266116	/nfs/dbraw/zinc/26/61/16/506266116.db2.gz	IJPTWFAEIQKGAD-UHFFFAOYSA-N	-1	0	361.419	2.830	50	0		FFAARM
O=C(OC[C@@H]1CCCO1)c1ccccc1[N-]S(=O)(=O)c1cccs1	ZINC000032666455	506277021	/nfs/dbraw/zinc/27/70/21/506277021.db2.gz	QBKMBZYUGDRZKA-LBPRGKRZSA-N	-1	0	367.448	2.885	50	0		FFAARM
CC(=O)Nc1ccc(Nc2c([N+](=O)[O-])cc(C(=O)[O-])cc2[N+](=O)[O-])cc1	ZINC000034133222	506365125	/nfs/dbraw/zinc/36/51/25/506365125.db2.gz	LFYDLAWDPZZMQV-UHFFFAOYSA-N	-1	0	360.282	2.903	50	0		FFAARM
O=C(CCc1nnc(-c2cccc(Cl)c2)[n-]c1=O)NCc1ccncc1	ZINC000034767934	506370037	/nfs/dbraw/zinc/37/00/37/506370037.db2.gz	DPEOFERAQXXMES-UHFFFAOYSA-N	-1	0	369.812	2.542	50	0		FFAARM
CC(NCc1ccc(F)cc1)=C1C(=O)[N-]C(=O)N(c2ccc(C)cc2)C1=O	ZINC000005626000	506451901	/nfs/dbraw/zinc/45/19/01/506451901.db2.gz	HJOKZENWGZDNOR-LGMDPLHJSA-N	-1	0	367.380	2.781	50	0		FFAARM
CN(C)c1c(Cl)cccc1NS(=O)(=O)c1cccc(C(=O)[O-])c1	ZINC000040105261	506468601	/nfs/dbraw/zinc/46/86/01/506468601.db2.gz	PGGVSDZJXYYXJH-UHFFFAOYSA-N	-1	0	354.815	2.905	50	0		FFAARM
O=C([O-])CCC(=O)N1N=C(c2ccco2)C[C@@H]1c1ccc2nccnc2c1	ZINC000012420827	506861562	/nfs/dbraw/zinc/86/15/62/506861562.db2.gz	MLXUNUBGKQTERH-MRXNPFEDSA-N	-1	0	364.361	2.765	50	0		FFAARM
Cc1ccc2c(CC(=O)N[C@H](Cc3ccc(O)cc3)C(=O)[O-])coc2c1	ZINC000012993201	506921529	/nfs/dbraw/zinc/92/15/29/506921529.db2.gz	KQTIVCFEJOVWMB-QGZVFWFLSA-N	-1	0	353.374	2.801	50	0		FFAARM
CCCNc1nnc(SCC(=O)Nc2ccccc2C(=O)[O-])s1	ZINC000013035992	506925925	/nfs/dbraw/zinc/92/59/25/506925925.db2.gz	KPOZCRAWDBXJJD-UHFFFAOYSA-N	-1	0	352.441	2.789	50	0		FFAARM
COc1ccc([C@@H](CC(=O)[O-])NC(=O)c2sc(C)nc2C)cc1OC	ZINC000013184672	506932461	/nfs/dbraw/zinc/93/24/61/506932461.db2.gz	PRWOTVJZBNPMGJ-GFCCVEGCSA-N	-1	0	364.423	2.723	50	0		FFAARM
COc1ccc(CCC(=O)N2C[C@H](C(=O)[O-])Oc3ccccc32)cc1OC	ZINC000013433752	506941163	/nfs/dbraw/zinc/94/11/63/506941163.db2.gz	FGERLQDENWIDSE-GOSISDBHSA-N	-1	0	371.389	2.515	50	0		FFAARM
CC(NNc1ccccc1)=C1C(=O)[N-]C(=O)N(Cc2ccccc2)C1=O	ZINC000017014667	507111622	/nfs/dbraw/zinc/11/16/22/507111622.db2.gz	RISIFZYAMJYIHA-DTQAZKPQSA-N	-1	0	350.378	2.996	50	0		FFAARM
Cc1cccc([N-]S(=O)(=O)c2cc3c(cc2Cl)NC(=O)CO3)c1	ZINC000020491850	507225032	/nfs/dbraw/zinc/22/50/32/507225032.db2.gz	SOVCFKDIROMHFX-UHFFFAOYSA-N	-1	0	352.799	2.780	50	0		FFAARM
CCc1cccc([N-]S(=O)(=O)c2c(C)nc3sc(C)cn3c2=O)c1	ZINC000020922061	507237104	/nfs/dbraw/zinc/23/71/04/507237104.db2.gz	IINFNRHHPVJNBL-UHFFFAOYSA-N	-1	0	363.464	2.736	50	0		FFAARM
O=C([O-])c1cc(-c2cc(F)c(F)c(F)c2)cc(S(=O)(=O)NC2CC2)c1	ZINC000071759911	507712838	/nfs/dbraw/zinc/71/28/38/507712838.db2.gz	NLVYGVYUNGWWRH-UHFFFAOYSA-N	-1	0	371.336	2.910	50	0		FFAARM
CCc1nccn1CCC(=O)N1CC[C@H](Cc2cccc(C(=O)[O-])c2)C1	ZINC000072159224	507764411	/nfs/dbraw/zinc/76/44/11/507764411.db2.gz	VWVYSMMHWSDSPA-MRXNPFEDSA-N	-1	0	355.438	2.625	50	0		FFAARM
COCc1c(C)onc1C(=O)N1CCC[C@H](Cc2ccc(C(=O)[O-])cc2)C1	ZINC000072169567	507768963	/nfs/dbraw/zinc/76/89/63/507768963.db2.gz	PXZKKBAUGJEGBC-OAHLLOKOSA-N	-1	0	372.421	2.923	50	0		FFAARM
COc1ccccc1OC1(C(=O)[O-])CCN(C(=O)C[C@@H]2C=CCC2)CC1	ZINC000072430753	507789866	/nfs/dbraw/zinc/78/98/66/507789866.db2.gz	BKISCCBLBAKXCX-OAHLLOKOSA-N	-1	0	359.422	2.876	50	0		FFAARM
COc1ccccc1CCNc1nccc(-c2cc(C(=O)[O-])ccn2)n1	ZINC000072440527	507792188	/nfs/dbraw/zinc/79/21/88/507792188.db2.gz	WPIWQHUXLWIWPH-UHFFFAOYSA-N	-1	0	350.378	2.900	50	0		FFAARM
COc1ccccc1[C@@H]1CN(C(=O)c2cc(C)n(C)c2C)C[C@H]1C(=O)[O-]	ZINC000091625286	507997254	/nfs/dbraw/zinc/99/72/54/507997254.db2.gz	JZVPNUNJGCVIND-DLBZAZTESA-N	-1	0	356.422	2.591	50	0		FFAARM
COc1cccc2c1OC[C@@H](C[N-]S(=O)(=O)c1c(F)cccc1F)C2	ZINC000095357529	508175255	/nfs/dbraw/zinc/17/52/55/508175255.db2.gz	TWHLIPWNYNWLGK-LLVKDONJSA-N	-1	0	369.389	2.503	50	0		FFAARM
C[C@@H](NC(=O)c1nn(-c2ccccc2C(F)(F)F)cc1[O-])[C@@H]1CCCO1	ZINC000095356833	508175485	/nfs/dbraw/zinc/17/54/85/508175485.db2.gz	RDTARVLMQGKLPT-YGRLFVJLSA-N	-1	0	369.343	2.894	50	0		FFAARM
CC1CCN(C(=O)c2cccc([C@H](C(=O)[O-])N3CCSCC3)c2)CC1	ZINC000095362249	508175900	/nfs/dbraw/zinc/17/59/00/508175900.db2.gz	FMCXXXDNFJHLHD-QGZVFWFLSA-N	-1	0	362.495	2.733	50	0		FFAARM
COc1ccc2c(c1)OC[C@]1(C(=O)[O-])CN(C(=O)c3ccc(C)s3)C[C@H]21	ZINC000095378189	508180730	/nfs/dbraw/zinc/18/07/30/508180730.db2.gz	OCOZZDYCBNVAQZ-AUUYWEPGSA-N	-1	0	373.430	2.768	50	0		FFAARM
CCOCCN(Cc1ccc(C(=O)[O-])o1)C(=O)c1sccc1OC	ZINC000095424546	508185304	/nfs/dbraw/zinc/18/53/04/508185304.db2.gz	WFXHWNLIDAEAKR-UHFFFAOYSA-N	-1	0	353.396	2.727	50	0		FFAARM
O=c1c2[n-][nH]n(Cc3ccc(F)cc3)c=2c(=O)n1-c1ccc(F)c(F)c1	ZINC000095481465	508188954	/nfs/dbraw/zinc/18/89/54/508188954.db2.gz	XVHSDCKQGRBAFF-HUUCEWRRSA-N	-1	0	360.295	2.597	50	0		FFAARM
O=C(C[C@@H](c1ccccc1)c1ccc(Cl)cc1)NCc1n[nH]c(=O)[n-]1	ZINC000095500425	508190636	/nfs/dbraw/zinc/19/06/36/508190636.db2.gz	KEHSGVMDTGBKPN-HNNXBMFYSA-N	-1	0	356.813	2.590	50	0		FFAARM
COc1nc2c(cc1C(=O)N1CCc3ccccc3[C@@H]1CC(=O)[O-])CCC2	ZINC000095512864	508193223	/nfs/dbraw/zinc/19/32/23/508193223.db2.gz	FDGCOLAFSSPRCX-SFHVURJKSA-N	-1	0	366.417	2.793	50	0		FFAARM
CC(C)c1ccc(N2C[C@@H](C(=O)NC3(C(=O)[O-])CCCC3)CC2=O)cc1	ZINC000095529149	508196957	/nfs/dbraw/zinc/19/69/57/508196957.db2.gz	JOQRFHZTEGGVOD-HNNXBMFYSA-N	-1	0	358.438	2.677	50	0		FFAARM
O=C([O-])c1ccccc1-n1nc(-c2ccncc2)nc1C[C@H]1CCCOC1	ZINC000096135932	508207420	/nfs/dbraw/zinc/20/74/20/508207420.db2.gz	LTTOEGOCYMYPIZ-CQSZACIVSA-N	-1	0	364.405	2.997	50	0		FFAARM
O=C(c1ccccc1)N1CCc2c(nc3cc(-c4ccccc4)[n-]n3c2=O)C1	ZINC000097123516	508219436	/nfs/dbraw/zinc/21/94/36/508219436.db2.gz	OWMPYDQLXQLAAY-UHFFFAOYSA-N	-1	0	370.412	2.888	50	0		FFAARM
C[C@H]1c2cc(F)ccc2CCN1C(=O)c1ccc(N2CC(=O)N=C2[O-])cc1	ZINC000097578409	508226607	/nfs/dbraw/zinc/22/66/07/508226607.db2.gz	OQCJPQBWPGYZBD-LBPRGKRZSA-N	-1	0	367.380	2.641	50	0		FFAARM
Cc1ccc(-c2nc([C@H](c3cccnc3)N3CCCC3)n(CC(=O)[O-])n2)o1	ZINC000097679865	508227863	/nfs/dbraw/zinc/22/78/63/508227863.db2.gz	DMRWIKJIWHVNOE-KRWDZBQOSA-N	-1	0	367.409	2.511	50	0		FFAARM
CCOc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccccc4F)c=3c2=O)cc1	ZINC000101417796	508241415	/nfs/dbraw/zinc/24/14/15/508241415.db2.gz	XQXWODUDKCZOQL-IRXDYDNUSA-N	-1	0	368.368	2.718	50	0		FFAARM
Cn1c(=O)c2ccc(C(=O)NCC3(c4ccccc4)CC3)cc2[n-]c1=S	ZINC000102669883	508281193	/nfs/dbraw/zinc/28/11/93/508281193.db2.gz	HKKPCWYPTYEOIU-UHFFFAOYSA-N	-1	0	365.458	2.684	50	0		FFAARM
Cc1cc(C(=O)N2CCC[C@H]2c2n[nH]c(=O)[n-]2)c2ccc(C)c(C)c2n1	ZINC000077319174	508300129	/nfs/dbraw/zinc/30/01/29/508300129.db2.gz	XSLLAAJXVWGGOD-HNNXBMFYSA-N	-1	0	351.410	2.549	50	0		FFAARM
CCCCCn1nc(C(=O)N2CCC[C@H](C(=O)[O-])C2)c2ccccc2c1=O	ZINC000236696642	509483533	/nfs/dbraw/zinc/48/35/33/509483533.db2.gz	YVFLQTZTDIXHDA-AWEZNQCLSA-N	-1	0	371.437	2.524	50	0		FFAARM
Cc1cc([C@H]2CCCCN2CC(=O)Nc2nc(C)c(C(=O)[O-])s2)no1	ZINC000240128284	509839746	/nfs/dbraw/zinc/83/97/46/509839746.db2.gz	IPIUIFGAQSJSQS-GFCCVEGCSA-N	-1	0	364.427	2.612	50	0		FFAARM
COc1ccc(C2(C(=O)N3CCc4[nH]nc(C(=O)[O-])c4C3)CCCC2)cc1	ZINC000252502469	509845821	/nfs/dbraw/zinc/84/58/21/509845821.db2.gz	UQXWTZJRUDKTDB-UHFFFAOYSA-N	-1	0	369.421	2.513	50	0		FFAARM
CC[C@H](C)[C@@H](NC(=O)CCc1nc(-c2cccc3[nH]ccc32)no1)C(=O)[O-]	ZINC000252552895	509852278	/nfs/dbraw/zinc/85/22/78/509852278.db2.gz	VEWGJRXPIOULQD-APPDUMDISA-N	-1	0	370.409	2.766	50	0		FFAARM
O=C(c1ccccn1)[C@H]1CCCN(Cc2nc(=O)c3sccc3[n-]2)C1	ZINC000253536788	509887924	/nfs/dbraw/zinc/88/79/24/509887924.db2.gz	OSHWLVGBYPRPMC-LBPRGKRZSA-N	-1	0	354.435	2.887	50	0		FFAARM
Cc1ccc(-c2noc(CCC(=O)N3CCC[C@H]3CC(=O)[O-])n2)cc1F	ZINC000262917383	510475336	/nfs/dbraw/zinc/47/53/36/510475336.db2.gz	KBPJAEVTKZAHHI-ZDUSSCGKSA-N	-1	0	361.373	2.582	50	0		FFAARM
O=C([O-])c1cccc(CNC(=O)CCN2C(=O)CCc3cc(F)ccc32)c1	ZINC000299743573	511668499	/nfs/dbraw/zinc/66/84/99/511668499.db2.gz	LKQDEFKWQODCGF-UHFFFAOYSA-N	-1	0	370.380	2.510	50	0		FFAARM
O=C(NCc1nc(C2CCCCC2)no1)c1cc(=O)n(-c2ccccc2)[n-]1	ZINC000299778111	511678036	/nfs/dbraw/zinc/67/80/36/511678036.db2.gz	OMCATKFWTPEGKN-UHFFFAOYSA-N	-1	0	367.409	2.526	50	0		FFAARM
Cc1noc(C)c1CO[C@@H]1CCN(C(=O)c2cc(F)c(F)c([O-])c2F)C1	ZINC000364014650	511907180	/nfs/dbraw/zinc/90/71/80/511907180.db2.gz	OTQSJPAOGKIHIY-SNVBAGLBSA-N	-1	0	370.327	2.846	50	0		FFAARM
COc1ccc(F)c(F)c1CN1CCC[C@@H](c2ccn(CC(=O)[O-])n2)C1	ZINC000426509384	513963909	/nfs/dbraw/zinc/96/39/09/513963909.db2.gz	NMCOEPKUWWZRLL-GFCCVEGCSA-N	-1	0	365.380	2.634	50	0		FFAARM
CSCC[C@@H](NC(=O)N(C)Cc1cc2cc(F)ccc2[nH]1)C(=O)[O-]	ZINC000426658510	514007235	/nfs/dbraw/zinc/00/72/35/514007235.db2.gz	QRDVZPWGWNKQLS-CQSZACIVSA-N	-1	0	353.419	2.655	50	0		FFAARM
Cc1cc(-c2cccc(C(=O)NCC3(C)COC3)c2)nc(C)c1C(=O)[O-]	ZINC000584888086	518523791	/nfs/dbraw/zinc/52/37/91/518523791.db2.gz	FYGKOJLOVUKLBX-UHFFFAOYSA-N	-1	0	354.406	2.830	50	0		FFAARM
O=C([O-])CCN(C(=O)CCOc1ccccc1Cl)C1CCOCC1	ZINC000578108185	519419161	/nfs/dbraw/zinc/41/91/61/519419161.db2.gz	HYYVHTQIUPEZNE-UHFFFAOYSA-N	-1	0	355.818	2.591	50	0		FFAARM
CCCn1ccnc1CN1CCC(Oc2cccc(F)c2)(C(=O)[O-])CC1	ZINC000082120005	521662258	/nfs/dbraw/zinc/66/22/58/521662258.db2.gz	LEFOGQUYBMTBEE-UHFFFAOYSA-N	-1	0	361.417	2.930	50	0		FFAARM
C[C@H](Oc1ccc(NC(=O)[C@H]2OCCc3ccccc32)cc1F)C(=O)[O-]	ZINC000630258903	522745124	/nfs/dbraw/zinc/74/51/24/522745124.db2.gz	VBYZBSYGGZLDFJ-GTNSWQLSSA-N	-1	0	359.353	2.930	50	0		FFAARM
O=C([O-])c1ccc(-n2nnnc2SCC(=O)c2ccc(Cl)cc2)cc1	ZINC000019853620	526359776	/nfs/dbraw/zinc/35/97/76/526359776.db2.gz	YIZUJTXFTMTBTP-UHFFFAOYSA-N	-1	0	374.809	2.989	50	0		FFAARM
Cc1oc(CN(C)C(=O)[C@@H]2C[C@@H]2c2ccc3c(c2)OCCO3)cc1C(=O)[O-]	ZINC000268944405	526769349	/nfs/dbraw/zinc/76/93/49/526769349.db2.gz	VHWZGMNFQCZURJ-HZPDHXFCSA-N	-1	0	371.389	2.820	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)C[C@H]1CCOC1)c1ccc(Br)cc1	ZINC000299742085	527624353	/nfs/dbraw/zinc/62/43/53/527624353.db2.gz	GTNTZGAZHPDWIT-ZWNOBZJWSA-N	-1	0	356.216	2.508	50	0		FFAARM
CN(Cc1ccc(C(=O)[O-])cc1)C(=O)CCN1C(=O)CCc2ccccc21	ZINC000237022352	536466058	/nfs/dbraw/zinc/46/60/58/536466058.db2.gz	BCWJYQRQLCVOPS-UHFFFAOYSA-N	-1	0	366.417	2.713	50	0		FFAARM
Cc1nn(-c2ccc(F)cc2)c(C)c1S(=O)(=O)[N-]c1cc(C)ccn1	ZINC000064946985	571134969	/nfs/dbraw/zinc/13/49/69/571134969.db2.gz	KCLKEVGIJKRIGI-UHFFFAOYSA-N	-1	0	360.414	3.132	50	0		FFAARM
C[C@H](C(=O)[O-])[C@@H](NC(=O)CN1C(=O)CCc2ccccc21)c1ccccc1	ZINC000262539600	601171704	/nfs/dbraw/zinc/17/17/04/601171704.db2.gz	RAEMYMUTEXOFLF-VBKZILBWSA-N	-1	0	366.417	2.544	50	0		FFAARM
Cc1cc(=O)n2nc(Cc3nc(-c4ccc(C)c(Cl)c4)no3)[n-]c2n1	ZINC000020295554	727832482	/nfs/dbraw/zinc/83/24/82/727832482.db2.gz	MHHUALRSJZUTIQ-UHFFFAOYSA-N	-1	0	356.773	2.741	50	0		FFAARM
O=C([O-])c1ccc2c(c1)c1c(n2Cc2ccccc2)CCS(=O)(=O)C1	ZINC000023550001	727846970	/nfs/dbraw/zinc/84/69/70/727846970.db2.gz	SMHMCJWJBNNZLK-UHFFFAOYSA-N	-1	0	355.415	2.859	50	0		FFAARM
CN(Cc1nccs1)[C@H]1CC12CCN(c1ccnc(C(=O)[O-])c1)CC2	ZINC000650768323	731026324	/nfs/dbraw/zinc/02/63/24/731026324.db2.gz	UXZYGXJYRHMDNO-HNNXBMFYSA-N	-1	0	358.467	2.727	50	0		FFAARM
CCc1nc(N)sc1C(=O)N1CC[C@H](Cc2ccc(C(=O)[O-])cc2)C1	ZINC000072473225	845555472	/nfs/dbraw/zinc/55/54/72/845555472.db2.gz	BMIWFSSJKMYRLQ-GFCCVEGCSA-N	-1	0	359.451	2.691	50	0		FFAARM
O=C([O-])[C@]1(CCCc2ccccc2)CCCN(C(=O)c2ccc(=O)[nH]c2)C1	ZINC000071750216	1019682497	/nfs/dbraw/zinc/68/24/97/1019682497.db2.gz	SYKMVULXHMYLCO-OAQYLSRUSA-N	-1	0	368.433	2.705	50	0		FFAARM
Cc1c(C(=O)[O-])cnn1-c1ccc(C(=O)N2C[C@@H](C)OCC2(C)C)cc1	ZINC000191653030	1023886674	/nfs/dbraw/zinc/88/66/74/1023886674.db2.gz	YDQZUSCJJMNWTP-GFCCVEGCSA-N	-1	0	357.410	2.518	50	0		FFAARM
O=C([O-])[C@@H]1CCN(S(=O)(=O)c2cccc3c2OCCC3)c2ccccc21	ZINC000656643466	1025434880	/nfs/dbraw/zinc/43/48/80/1025434880.db2.gz	HVGWGRTUGSMQEW-OAHLLOKOSA-N	-1	0	373.430	2.779	50	0		FFAARM
CCc1cc(C(=O)N2C[C@@H](c3ccc4c(c3)OCO4)[C@H](C(=O)[O-])C2)cs1	ZINC000091808614	1027067595	/nfs/dbraw/zinc/06/75/95/1027067595.db2.gz	PIFRWFGTAAAZOA-LSDHHAIUSA-N	-1	0	373.430	2.980	50	0		FFAARM
COc1ccc(OC)c([C@H](C(=O)[O-])N(C)Cc2cnc3ccccn23)c1	ZINC001506419833	1059509059	/nfs/dbraw/zinc/50/90/59/1059509059.db2.gz	YDRLDVVFTNECLC-GOSISDBHSA-N	-1	0	355.394	2.609	50	0		FFAARM
Cc1nc([C@H](C)N(C)S(=O)(=O)c2ccsc2C(=O)[O-])c(C)s1	ZINC001506423850	1059511722	/nfs/dbraw/zinc/51/17/22/1059511722.db2.gz	XZVHCPIUOOWROS-ZETCQYMHSA-N	-1	0	360.482	2.901	50	0		FFAARM
COc1c(C)cc([C@H](C(=O)[O-])N2CCN(CC(F)(F)F)CC2)cc1C	ZINC001529142889	1062183346	/nfs/dbraw/zinc/18/33/46/1062183346.db2.gz	UUCMBGOZLWQWFV-CQSZACIVSA-N	-1	0	360.376	2.618	50	0		FFAARM
O=C([O-])c1cc(O)ccc1NC(=O)COc1ccc(Br)cc1	ZINC000004919663	219624946	/nfs/dbraw/zinc/62/49/46/219624946.db2.gz	WOXGEXLXCMSLEG-UHFFFAOYSA-N	-1	0	366.167	2.870	50	0		FFAARM
COc1ccc2c(c1)c(=O)c(C(=O)[O-])c(-c1ccc3c(c1)OCO3)n2C	ZINC000000717516	203945561	/nfs/dbraw/zinc/94/55/61/203945561.db2.gz	QHGWVYQPFKYXMQ-UHFFFAOYSA-N	-1	0	353.330	2.641	50	0		FFAARM
O=C([O-])[C@H]1CCCN1S(=O)(=O)c1cc(Cl)c(Cl)cc1Cl	ZINC000001393188	204003727	/nfs/dbraw/zinc/00/37/27/204003727.db2.gz	WAAHPRDFNUTCLD-SECBINFHSA-N	-1	0	358.630	2.885	50	0		FFAARM
O=c1[nH]c2ccc(S(=O)(=O)[N-]c3cccc4cccnc43)cc2s1	ZINC000001424460	204006141	/nfs/dbraw/zinc/00/61/41/204006141.db2.gz	VUOWQYTWOGCKIZ-UHFFFAOYSA-N	-1	0	357.416	2.939	50	0		FFAARM
Cc1ccc(S(=O)(=O)[N-]c2cccc(-c3ccc(=O)n(C)n3)c2)s1	ZINC000010324842	204008127	/nfs/dbraw/zinc/00/81/27/204008127.db2.gz	FBFSHOSYVULSLQ-UHFFFAOYSA-N	-1	0	361.448	2.618	50	0		FFAARM
CCOC(=O)c1c(C)n(C)c2ccc(OC(=O)N=C([O-])C(F)(F)F)cc21	ZINC000001470931	204009096	/nfs/dbraw/zinc/00/90/96/204009096.db2.gz	VYJIAQPIHQZKKH-UHFFFAOYSA-N	-1	0	372.299	2.841	50	0		FFAARM
CC(C)[C@H](O)[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)[O-]	ZINC000002583273	204045061	/nfs/dbraw/zinc/04/50/61/204045061.db2.gz	LYRGLIQVUMAZJU-MOPGFXCFSA-N	-1	0	369.417	2.995	50	0		FFAARM
O=C1N[C@@H](c2ccccc2)C(=C([O-])c2cccs2)[C@](O)(C(F)(F)F)N1	ZINC000004163467	204124430	/nfs/dbraw/zinc/12/44/30/204124430.db2.gz	OXRRYKXYECAQSB-HUBLWGQQSA-N	-1	0	370.352	2.852	50	0		FFAARM
COc1cc(N)c(Cl)cc1C(=O)OCc1nc(=O)c2sccc2[n-]1	ZINC000005172151	204195555	/nfs/dbraw/zinc/19/55/55/204195555.db2.gz	ITRICMVSRKXEGB-UHFFFAOYSA-N	-1	0	365.798	2.586	50	0		FFAARM
COc1ccc(NC(=O)C2CC2)cc1[N-]S(=O)(=O)c1ccc(F)cc1	ZINC000005926104	204230742	/nfs/dbraw/zinc/23/07/42/204230742.db2.gz	FPUROKPECUGAIG-UHFFFAOYSA-N	-1	0	364.398	2.984	50	0		FFAARM
C[C@H](OC(=O)c1cc(=O)c2ccccc2[n-]1)C(=O)Nc1ccccc1F	ZINC000006605902	204256071	/nfs/dbraw/zinc/25/60/71/204256071.db2.gz	UZGZINXJOLNYPN-NSHDSACASA-N	-1	0	354.337	2.851	50	0		FFAARM
COc1ccccc1[N-]S(=O)(=O)c1ccc2c(c1)NC(=O)[C@@H](C)S2	ZINC000006779342	204269528	/nfs/dbraw/zinc/26/95/28/204269528.db2.gz	ZNSKNAQPINXBGP-SNVBAGLBSA-N	-1	0	364.448	2.929	50	0		FFAARM
O=C([O-])c1ccc(Br)c(N2C(=O)[C@@H]3CC=CC[C@@H]3C2=O)c1	ZINC000012428456	204460662	/nfs/dbraw/zinc/46/06/62/204460662.db2.gz	JZIPZDADEZRTHY-AOOOYVTPSA-N	-1	0	350.168	2.603	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)c1cccc(CN2CCCC2=O)c1)c1cccs1	ZINC000013389956	204529801	/nfs/dbraw/zinc/52/98/01/204529801.db2.gz	BUERKIFPSGJBCW-OAHLLOKOSA-N	-1	0	372.446	2.816	50	0		FFAARM
COc1ccc(/C=C2\SC(=O)N(CCCC(=O)[O-])C2=O)c(OC)c1	ZINC000013769112	204553502	/nfs/dbraw/zinc/55/35/02/204553502.db2.gz	APGJXZCFDNEIMG-JYRVWZFOSA-N	-1	0	351.380	2.605	50	0		FFAARM
O=C([O-])c1ccc(NC(=O)[C@H]2CC(=O)Nc3nc4ccccc4n32)cc1	ZINC000040268866	205065591	/nfs/dbraw/zinc/06/55/91/205065591.db2.gz	HHRMUMKDIYHDTD-CQSZACIVSA-N	-1	0	350.334	2.906	50	0		FFAARM
COc1cccc([C@H](c2sc3ncnn3c2[O-])N2CCCC2)c1OC	ZINC000041634550	205092250	/nfs/dbraw/zinc/09/22/50/205092250.db2.gz	KBXJRUUKRIEYBR-CYBMUJFWSA-N	-1	0	360.439	2.699	50	0		FFAARM
O=C([O-])[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1OCCc2ccccc21	ZINC000299743743	205125729	/nfs/dbraw/zinc/12/57/29/205125729.db2.gz	LZMGZBQTOBXXPZ-OALUTQOASA-N	-1	0	364.401	2.594	50	0		FFAARM
O=C([O-])c1cccc(CNC(=O)c2cc(N3CCCC3=O)ccc2F)c1	ZINC000299744355	205126459	/nfs/dbraw/zinc/12/64/59/205126459.db2.gz	OIYQANBJURINLQ-UHFFFAOYSA-N	-1	0	356.353	2.581	50	0		FFAARM
CCOc1cc(C(=O)N2CCOc3ccccc3C2)ccc1OCC(=O)[O-]	ZINC000299745715	205127382	/nfs/dbraw/zinc/12/73/82/205127382.db2.gz	SBZSMFXBLSMYRM-UHFFFAOYSA-N	-1	0	371.389	2.584	50	0		FFAARM
COc1ccc(CNC(=O)[C@@H]2CSc3ccccc3O2)cc1C(=O)[O-]	ZINC000299750971	205133008	/nfs/dbraw/zinc/13/30/08/205133008.db2.gz	OYAPUNNNKOCRHJ-HNNXBMFYSA-N	-1	0	359.403	2.563	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)C[C@H]1CCOC1)c1ccc(OC(F)(F)F)cc1	ZINC000299752976	205134630	/nfs/dbraw/zinc/13/46/30/205134630.db2.gz	WHAYBHGUFMSGMM-MFKMUULPSA-N	-1	0	361.316	2.644	50	0		FFAARM
O=C([O-])c1cn(Cc2cn3c(n2)SCC3)cc(Oc2ccccc2)c1=O	ZINC000055042258	205205679	/nfs/dbraw/zinc/20/56/79/205205679.db2.gz	XHTRHMAJBVVYBS-UHFFFAOYSA-N	-1	0	369.402	2.689	50	0		FFAARM
CCN(c1cccc(F)c1)S(=O)(=O)c1cc(CC(=O)[O-])ccc1OC	ZINC000057119516	205235514	/nfs/dbraw/zinc/23/55/14/205235514.db2.gz	SYSSTLOOYNMKAI-UHFFFAOYSA-N	-1	0	367.398	2.677	50	0		FFAARM
Cc1cc([C@H](C(=O)[O-])N(C)Cc2nc(-c3ccncc3)no2)ccc1F	ZINC000055393483	205217494	/nfs/dbraw/zinc/21/74/94/205217494.db2.gz	CEIHOLAUKOJACB-MRXNPFEDSA-N	-1	0	356.357	2.837	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)CCNC(=O)C1CCCC1)c1ccccc1Cl	ZINC000058131481	205251190	/nfs/dbraw/zinc/25/11/90/205251190.db2.gz	JCPBXMKMODNONN-OAHLLOKOSA-N	-1	0	366.845	2.669	50	0		FFAARM
Cc1ccc(C(=O)Nc2ccccc2[N-]S(=O)(=O)c2cn[nH]c2)cc1	ZINC000058210071	205262904	/nfs/dbraw/zinc/26/29/04/205262904.db2.gz	SQZLISAYRVOCQA-UHFFFAOYSA-N	-1	0	356.407	2.771	50	0		FFAARM
Cc1cc(S(=O)(=O)Nc2cc(F)ccc2F)ccc1OCC(=O)[O-]	ZINC000058394008	205274773	/nfs/dbraw/zinc/27/47/73/205274773.db2.gz	ITBMCEIZTAHLGO-UHFFFAOYSA-N	-1	0	357.334	2.537	50	0		FFAARM
COc1ccccc1[C@H]1CC(=O)Nc2c(C(=O)[O-])cn(-c3cc(C)on3)c21	ZINC000061718929	205286600	/nfs/dbraw/zinc/28/66/00/205286600.db2.gz	NQYFENJJVPSDBR-GFCCVEGCSA-N	-1	0	367.361	2.955	50	0		FFAARM
Cc1cc(C(=O)[O-])c(O)c(S(=O)(=O)Nc2ccc(F)c(F)c2F)c1	ZINC000058406247	205274999	/nfs/dbraw/zinc/27/49/99/205274999.db2.gz	MPSLBPJPGIIVOB-UHFFFAOYSA-N	-1	0	361.297	2.617	50	0		FFAARM
COc1ccc([C@@H]2CC(=O)NCc3nc4cc(C)ccn4c32)cc1C(=O)[O-]	ZINC000065373396	205341220	/nfs/dbraw/zinc/34/12/20/205341220.db2.gz	DOGMXEOOEVLMKW-ZDUSSCGKSA-N	-1	0	365.389	2.501	50	0		FFAARM
Cc1n[nH]c(C)c1[C@@H](NC(=O)c1ccc2cccc(Cl)c2n1)C(=O)[O-]	ZINC000067654350	205380652	/nfs/dbraw/zinc/38/06/52/205380652.db2.gz	PTVBVGJAZWGIAD-OAHLLOKOSA-N	-1	0	358.785	2.784	50	0		FFAARM
COc1cc(-c2ccc3ncc(C(=O)[O-])c(O)c3c2)cc(OC)c1OC	ZINC000067774315	205390420	/nfs/dbraw/zinc/39/04/20/205390420.db2.gz	VGWHVJZDWBDHTJ-UHFFFAOYSA-N	-1	0	355.346	2.919	50	0		FFAARM
O=C([O-])c1n[nH]cc1CN1CCc2nc[nH]c2[C@@H]1c1ccnc2ccccc21	ZINC000067868041	205399588	/nfs/dbraw/zinc/39/95/88/205399588.db2.gz	IFSPNSGEQKHYAF-IBGZPJMESA-N	-1	0	374.404	2.527	50	0		FFAARM
O=C(Cc1ccccc1C(=O)[O-])Nc1nnc(COc2ccccc2)s1	ZINC000071289122	205427062	/nfs/dbraw/zinc/42/70/62/205427062.db2.gz	CJDIDFVKGQCDQR-UHFFFAOYSA-N	-1	0	369.402	2.997	50	0		FFAARM
COc1cc(S(=O)(=O)[N-]c2onc(C)c2C)ccc1Br	ZINC000079108494	205637296	/nfs/dbraw/zinc/63/72/96/205637296.db2.gz	XJIQVZTYXMDXIJ-UHFFFAOYSA-N	-1	0	361.217	2.863	50	0		FFAARM
CS(=O)(=O)[N-]c1ccccc1C(=O)Nc1ccc2c(c1)OC(F)(F)O2	ZINC000048342784	206081840	/nfs/dbraw/zinc/08/18/40/206081840.db2.gz	WNYWRWWFFIANII-UHFFFAOYSA-N	-1	0	370.333	2.632	50	0		FFAARM
COc1ccc(Br)cc1CCC(=O)N1CCC(C(=O)[O-])CC1	ZINC000237120756	206087088	/nfs/dbraw/zinc/08/70/88/206087088.db2.gz	XURYSOPFGGNYBZ-UHFFFAOYSA-N	-1	0	370.243	2.714	50	0		FFAARM
C[C@@H](CC(=O)N1CCO[C@@H](CC(=O)[O-])C1)c1cccc(C(F)(F)F)c1	ZINC000237335001	206100349	/nfs/dbraw/zinc/10/03/49/206100349.db2.gz	MACDDXVAEUBKRQ-FZMZJTMJSA-N	-1	0	359.344	2.901	50	0		FFAARM
Cc1ccc(CN2C(=O)CC[C@H]2C(=O)N2CCC[C@@H](CCC(=O)[O-])C2)cc1	ZINC000237733570	206106638	/nfs/dbraw/zinc/10/66/38/206106638.db2.gz	IZDYYGJHULGZFJ-WMZOPIPTSA-N	-1	0	372.465	2.589	50	0		FFAARM
C[C@]1(C(=O)[O-])CCN(C(=O)[C@@H]2C[C@@H]2c2ccc(Br)cc2)C1	ZINC000237646860	206106834	/nfs/dbraw/zinc/10/68/34/206106834.db2.gz	WGLAKHHJBKONIC-IOASZLSFSA-N	-1	0	352.228	2.876	50	0		FFAARM
C[C@]1(C(=O)[O-])CCN(C(=O)c2c[nH]c3cccc(Br)c32)C1	ZINC000237652778	206107284	/nfs/dbraw/zinc/10/72/84/206107284.db2.gz	ZZUUEBRSORXVMM-HNNXBMFYSA-N	-1	0	351.200	2.867	50	0		FFAARM
C[C@@]1(C(=O)[O-])CCN(C(=O)Cc2csc(Cc3ccc(F)cc3)n2)C1	ZINC000237647000	206108230	/nfs/dbraw/zinc/10/82/30/206108230.db2.gz	ZNLLCRZDUJTZRC-GOSISDBHSA-N	-1	0	362.426	2.739	50	0		FFAARM
O=C([O-])CCN(C(=O)[C@H]1C[C@H]1c1ccc(F)cc1F)C1CCOCC1	ZINC000238070383	206113053	/nfs/dbraw/zinc/11/30/53/206113053.db2.gz	PEMYCTQANMGCPC-GJZGRUSLSA-N	-1	0	353.365	2.551	50	0		FFAARM
O=C([O-])[C@H]1CCN(C(=O)CCCc2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000238084314	206114013	/nfs/dbraw/zinc/11/40/13/206114013.db2.gz	NBIDNXLAWZDION-LBPRGKRZSA-N	-1	0	363.801	2.646	50	0		FFAARM
O=C([O-])c1ccc(S(=O)(=O)N[C@H]2CCCC[C@H]2C(F)(F)F)c(F)c1	ZINC000225436666	206118430	/nfs/dbraw/zinc/11/84/30/206118430.db2.gz	XFUCACKIMWFIBN-KOLCDFICSA-N	-1	0	369.336	2.923	50	0		FFAARM
O=C([O-])[C@H]1CCCN(C(=O)c2c[nH]c3cccc(Br)c23)C1	ZINC000238075004	206112422	/nfs/dbraw/zinc/11/24/22/206112422.db2.gz	PFBVTORVJDDNAD-VIFPVBQESA-N	-1	0	351.200	2.867	50	0		FFAARM
COC(=O)[C@@]([N-]c1ccccc1F)(NC(=O)OC(C)C)C(F)(F)F	ZINC000002272570	206154185	/nfs/dbraw/zinc/15/41/85/206154185.db2.gz	LCOJADXEPHDQPB-CYBMUJFWSA-N	-1	0	352.284	2.804	50	0		FFAARM
O=C(CSC1=Nc2ccc(F)cc2S(=O)(=O)[N-]1)Nc1ccccc1	ZINC000004853604	206183029	/nfs/dbraw/zinc/18/30/29/206183029.db2.gz	PACLCXSRVKWDND-UHFFFAOYSA-N	-1	0	365.411	2.668	50	0		FFAARM
COC(=O)c1ccc(C)c([N-]S(=O)(=O)c2cc(OC)ccc2OC)c1	ZINC000005120857	206189913	/nfs/dbraw/zinc/18/99/13/206189913.db2.gz	OKBHRRAPOMVDMB-UHFFFAOYSA-N	-1	0	365.407	2.600	50	0		FFAARM
CCO[C@H]1C[C@H](N(C)C(=O)c2ccc3c(c2)[n-]c(=S)[nH]c3=O)C12CCC2	ZINC000160541489	206228074	/nfs/dbraw/zinc/22/80/74/206228074.db2.gz	OROIFRRWOUFPOM-GJZGRUSLSA-N	-1	0	373.478	2.632	50	0		FFAARM
COc1ccccc1CNS(=O)(=O)c1cc(C(=O)[O-])ccc1Cl	ZINC000007986349	206246323	/nfs/dbraw/zinc/24/63/23/206246323.db2.gz	UQGZYYUGUFNHSO-UHFFFAOYSA-N	-1	0	355.799	2.525	50	0		FFAARM
CS(=O)(=O)c1ccc(C(=O)Nc2cc(Cl)ccc2C(=O)[O-])cc1	ZINC000008429603	206248322	/nfs/dbraw/zinc/24/83/22/206248322.db2.gz	XGTSRZKMEWTMEC-UHFFFAOYSA-N	-1	0	353.783	2.694	50	0		FFAARM
CC(C)(C)c1nc(CC(=O)Nc2ccc(-c3nc(=O)o[n-]3)cc2)cs1	ZINC000170620491	206276036	/nfs/dbraw/zinc/27/60/36/206276036.db2.gz	BRGLVAMUSLGLCP-UHFFFAOYSA-N	-1	0	358.423	2.965	50	0		FFAARM
Cc1cc(C(=O)[O-])ccc1NS(=O)(=O)c1ccc2c(c1)OCCCO2	ZINC000012541859	206293576	/nfs/dbraw/zinc/29/35/76/206293576.db2.gz	ZLLDCLKFGFQFCQ-UHFFFAOYSA-N	-1	0	363.391	2.655	50	0		FFAARM
COc1cc(C)c(NS(=O)(=O)c2cc(C(=O)[O-])ccc2C)cc1OC	ZINC000013028989	206299563	/nfs/dbraw/zinc/29/95/63/206299563.db2.gz	RKRFXPMPBPSBTE-UHFFFAOYSA-N	-1	0	365.407	2.820	50	0		FFAARM
CCOc1ccccc1N1C(=O)C[C@@H](Sc2ncccc2C(=O)[O-])C1=O	ZINC000019880983	206328177	/nfs/dbraw/zinc/32/81/77/206328177.db2.gz	RQTOUFWQNMUXAE-CQSZACIVSA-N	-1	0	372.402	2.603	50	0		FFAARM
O=C(c1cc(=O)n(-c2ccccc2)[n-]1)N1CC(Oc2cccc(Cl)c2)C1	ZINC000215039175	206344528	/nfs/dbraw/zinc/34/45/28/206344528.db2.gz	IINGTXQJJYIOMY-UHFFFAOYSA-N	-1	0	369.808	2.722	50	0		FFAARM
CCc1nc2sc([C@H](c3ccccc3)N3CCN(CC)CC3)c([O-])n2n1	ZINC000022577993	206379280	/nfs/dbraw/zinc/37/92/80/206379280.db2.gz	PBWFQMBVQULEDS-INIZCTEOSA-N	-1	0	371.510	2.786	50	0		FFAARM
COc1ccc(/C=C/C(=O)[O-])cc1S(=O)(=O)N(C)c1ccc(C)cc1	ZINC000065667941	206526126	/nfs/dbraw/zinc/52/61/26/206526126.db2.gz	WYBUABDZGPPINB-YRNVUSSQSA-N	-1	0	361.419	2.927	50	0		FFAARM
CC(C)c1nn(C)c2sc(C(=O)N3CCCC[C@H]3c3n[nH]c(=O)[n-]3)cc12	ZINC000329481042	258139959	/nfs/dbraw/zinc/13/99/59/258139959.db2.gz	VRKPJVOFYMMDDC-NSHDSACASA-N	-1	0	374.470	2.949	50	0		FFAARM
Cc1ccc2c(C)cc(N3CCC4(CC3)NC(=O)C[C@H]4C(=O)[O-])nc2c1C	ZINC000095381099	132209430	/nfs/dbraw/zinc/20/94/30/132209430.db2.gz	MLTDZQOOWOZGDE-INIZCTEOSA-N	-1	0	367.449	2.720	50	0		FFAARM
O=C([O-])c1ccc(-c2ccccc2)nc1N1CCC2(CC1)OCCC[C@@H]2O	ZINC000095380550	132209584	/nfs/dbraw/zinc/20/95/84/132209584.db2.gz	URASIHOXABBDAR-SFHVURJKSA-N	-1	0	368.433	2.957	50	0		FFAARM
Cc1ccc(CN2CCN(c3ccc(Cl)c(C(=O)[O-])n3)CC2=O)cc1	ZINC000095503665	132212722	/nfs/dbraw/zinc/21/27/22/132212722.db2.gz	NUEAJRADOBJNPJ-UHFFFAOYSA-N	-1	0	359.813	2.590	50	0		FFAARM
CN1C(=O)C[C@H](C(=O)N[C@H](CC(=O)[O-])c2ccc(F)cc2)c2ccccc21	ZINC000299750016	136122005	/nfs/dbraw/zinc/12/20/05/136122005.db2.gz	MKHBBMVXKZFPLJ-JKSUJKDBSA-N	-1	0	370.380	2.608	50	0		FFAARM
NC(=O)c1cccnc1N1CCC(Cc2ccc(Cl)cc2)(C(=O)[O-])CC1	ZINC000071661465	136139738	/nfs/dbraw/zinc/13/97/38/136139738.db2.gz	UNVGECNFQDYGJA-UHFFFAOYSA-N	-1	0	373.840	2.748	50	0		FFAARM
Cc1cnc(C)c(N2CCC(C(=O)[O-])(n3ccc(C(C)(C)C)n3)CC2)n1	ZINC000072419314	136145834	/nfs/dbraw/zinc/14/58/34/136145834.db2.gz	GQWLONRTIAFSAH-UHFFFAOYSA-N	-1	0	357.458	2.668	50	0		FFAARM
O=C([O-])C1(n2ccc(-c3ccco3)n2)CCN(c2ccncc2F)CC1	ZINC000072480827	136149630	/nfs/dbraw/zinc/14/96/30/136149630.db2.gz	ZQHDCOATLGFYKE-UHFFFAOYSA-N	-1	0	356.357	2.758	50	0		FFAARM
O=C([O-])[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1ccc(Br)cn1	ZINC000249917765	509779838	/nfs/dbraw/zinc/77/98/38/509779838.db2.gz	TXNDPVMTFHCJFB-WQAKAFBOSA-N	-1	0	353.216	2.702	50	0		FFAARM
O=C([O-])c1cccc(Nc2nc(N3CCCC3)nc(N3CCCC3)n2)c1	ZINC000000689902	506228831	/nfs/dbraw/zinc/22/88/31/506228831.db2.gz	JYMBLVQYYLEMDD-UHFFFAOYSA-N	-1	0	354.414	2.514	50	0		FFAARM
Cc1[nH]c2ccccc2c1[C@H](C(=O)[O-])N1CCN(C(=O)c2ccco2)CC1	ZINC000032105932	506232082	/nfs/dbraw/zinc/23/20/82/506232082.db2.gz	NGHNOPXXPHQVTE-GOSISDBHSA-N	-1	0	367.405	2.653	50	0		FFAARM
CCc1ccc(N2C[C@H](C(=O)Nc3cccc(C(=O)[O-])c3)CC2=O)cc1	ZINC000001072454	506248172	/nfs/dbraw/zinc/24/81/72/506248172.db2.gz	HCLNTRIGSCOPFN-OAHLLOKOSA-N	-1	0	352.390	2.939	50	0		FFAARM
C[C@H]1CCc2c(sc(NC(=O)c3cccc(C(=O)[O-])c3)c2C(N)=O)C1	ZINC000001190432	506253966	/nfs/dbraw/zinc/25/39/66/506253966.db2.gz	YWNPSMVMVWEYHX-VIFPVBQESA-N	-1	0	358.419	2.922	50	0		FFAARM
O=C(CCCCn1c(=S)[n-]c2ccsc2c1=O)NC[C@@H]1CCCO1	ZINC000002925496	506301821	/nfs/dbraw/zinc/30/18/21/506301821.db2.gz	USKWRJSTEMCUTA-NSHDSACASA-N	-1	0	367.496	2.586	50	0		FFAARM
COc1cc2c(cc1OC)[C@@H]1[C@@H](C(=O)[O-])c3ccccc3C(=O)N1CC2	ZINC000032916828	506312749	/nfs/dbraw/zinc/31/27/49/506312749.db2.gz	MXBNJFLOBHEONN-ZWKOTPCHSA-N	-1	0	353.374	2.625	50	0		FFAARM
CCOc1ccc(S(=O)(=O)N(C)c2ccccc2F)cc1C(=O)[O-]	ZINC000065667979	506342865	/nfs/dbraw/zinc/34/28/65/506342865.db2.gz	XHFJBQBAEXNIQX-UHFFFAOYSA-N	-1	0	353.371	2.748	50	0		FFAARM
CCOC(=O)c1c(CC)[nH]nc1S(=O)(=O)[N-]c1ccc(CC)cc1	ZINC000033256063	506351378	/nfs/dbraw/zinc/35/13/78/506351378.db2.gz	MAXDMXIKGFXTBP-UHFFFAOYSA-N	-1	0	351.428	2.512	50	0		FFAARM
O=C(CCc1nnc(-c2cccc(F)c2)[n-]c1=O)NCc1ccccc1	ZINC000034768552	506370018	/nfs/dbraw/zinc/37/00/18/506370018.db2.gz	SOTVAEXCSROUOF-UHFFFAOYSA-N	-1	0	352.369	2.632	50	0		FFAARM
O=C(CCc1nnc(-c2cccc(F)c2)[n-]c1=O)NCCc1ccccc1	ZINC000034768559	506370800	/nfs/dbraw/zinc/37/08/00/506370800.db2.gz	XKNITDCNAWHDOR-UHFFFAOYSA-N	-1	0	366.396	2.675	50	0		FFAARM
CC(C)CNC(=O)CCc1nnc(-c2cccc(C(F)(F)F)c2)[n-]c1=O	ZINC000034767506	506371110	/nfs/dbraw/zinc/37/11/10/506371110.db2.gz	QRAUYUCSBRDZEX-UHFFFAOYSA-N	-1	0	368.359	2.968	50	0		FFAARM
Cc1[nH]c(C(=O)N2CCC(CC(=O)[O-])CC2)c(C)c1C(=O)OC(C)C	ZINC000034927242	506373752	/nfs/dbraw/zinc/37/37/52/506373752.db2.gz	IDAKFOPXMUZHIA-UHFFFAOYSA-N	-1	0	350.415	2.524	50	0		FFAARM
O=c1ccc(-c2ccc(Cl)c(S(=O)(=O)[N-]c3ccccc3)c2)n[nH]1	ZINC000035378088	506381949	/nfs/dbraw/zinc/38/19/49/506381949.db2.gz	GMSNEAWMERFVOF-UHFFFAOYSA-N	-1	0	361.810	2.891	50	0		FFAARM
Cc1cccc(-n2nnnc2SCc2nc(=O)c3sccc3[n-]2)c1	ZINC000006619231	506492467	/nfs/dbraw/zinc/49/24/67/506492467.db2.gz	HHXADYWROSNHAB-UHFFFAOYSA-N	-1	0	356.436	2.561	50	0		FFAARM
Cc1ccc(O[C@@H](C)C(=O)N(C)Cc2nc(=O)c3sccc3[n-]2)cc1	ZINC000010721125	506751376	/nfs/dbraw/zinc/75/13/76/506751376.db2.gz	LSXNDWIPNPVSBR-LBPRGKRZSA-N	-1	0	357.435	2.719	50	0		FFAARM
Cc1c(F)cccc1NS(=O)(=O)c1ccc2c(c1)NC(=O)[C@@H](C)O2	ZINC000012372502	506855519	/nfs/dbraw/zinc/85/55/19/506855519.db2.gz	CMHHMHQZDVRLAZ-SNVBAGLBSA-N	-1	0	350.371	2.654	50	0		FFAARM
Cc1ccc([C@@H]2NC(=O)N[C@](O)(C(F)(F)F)C2=C(O)c2ccccc2)o1	ZINC000012377551	506855721	/nfs/dbraw/zinc/85/57/21/506855721.db2.gz	BXZOMEVXBOXWEF-HEHGZKQESA-N	-1	0	368.311	2.692	50	0		FFAARM
Cc1ccc(C)c([C@@H](C)NC(=O)Cc2csc([N-]S(C)(=O)=O)n2)c1	ZINC000012541796	506874336	/nfs/dbraw/zinc/87/43/36/506874336.db2.gz	JFFLNHMECLABPS-GFCCVEGCSA-N	-1	0	367.496	2.551	50	0		FFAARM
CS(=O)(=O)[N-]c1ccccc1C(=O)NCCCn1ccc2ccccc21	ZINC000012605540	506884174	/nfs/dbraw/zinc/88/41/74/506884174.db2.gz	RAEASIBZVUAYSA-UHFFFAOYSA-N	-1	0	371.462	2.833	50	0		FFAARM
COc1cc(OC)cc([C@@H](Nc2ncccc2C(=O)[O-])c2nccn2C)c1	ZINC000012627346	506886076	/nfs/dbraw/zinc/88/60/76/506886076.db2.gz	DZGWOCGDOSIWCX-MRXNPFEDSA-N	-1	0	368.393	2.732	50	0		FFAARM
O=C([O-])[C@@H](Cc1c[nH]c2ccccc12)NC(=O)NCc1ccc(F)cc1	ZINC000013235491	506934124	/nfs/dbraw/zinc/93/41/24/506934124.db2.gz	KNYCJRTZJKCCNX-QGZVFWFLSA-N	-1	0	355.369	2.802	50	0		FFAARM
CC(C)n1ncc2cc(C(=O)N[C@H](CC(=O)[O-])c3ccccc3)cnc21	ZINC000013428047	506940694	/nfs/dbraw/zinc/94/06/94/506940694.db2.gz	ONCSLWRTSSLOEA-MRXNPFEDSA-N	-1	0	352.394	2.958	50	0		FFAARM
COc1ccc([C@H](CC(=O)[O-])NC(=O)[C@H]2COc3ccccc3C2)cc1	ZINC000013427431	506941770	/nfs/dbraw/zinc/94/17/70/506941770.db2.gz	VPVQFLCASGYOGY-WBVHZDCISA-N	-1	0	355.390	2.579	50	0		FFAARM
COc1ccc(/C=C/C(=O)[O-])cc1S(=O)(=O)N1c2ccccc2C[C@@H]1C	ZINC000013366973	506941963	/nfs/dbraw/zinc/94/19/63/506941963.db2.gz	BYEISBXPTKAUKC-FROQITRMSA-N	-1	0	373.430	2.933	50	0		FFAARM
COc1ccc2nc(S(=O)(=O)Cc3ncc(C)c(OC)c3C)[n-]c2c1	ZINC000013559434	506945286	/nfs/dbraw/zinc/94/52/86/506945286.db2.gz	IXEQEYRTSRFZEO-UHFFFAOYSA-N	-1	0	361.423	2.566	50	0	endogenous,world	FFAARM
COc1cccc(C[C@@H](C(=O)Nc2cc(C)ccc2C)c2nnn[n-]2)c1	ZINC000013943535	506957410	/nfs/dbraw/zinc/95/74/10/506957410.db2.gz	SKDOYQIXNPKZKZ-MRXNPFEDSA-N	-1	0	351.410	2.790	50	0		FFAARM
COc1ccc(/C=C/C(=O)[O-])cc1S(=O)(=O)Nc1c(F)cccc1F	ZINC000014119646	506967312	/nfs/dbraw/zinc/96/73/12/506967312.db2.gz	UBZVQRRJSDTVOC-SOFGYWHQSA-N	-1	0	369.345	2.872	50	0		FFAARM
COc1cc(-c2oc3cc([O-])cc(O)c3c(=O)c2OC)cc(OC)c1OC	ZINC000014436790	506990156	/nfs/dbraw/zinc/99/01/56/506990156.db2.gz	YSXLGTWJLNLXKQ-UHFFFAOYSA-N	-1	0	374.345	2.906	50	0		FFAARM
Cc1cccc(C)c1[N-]S(=O)(=O)c1ccc(-c2ccc(=O)[nH]n2)s1	ZINC000015726528	507056286	/nfs/dbraw/zinc/05/62/86/507056286.db2.gz	AOBIINRATAANAM-UHFFFAOYSA-N	-1	0	361.448	2.916	50	0		FFAARM
CCC(NNc1ccccc1)=C1C(=O)[N-]C(=O)N(c2ccccc2)C1=O	ZINC000016995983	507110845	/nfs/dbraw/zinc/11/08/45/507110845.db2.gz	WEEBEFKOVKCSKD-FOCLMDBBSA-N	-1	0	350.378	2.755	50	0		FFAARM
O=C1[N-]C(=O)N(Cc2ccccc2)C(=O)C1=C1C[C@@H](c2cccs2)NN1	ZINC000017028171	507111954	/nfs/dbraw/zinc/11/19/54/507111954.db2.gz	WEARVMAIYSDXDH-AHAXBBEGSA-N	-1	0	368.418	2.660	50	0		FFAARM
Cc1ccccc1[N-]S(=O)(=O)c1cc2c(cc1Cl)NC(=O)CO2	ZINC000021650768	507261557	/nfs/dbraw/zinc/26/15/57/507261557.db2.gz	WVGQBVRGULSVNO-UHFFFAOYSA-N	-1	0	352.799	2.780	50	0		FFAARM
CCc1ccc([C@H](O)COc2ccc(C[C@H]3SC(=O)[N-]C3=O)cc2)nc1	ZINC000021981317	507276582	/nfs/dbraw/zinc/27/65/82/507276582.db2.gz	RMTFRGFLVHAYCI-IAGOWNOFSA-N	-1	0	372.446	2.651	50	0	in-vitro	FFAARM
Cc1ccc(S(=O)(=O)N(C)c2ccc(O[C@@H](C)C(=O)[O-])cc2)cc1C	ZINC000022141507	507280713	/nfs/dbraw/zinc/28/07/13/507280713.db2.gz	FEZKJLVVIYKZOW-AWEZNQCLSA-N	-1	0	363.435	2.980	50	0		FFAARM
CC(=O)N1CCc2cc([N-]S(=O)(=O)c3c(F)cccc3F)ccc21	ZINC000024976528	507454772	/nfs/dbraw/zinc/45/47/72/507454772.db2.gz	SZQWTCXXXCZUQS-UHFFFAOYSA-N	-1	0	352.362	2.675	50	0		FFAARM
O=S(=O)([N-]c1ccc(-n2cncn2)nc1)c1cccc(Cl)c1Cl	ZINC000026542500	507596031	/nfs/dbraw/zinc/59/60/31/507596031.db2.gz	GUSAVVBJRXXZBU-UHFFFAOYSA-N	-1	0	370.221	2.770	50	0		FFAARM
CC1(C)[C@@H](C(=O)[O-])[C@@H]1C(=O)Nc1cccc(C(=O)Nc2nccs2)c1	ZINC000071288994	507700074	/nfs/dbraw/zinc/70/00/74/507700074.db2.gz	ARNXSRIUXBYBEV-VXGBXAGGSA-N	-1	0	359.407	2.691	50	0		FFAARM
COCCNS(=O)(=O)c1cc(C(=O)[O-])cc(-c2cccc(C)c2C)c1	ZINC000071754604	507712909	/nfs/dbraw/zinc/71/29/09/507712909.db2.gz	AXZQVHRPTPGHSV-UHFFFAOYSA-N	-1	0	363.435	2.593	50	0		FFAARM
CC(C)(C(=O)N1CCC(Oc2ccccc2)(C(=O)[O-])CC1)n1cccc1	ZINC000072408956	507784579	/nfs/dbraw/zinc/78/45/79/507784579.db2.gz	SIXZMSVPTODDTH-UHFFFAOYSA-N	-1	0	356.422	2.748	50	0		FFAARM
O=C([O-])c1ccc(C[C@@H]2CCN(S(=O)(=O)Cc3ccccc3)C2)cc1	ZINC000072408597	507784634	/nfs/dbraw/zinc/78/46/34/507784634.db2.gz	MSWOEUFHGMDUSV-KRWDZBQOSA-N	-1	0	359.447	2.779	50	0		FFAARM
Cc1noc(C)c1NC(=O)N1CCC(Oc2ccccc2)(C(=O)[O-])CC1	ZINC000072418276	507786494	/nfs/dbraw/zinc/78/64/94/507786494.db2.gz	SWMDXTJDIUPUSU-UHFFFAOYSA-N	-1	0	359.382	2.822	50	0		FFAARM
Cc1nccn1C1(C(=O)[O-])CCN(C(=O)c2coc3ccccc23)CC1	ZINC000072475567	507796288	/nfs/dbraw/zinc/79/62/88/507796288.db2.gz	KCYKWQPVYHJLKC-UHFFFAOYSA-N	-1	0	353.378	2.654	50	0		FFAARM
CSc1cccc(CC(=O)N2CCCn3nc(CCC(=O)[O-])cc3C2)c1	ZINC000072479119	507796977	/nfs/dbraw/zinc/79/69/77/507796977.db2.gz	KPAPGUNMTUXNTJ-UHFFFAOYSA-N	-1	0	373.478	2.597	50	0		FFAARM
CCN(CC)C(=O)Cc1ccc([N-]S(=O)(=O)c2cccs2)cc1	ZINC000030653706	507811700	/nfs/dbraw/zinc/81/17/00/507811700.db2.gz	UMIONTVAXCVKDP-UHFFFAOYSA-N	-1	0	352.481	2.960	50	0		FFAARM
O=C1OCCN1c1cccc([N-]S(=O)(=O)c2cc(F)cc(F)c2)c1	ZINC000031720108	507821321	/nfs/dbraw/zinc/82/13/21/507821321.db2.gz	YRZQNSPDKBUYGL-UHFFFAOYSA-N	-1	0	354.334	2.722	50	0		FFAARM
COc1cc([C@H]2SC(C)(C)[C@@H](C(=O)[O-])N2C(C)=O)cc(OC)c1OC	ZINC000075251824	508092250	/nfs/dbraw/zinc/09/22/50/508092250.db2.gz	NPCUMDXXMDXQSI-HUUCEWRRSA-N	-1	0	369.439	2.538	50	0		FFAARM
Cc1ncsc1CCC(=O)N[C@H](Cc1cc(F)c(F)c(F)c1)C(=O)[O-]	ZINC000095389365	508183549	/nfs/dbraw/zinc/18/35/49/508183549.db2.gz	JJXSDYKDSYKMQT-GFCCVEGCSA-N	-1	0	372.368	2.614	50	0		FFAARM
COc1ccc(CNC(=O)[C@H](C)c2ccc3c(c2)OCCO3)cc1C(=O)[O-]	ZINC000095424123	508185247	/nfs/dbraw/zinc/18/52/47/508185247.db2.gz	LLHXVZJAHOUIGQ-GFCCVEGCSA-N	-1	0	371.389	2.585	50	0		FFAARM
COc1cc(OC)nc([N-]S(=O)(=O)c2c(C)sc3ccccc32)n1	ZINC000095466263	508187869	/nfs/dbraw/zinc/18/78/69/508187869.db2.gz	CNZKKKZZVMAZDH-UHFFFAOYSA-N	-1	0	365.436	2.818	50	0		FFAARM
COCCn1ccc2c1cccc2C(=O)N=c1[n-]c(C(=O)OC)c(C)s1	ZINC000095472837	508188612	/nfs/dbraw/zinc/18/86/12/508188612.db2.gz	JQLBXMOCQSJJAQ-UHFFFAOYSA-N	-1	0	373.434	3.092	50	0		FFAARM
CCCc1nc(C(=O)N[C@H](Cc2cc(F)c(F)c(F)c2)C(=O)[O-])cs1	ZINC000095509244	508192651	/nfs/dbraw/zinc/19/26/51/508192651.db2.gz	QLUZVRCVWDRWIU-LLVKDONJSA-N	-1	0	372.368	2.939	50	0		FFAARM
NC(=O)Nc1cccc(C(=O)N(CCCC(=O)[O-])Cc2ccccc2)c1	ZINC000095992001	508200437	/nfs/dbraw/zinc/20/04/37/508200437.db2.gz	UPNATRDXFQHTGD-UHFFFAOYSA-N	-1	0	355.394	2.684	50	0		FFAARM
C[C@H](CN(C(=O)c1cccc(OCc2cccnc2)c1)C1CC1)C(=O)[O-]	ZINC000095991926	508200486	/nfs/dbraw/zinc/20/04/86/508200486.db2.gz	LDMNUJZMEPSPLH-CQSZACIVSA-N	-1	0	354.406	2.986	50	0		FFAARM
Cc1ccc([N-]S(=O)(=O)c2n[nH]cc2C(=O)Nc2ccc(F)cc2)cc1	ZINC000096361085	508213433	/nfs/dbraw/zinc/21/34/33/508213433.db2.gz	ACXQYSOBDDJPOO-UHFFFAOYSA-N	-1	0	374.397	2.910	50	0		FFAARM
O=C([O-])COc1ccccc1/C=C1/N=C(c2ccc(F)cc2F)OC1=O	ZINC000096892185	508215805	/nfs/dbraw/zinc/21/58/05/508215805.db2.gz	GHJTXARQAMTFHI-VGOFMYFVSA-N	-1	0	359.284	2.773	50	0		FFAARM
CC[C@@H](C)C(=O)N1CCc2nc3cc(-c4ccccc4)[n-]n3c(=O)c2C1	ZINC000097161241	508220736	/nfs/dbraw/zinc/22/07/36/508220736.db2.gz	HNYLDHBIVJWPFV-CYBMUJFWSA-N	-1	0	350.422	2.620	50	0		FFAARM
CC[C@H]1C(=O)N(C)CCN1Cc1ccc(OCc2ccc(C(=O)[O-])o2)cc1	ZINC000097745122	508229833	/nfs/dbraw/zinc/22/98/33/508229833.db2.gz	QEJRHDUPHCQILK-KRWDZBQOSA-N	-1	0	372.421	2.609	50	0		FFAARM
COc1ccc(-n2c(=O)c3[n-][nH]n(Cc4cccc(Cl)c4)c=3c2=O)cc1	ZINC000101167296	508240841	/nfs/dbraw/zinc/24/08/41/508240841.db2.gz	ZISPBMLHLLCEMR-JKSUJKDBSA-N	-1	0	370.796	2.842	50	0		FFAARM
CCc1ccc(-n2c(=O)c3[n-][nH]n(-c4cccc(OC)c4)c=3c2=O)cc1	ZINC000101260305	508241176	/nfs/dbraw/zinc/24/11/76/508241176.db2.gz	WPMHZJKBDGKCQS-IRXDYDNUSA-N	-1	0	350.378	2.755	50	0		FFAARM
COc1cccc(Cn2[nH][n-]c3c(=O)n(-c4ccccc4Cl)c(=O)c2=3)c1	ZINC000101418591	508241441	/nfs/dbraw/zinc/24/14/41/508241441.db2.gz	XASPKVNCZUBUGH-CVEARBPZSA-N	-1	0	370.796	2.842	50	0		FFAARM
Cc1ccc([C@@H]2CC(c3c(=O)[nH]c(=O)n(C4CCCCC4)c3[O-])=NN2)s1	ZINC000101762199	508256369	/nfs/dbraw/zinc/25/63/69/508256369.db2.gz	JWSSMLKCBFDHRW-LBPRGKRZSA-N	-1	0	374.466	2.556	50	0		FFAARM
CCc1[n-]n2c(nc(C)c(CC(=O)OC)c2=O)c1-c1ccc(OC)cc1	ZINC000102727943	508283290	/nfs/dbraw/zinc/28/32/90/508283290.db2.gz	LNPCAMKKLWGBMX-UHFFFAOYSA-N	-1	0	355.394	2.697	50	0		FFAARM
CC(C)c1nc(C(=O)N2CCCC[C@@H]2C(=O)[O-])nn1-c1ccccc1F	ZINC000128630724	508621127	/nfs/dbraw/zinc/62/11/27/508621127.db2.gz	NSBJJUAUUJUWJI-CQSZACIVSA-N	-1	0	360.389	2.609	50	0		FFAARM
Cc1ccc(N(C)S(=O)(=O)c2cc(C(=O)[O-])ccc2F)cc1N(C)C	ZINC000162108941	509172556	/nfs/dbraw/zinc/17/25/56/509172556.db2.gz	PDEHYNSPMHAMGW-UHFFFAOYSA-N	-1	0	366.414	2.723	50	0		FFAARM
CCc1nn(C)cc1[N-]S(=O)(=O)c1cc(Br)sc1C	ZINC000222860158	509324320	/nfs/dbraw/zinc/32/43/20/509324320.db2.gz	LHMUKUXPLLLKIO-UHFFFAOYSA-N	-1	0	364.290	2.916	50	0		FFAARM
C[C@@H]1CC[C@@H](CCC(=O)[N-]S(=O)(=O)c2ccc(F)c3ncccc23)O1	ZINC000170645640	509694469	/nfs/dbraw/zinc/69/44/69/509694469.db2.gz	IUXIAFDJLXYMDI-NEPJUHHUSA-N	-1	0	366.414	2.527	50	0		FFAARM
Cc1noc(C)c1COc1cccc(C(=O)N2CC[C@@](C)(C(=O)[O-])C2)c1	ZINC000237641354	509699582	/nfs/dbraw/zinc/69/95/82/509699582.db2.gz	RBOLUZGKZNVECB-LJQANCHMSA-N	-1	0	358.394	2.807	50	0		FFAARM
CCO[C@@H]1C[C@](NC(=O)c2cnc(-c3ccco3)s2)(C(=O)[O-])C1(C)C	ZINC000193040966	509749819	/nfs/dbraw/zinc/74/98/19/509749819.db2.gz	DMZSXDUIBIBRBJ-PXAZEXFGSA-N	-1	0	364.423	2.791	50	0		FFAARM
CCO[C@H]1C[C@@](NC(=O)c2cnc(-c3ccco3)s2)(C(=O)[O-])C1(C)C	ZINC000193041005	509750713	/nfs/dbraw/zinc/75/07/13/509750713.db2.gz	DMZSXDUIBIBRBJ-YVEFUNNKSA-N	-1	0	364.423	2.791	50	0		FFAARM
O=C([O-])C1(CC(=O)Nc2ccc3c(c2)CCC(=O)N3)Cc2ccccc2C1	ZINC000238049136	509809378	/nfs/dbraw/zinc/80/93/78/509809378.db2.gz	JRYDJWPAGIPSHE-UHFFFAOYSA-N	-1	0	364.401	2.770	50	0		FFAARM
O=C([O-])c1ccc(CNC(=O)c2ccc(OC3CCOCC3)cc2)cc1	ZINC000262394938	510265118	/nfs/dbraw/zinc/26/51/18/510265118.db2.gz	GOABLXSJFKFPIF-UHFFFAOYSA-N	-1	0	355.390	2.873	50	0		FFAARM
O=C([O-])[C@@H](CNC(=O)c1ccc(Cl)c2cccnc12)C1CCOCC1	ZINC000262987189	510509329	/nfs/dbraw/zinc/50/93/29/510509329.db2.gz	PXIZEMQVLGQBMS-AWEZNQCLSA-N	-1	0	362.813	2.745	50	0		FFAARM
Cc1ccc(Cl)c(O[C@@H](C)C(=O)N(CCC(=O)[O-])C2CCOCC2)c1	ZINC000408513303	513083537	/nfs/dbraw/zinc/08/35/37/513083537.db2.gz	NIXMZINVZDXIMI-ZDUSSCGKSA-N	-1	0	369.845	2.898	50	0		FFAARM
Cc1oc(C(=O)N(CC(=O)[O-])C2CCOCC2)cc1COc1ccccc1	ZINC000408513336	513083700	/nfs/dbraw/zinc/08/37/00/513083700.db2.gz	UBIDDPMTWNRUBO-UHFFFAOYSA-N	-1	0	373.405	2.873	50	0		FFAARM
O=C([O-])Cn1nccc1[C@H]1CCCN(C(=O)c2ccc3ccccc3n2)C1	ZINC000426580987	513985259	/nfs/dbraw/zinc/98/52/59/513985259.db2.gz	QESBDMWHSGXCDX-HNNXBMFYSA-N	-1	0	364.405	2.536	50	0		FFAARM
COCC1(CNC(=O)c2ccc(-c3ccnc(C(=O)[O-])c3)cc2)CCC1	ZINC000534646022	517980469	/nfs/dbraw/zinc/98/04/69/517980469.db2.gz	HYIWDRHECAEGBC-UHFFFAOYSA-N	-1	0	354.406	2.993	50	0		FFAARM
Cc1nn(-c2ccccc2)c(C)c1/C=C\C(=O)N1CC[C@](C)(C(=O)[O-])C1	ZINC000606442001	521068194	/nfs/dbraw/zinc/06/81/94/521068194.db2.gz	JJKDXGUXRIGTSF-QJRAZLAKSA-N	-1	0	353.422	2.826	50	0		FFAARM
O=C([O-])COc1cccc(NC(=O)/C=C\c2ccc(-n3ccnc3)cc2)c1	ZINC000606442513	521068249	/nfs/dbraw/zinc/06/82/49/521068249.db2.gz	NJBHYPPJOKWDSJ-TWGQIWQCSA-N	-1	0	363.373	2.988	50	0		FFAARM
CCOc1cc(/C=C\C(=O)N2CCC[C@H]2C(=O)[O-])cc(Cl)c1OC	ZINC000606441005	521068344	/nfs/dbraw/zinc/06/83/44/521068344.db2.gz	CAVOBAPHBWXXRC-FWWRYZNZSA-N	-1	0	353.802	2.836	50	0		FFAARM
Cc1cccc(N2CCN(c3ccc(NC(=O)/C=C\C(=O)[O-])cc3)CC2)c1	ZINC000000627220	524561332	/nfs/dbraw/zinc/56/13/32/524561332.db2.gz	NZZJNGKYFGFRMH-KTKRTIGZSA-N	-1	0	365.433	2.901	50	0		FFAARM
Cc1ccccc1[C@@H](CC(=O)[O-])NC(=O)[C@@H]1CC(=O)Nc2ccccc21	ZINC000237596336	525363421	/nfs/dbraw/zinc/36/34/21/525363421.db2.gz	UACSJFQMNOEEFZ-NVXWUHKLSA-N	-1	0	352.390	2.753	50	0		FFAARM
O=C([O-])[C@@H]1Cc2ccccc2CN1C(=O)CCc1nc(C2CCCC2)no1	ZINC000271905863	526292809	/nfs/dbraw/zinc/29/28/09/526292809.db2.gz	NEPDBDAMDZOTOE-INIZCTEOSA-N	-1	0	369.421	2.698	50	0		FFAARM
O=C([O-])c1cccc(CNC(=O)[C@H]2C[C@@H]2c2ccc3c(c2)OCCO3)c1	ZINC000299745945	526389026	/nfs/dbraw/zinc/38/90/26/526389026.db2.gz	UFKDTKSPSRUQJR-CVEARBPZSA-N	-1	0	353.374	2.576	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)[C@@H]1CC(=O)Nc2cc(F)ccc21)c1ccc(F)cc1	ZINC000238142092	527625742	/nfs/dbraw/zinc/62/57/42/527625742.db2.gz	VYDRSUBYBXGVTK-HUUCEWRRSA-N	-1	0	374.343	2.723	50	0		FFAARM
O=C([O-])C[C@@H]1CN(C(=O)c2ccccc2OCc2ccc(F)cc2)CCO1	ZINC000269034189	527631386	/nfs/dbraw/zinc/63/13/86/527631386.db2.gz	NRTNRTNJNLCWRF-MRXNPFEDSA-N	-1	0	373.380	2.720	50	0		FFAARM
Cn1c(=O)c2ccc(C(=O)NCCc3ccc(Cl)cc3)cc2[n-]c1=S	ZINC000102167477	570828826	/nfs/dbraw/zinc/82/88/26/570828826.db2.gz	UDPDBLAAKMKEFW-UHFFFAOYSA-N	-1	0	373.865	2.848	50	0		FFAARM
CCCCOC(=O)c1ccc(NC(=O)c2c[n-]n3c2nc(C)cc3=O)cc1	ZINC000102522882	570833673	/nfs/dbraw/zinc/83/36/73/570833673.db2.gz	AQYSHIVYLRQUNF-UHFFFAOYSA-N	-1	0	368.393	2.540	50	0		FFAARM
O=C(C=C1CCCCC1)N[C@@H]1C[C@H](C(=O)[O-])C[C@@H]1n1cc(C2CC2)nn1	ZINC000685942220	571102946	/nfs/dbraw/zinc/10/29/46/571102946.db2.gz	HNUILGZZVXADKE-UXLLHSPISA-N	-1	0	358.442	2.567	50	0		FFAARM
Cc1ccc(-n2nc(C(=O)N[C@H](C(=O)[O-])C(C)C)c3c2CCC3)c(C)c1	ZINC000236781659	600058233	/nfs/dbraw/zinc/05/82/33/600058233.db2.gz	VBDJIIOKOLYPJG-KRWDZBQOSA-N	-1	0	355.438	2.817	50	0		FFAARM
Cc1[nH]c(C(=O)N[C@@H](Cn2cccn2)c2ccccc2)c(C)c1C(=O)[O-]	ZINC000738153864	600788610	/nfs/dbraw/zinc/78/86/10/600788610.db2.gz	FMSDGOBQLSXZFY-HNNXBMFYSA-N	-1	0	352.394	2.698	50	0		FFAARM
CC(C)Oc1nn(C)c2ccc(NC(=O)[C@H]3CC=CC[C@H]3C(=O)[O-])cc12	ZINC000675028338	971520937	/nfs/dbraw/zinc/52/09/37/971520937.db2.gz	PQMPRBTYZUIJHX-UONOGXRCSA-N	-1	0	357.410	2.966	50	0		FFAARM
C[C@H]1Oc2c(cccc2C(=O)N2CC[C@H](C(=O)[O-])c3ccccc32)NC1=O	ZINC000669435604	984589547	/nfs/dbraw/zinc/58/95/47/984589547.db2.gz	LHXICFSQTQVXBD-YPMHNXCESA-N	-1	0	366.373	2.625	50	0		FFAARM
CC[C@](CNC(=O)c1cccc2c1COCC2)(C(=O)[O-])c1ccccc1	ZINC000952886720	1011014635	/nfs/dbraw/zinc/01/46/35/1011014635.db2.gz	BSKANYCRYHVYPN-OAQYLSRUSA-N	-1	0	353.418	2.922	50	0		FFAARM
C[C@@H](NC(=O)Nc1cc([C@H]2CCCO2)nn1C)[C@@H]1C[C@H](C(=O)[O-])C1(C)C	ZINC000653544346	1024938713	/nfs/dbraw/zinc/93/87/13/1024938713.db2.gz	URRLZDQHKFVBDN-GFQSEFKGSA-N	-1	0	364.446	2.529	50	0		FFAARM
CC1(C)C[C@]1(C(=O)[O-])C(=O)Nc1cccc(C(=O)Nc2ccccn2)c1	ZINC000663111439	1026594602	/nfs/dbraw/zinc/59/46/02/1026594602.db2.gz	OJQZYUXPNBUFHZ-LJQANCHMSA-N	-1	0	353.378	2.773	50	0		FFAARM
CC1(C)C[C@@]1(C(=O)[O-])C(=O)Nc1cccc(C(=O)Nc2ccccn2)c1	ZINC000663111437	1026595146	/nfs/dbraw/zinc/59/51/46/1026595146.db2.gz	OJQZYUXPNBUFHZ-IBGZPJMESA-N	-1	0	353.378	2.773	50	0		FFAARM
C[C@@H]1Oc2ccccc2O[C@H]1C(=O)N1CC[C@H](C(=O)[O-])c2ccccc21	ZINC000669436708	1027937124	/nfs/dbraw/zinc/93/71/24/1027937124.db2.gz	COBKYMWYZQRLAE-XAYKYTGQSA-N	-1	0	353.374	2.820	50	0		FFAARM
Cn1ccc(C(=O)N2C[C@@H]3C[C@@H](c4ccccc4)CC[C@]3(C(=O)[O-])C2)n1	ZINC000299755880	203751126	/nfs/dbraw/zinc/75/11/26/203751126.db2.gz	ADGISLRWFDSDSP-FTRWYGJKSA-N	-1	0	353.422	2.531	50	0		FFAARM
COc1ccc([C@@H](CC(=O)[O-])NC(=O)c2ccc(OC)c(OC)c2)cc1	ZINC000001470744	204009727	/nfs/dbraw/zinc/00/97/27/204009727.db2.gz	GTAHVMZWPGIQBI-OAHLLOKOSA-N	-1	0	359.378	2.658	50	0	biogenic	FFAARM
O=C([O-])COc1ccc2c(c1)occ(-c1ccc3c(c1)OCCO3)c2=O	ZINC000002097398	204025975	/nfs/dbraw/zinc/02/59/75/204025975.db2.gz	RHHDWBZMYOIWRJ-UHFFFAOYSA-N	-1	0	354.314	2.695	50	0	biogenic	FFAARM
CSCC[C@@H](NC(=O)c1ccccc1NC(=O)C(C)(C)C)C(=O)[O-]	ZINC000003164167	204081230	/nfs/dbraw/zinc/08/12/30/204081230.db2.gz	XSHMIRINUGXBOW-CYBMUJFWSA-N	-1	0	352.456	2.607	50	0		FFAARM
N=C1c2ccccc2CN1c1ccc(S(=O)(=O)[N-]c2ncccn2)cc1	ZINC000003198509	204081979	/nfs/dbraw/zinc/08/19/79/204081979.db2.gz	CJYIMMNTYGDQTA-UHFFFAOYSA-N	-1	0	365.418	2.623	50	0		FFAARM
O=C([O-])COc1c(I)cc(Cl)c2cccnc21	ZINC000003278004	204087151	/nfs/dbraw/zinc/08/71/51/204087151.db2.gz	XLKWXKFEMAQBTO-UHFFFAOYSA-N	-1	0	363.538	2.956	50	0		FFAARM
Cc1n[nH]c(C)c1S(=O)(=O)[N-]c1cnn(Cc2cccc(Cl)c2)c1	ZINC000002805049	204059988	/nfs/dbraw/zinc/05/99/88/204059988.db2.gz	OAHUAGZSHCGLMP-UHFFFAOYSA-N	-1	0	365.846	2.726	50	0		FFAARM
O=C([O-])[C@H]1CC=CC[C@H]1C(=O)Nc1ccc(I)cc1	ZINC000004610422	204150344	/nfs/dbraw/zinc/15/03/44/204150344.db2.gz	CNBCFMDYNFYBIT-NEPJUHHUSA-N	-1	0	371.174	2.897	50	0		FFAARM
COCCNC(=O)c1ccccc1[N-]S(=O)(=O)c1ccc(Cl)cc1	ZINC000004706397	204156188	/nfs/dbraw/zinc/15/61/88/204156188.db2.gz	IOLLGVCVOHSYLZ-UHFFFAOYSA-N	-1	0	368.842	2.517	50	0		FFAARM
CC(=O)Oc1ccc(Cl)cc1N1C(=O)c2ccc(C(=O)[O-])cc2C1=O	ZINC000004822884	204166657	/nfs/dbraw/zinc/16/66/57/204166657.db2.gz	SKIBITBCGOVLMI-UHFFFAOYSA-N	-1	0	359.721	2.764	50	0		FFAARM
O=C([O-])[C@@H]1CC(=O)N(c2ccc(Br)cc2Br)C1	ZINC000004237861	204128764	/nfs/dbraw/zinc/12/87/64/204128764.db2.gz	ZWBOTACRPPHVCJ-ZCFIWIBFSA-N	-1	0	363.005	2.649	50	0		FFAARM
O=C([O-])COCC(=O)Nc1ccc(Oc2cccc(C(F)(F)F)c2)nc1	ZINC000004334093	204134574	/nfs/dbraw/zinc/13/45/74/204134574.db2.gz	VENDFLOMFLOWPG-UHFFFAOYSA-N	-1	0	370.283	2.932	50	0		FFAARM
O=C([O-])CSCC(=O)Nc1n[nH]c(SCc2ccc(Cl)cc2)n1	ZINC000004334816	204134748	/nfs/dbraw/zinc/13/47/48/204134748.db2.gz	RLSGHWOMAAKAIR-UHFFFAOYSA-N	-1	0	372.859	2.507	50	0		FFAARM
CC(C)(C)OC(=O)N[C@H](CCCNC(=O)OCc1ccccc1)C(=O)[O-]	ZINC000004534254	204144829	/nfs/dbraw/zinc/14/48/29/204144829.db2.gz	QYYCZJUFHDLLOJ-CQSZACIVSA-N	-1	0	366.414	2.671	50	0		FFAARM
COc1cc2c(cc1OC)[C@H](C(=O)[O-])[C@H](c1ccccc1OC)N(C)C2=O	ZINC000004563445	204146812	/nfs/dbraw/zinc/14/68/12/204146812.db2.gz	RTULEOKBRLRJCC-ROUUACIJSA-N	-1	0	371.389	2.708	50	0		FFAARM
COc1ccc(-n2c(Cn3ncc4ccccc4c3=O)n[n-]c2=S)cc1	ZINC000005447915	204209911	/nfs/dbraw/zinc/20/99/11/204209911.db2.gz	CMKHWWKMFIZNGP-UHFFFAOYSA-N	-1	0	365.418	2.697	50	0		FFAARM
COc1cccc(C[C@@H](C(=O)Nc2cc(C)cc(C)c2)c2nnn[n-]2)c1	ZINC000005488755	204211346	/nfs/dbraw/zinc/21/13/46/204211346.db2.gz	VYGQTSCISDVOPV-QGZVFWFLSA-N	-1	0	351.410	2.790	50	0		FFAARM
O=C([O-])c1ccc(NC(=O)/C(=C\c2ccco2)NC(=O)c2ccco2)cc1	ZINC000004976731	204182486	/nfs/dbraw/zinc/18/24/86/204182486.db2.gz	CGRBBPZQGXIYGS-RVDMUPIBSA-N	-1	0	366.329	2.980	50	0		FFAARM
O=C([O-])c1cnn2c1N[C@H](c1ccc3c(c1)OCO3)C[C@H]2C(F)(F)F	ZINC000005027166	204185850	/nfs/dbraw/zinc/18/58/50/204185850.db2.gz	BLNNAPTWPAAZLE-CABZTGNLSA-N	-1	0	355.272	2.970	50	0		FFAARM
O=C([O-])c1ccc2c(c1)nc1n(c2=O)CC/C1=C\c1ccc2c(c1)OCO2	ZINC000006566297	204253332	/nfs/dbraw/zinc/25/33/32/204253332.db2.gz	ARVRUKSFHSBNLP-KPKJPENVSA-N	-1	0	362.341	2.768	50	0		FFAARM
O=C([O-])[C@H]1CCCN(C(=O)c2cnn(-c3ccccc3)c2-n2cccc2)C1	ZINC000006751421	204265770	/nfs/dbraw/zinc/26/57/70/204265770.db2.gz	DDEIXYOKEYRRAB-HNNXBMFYSA-N	-1	0	364.405	2.600	50	0		FFAARM
CC[C@@]1(C)NC(=O)N([N-]C(=O)c2ccc(-c3ccc(C(C)=O)cc3)o2)C1=O	ZINC000008342820	204327571	/nfs/dbraw/zinc/32/75/71/204327571.db2.gz	BSJXETHMCFQSHD-LJQANCHMSA-N	-1	0	369.377	2.515	50	0		FFAARM
CCc1ccc(NC(=O)COC(=O)c2cc(=O)c3ccccc3[n-]2)cc1	ZINC000009218803	204358404	/nfs/dbraw/zinc/35/84/04/204358404.db2.gz	XSYYPDRRCJBQOY-UHFFFAOYSA-N	-1	0	350.374	2.886	50	0		FFAARM
O=C(CSc1nnc([N-]C(=O)c2csnn2)s1)c1ccccc1	ZINC000009250915	204359077	/nfs/dbraw/zinc/35/90/77/204359077.db2.gz	VSJDJOZDYWWWCP-UHFFFAOYSA-N	-1	0	363.449	2.617	50	0		FFAARM
Cc1ccccc1C(=O)Nc1cc(=O)nc2[n-]c(Cc3ccccc3)nn21	ZINC000009332628	204363608	/nfs/dbraw/zinc/36/36/08/204363608.db2.gz	HWOQIQAEAJFGFE-UHFFFAOYSA-N	-1	0	359.389	2.569	50	0		FFAARM
CS(=O)(=O)[N-]c1ccccc1C(=O)OCc1cccc2cccnc21	ZINC000011290382	204407505	/nfs/dbraw/zinc/40/75/05/204407505.db2.gz	CNOROHVZNCNKRI-UHFFFAOYSA-N	-1	0	356.403	2.963	50	0		FFAARM
Cc1cc(=O)[nH]c2c(C)cc(S(=O)(=O)Nc3cccc(C(=O)[O-])c3)cc12	ZINC000010274252	204392718	/nfs/dbraw/zinc/39/27/18/204392718.db2.gz	JNSQIZAPSGPUJF-UHFFFAOYSA-N	-1	0	372.402	2.644	50	0		FFAARM
CCn1c2nc(-c3ccc(OC)cc3)cc(C(=O)[O-])c2c(=O)[nH]c1=S	ZINC000036617278	205017109	/nfs/dbraw/zinc/01/71/09/205017109.db2.gz	VRQAFGRYHDTIQI-UHFFFAOYSA-N	-1	0	357.391	2.848	50	0		FFAARM
CCn1c2nc(-c3cccc(OC)c3)cc(C(=O)[O-])c2c(=O)[nH]c1=S	ZINC000036617264	205017258	/nfs/dbraw/zinc/01/72/58/205017258.db2.gz	DUSPJOVAPXUKGW-UHFFFAOYSA-N	-1	0	357.391	2.848	50	0		FFAARM
Cc1cc(Cl)c(Cl)cc1S(=O)(=O)N1CCC(C(=O)[O-])CC1	ZINC000041095894	205089000	/nfs/dbraw/zinc/08/90/00/205089000.db2.gz	GCCNLLOVAGNUFU-UHFFFAOYSA-N	-1	0	352.239	2.787	50	0		FFAARM
COCC(=O)Nc1ccc(NC(=O)C[C@](C)(C(=O)[O-])c2ccccc2)cc1	ZINC000044830714	205112084	/nfs/dbraw/zinc/11/20/84/205112084.db2.gz	AGYURIGGSXDADF-FQEVSTJZSA-N	-1	0	370.405	2.643	50	0		FFAARM
O=C([O-])CCC/C=C\C[C@@H]1[C@@H](/C=C/[C@@H](O)Cc2ccccc2)[C@H](O)C[C@@H]1O	ZINC000043772276	205104920	/nfs/dbraw/zinc/10/49/20/205104920.db2.gz	AVUYLHQSIMTBCQ-SDMFVQJASA-N	-1	0	374.477	2.705	50	0	in-vitro	FFAARM
CN(CCC(=O)[O-])C(=O)[C@H](c1cccc(Br)c1)N1CCCC1	ZINC000299750613	205133297	/nfs/dbraw/zinc/13/32/97/205133297.db2.gz	OBUGRWSHDXYJNH-HNNXBMFYSA-N	-1	0	369.259	2.519	50	0		FFAARM
O=S(=O)([N-]c1ccccc1-n1cnnn1)c1cccc(Cl)c1Cl	ZINC000047328475	205145505	/nfs/dbraw/zinc/14/55/05/205145505.db2.gz	IDJWUTNGHAQZHT-UHFFFAOYSA-N	-1	0	370.221	2.770	50	0		FFAARM
Cc1ccsc1CNc1ccc(C(=O)N2CCOC[C@@H]2CC(=O)[O-])cc1	ZINC000055088966	205205993	/nfs/dbraw/zinc/20/59/93/205205993.db2.gz	OMOXUSMWAJNHGQ-INIZCTEOSA-N	-1	0	374.462	2.984	50	0		FFAARM
COc1ccc(C)cc1[C@@H](C(=O)[O-])N(C)Cc1nc(-c2ccccn2)no1	ZINC000055119521	205208120	/nfs/dbraw/zinc/20/81/20/205208120.db2.gz	DQOPGOYUECCPSE-KRWDZBQOSA-N	-1	0	368.393	2.706	50	0		FFAARM
O=C(CC1(C(=O)[O-])CCCCC1)Nc1cccc(C(=O)N2CCOCC2)c1	ZINC000055149611	205208441	/nfs/dbraw/zinc/20/84/41/205208441.db2.gz	LGVKSIIHZQLPEU-UHFFFAOYSA-N	-1	0	374.437	2.523	50	0		FFAARM
COc1cc(NC(=O)CCc2cc(=O)[n-]o2)ccc1NC(=O)CC(C)C	ZINC000055327814	205214105	/nfs/dbraw/zinc/21/41/05/205214105.db2.gz	ZFYPGFKXAQEDAI-UHFFFAOYSA-N	-1	0	361.398	2.945	50	0		FFAARM
O=C([O-])c1ccc2c(c1)n(Cc1ncccn1)c(=O)n2CCc1ccccc1	ZINC000055369462	205216625	/nfs/dbraw/zinc/21/66/25/205216625.db2.gz	OZIAXYDGKSJDOL-UHFFFAOYSA-N	-1	0	374.400	2.582	50	0		FFAARM
C[C@H](c1ccccc1)N(CCC(=O)[O-])C(=O)CCC(=O)NC1CCCC1	ZINC000055404143	205217608	/nfs/dbraw/zinc/21/76/08/205217608.db2.gz	OKLWFZAWZWVBED-OAHLLOKOSA-N	-1	0	360.454	2.890	50	0		FFAARM
CC(=O)NCCc1ccc(S(=O)(=O)[N-]c2cc(F)ccc2C)s1	ZINC000058159966	205253073	/nfs/dbraw/zinc/25/30/73/205253073.db2.gz	WVCQHVNUMXEVDJ-UHFFFAOYSA-N	-1	0	356.444	2.675	50	0		FFAARM
O=C(Cc1ccc(S(=O)(=O)[N-]c2ccc(F)cc2)s1)N1CCCC1	ZINC000064919592	205308518	/nfs/dbraw/zinc/30/85/18/205308518.db2.gz	GLZVHWNTSZFMKP-UHFFFAOYSA-N	-1	0	368.455	2.853	50	0		FFAARM
CCn1c2ccc(S(=O)(=O)[N-]c3ccccc3OC)cc2sc1=O	ZINC000064947111	205309667	/nfs/dbraw/zinc/30/96/67/205309667.db2.gz	ZSBBFJUDIHRMGH-UHFFFAOYSA-N	-1	0	364.448	2.892	50	0		FFAARM
CCOC(=O)c1cc(S(=O)(=O)[N-]c2cc(C)cc(C)c2)c(C)n1C	ZINC000064923319	205309730	/nfs/dbraw/zinc/30/97/30/205309730.db2.gz	KEOJAAJGLRFCKH-UHFFFAOYSA-N	-1	0	350.440	2.928	50	0		FFAARM
COc1ccccc1[N-]S(=O)(=O)c1ccc(-c2nnc(C)o2)s1	ZINC000064920111	205310206	/nfs/dbraw/zinc/31/02/06/205310206.db2.gz	VOCWAQMXQQEBTR-UHFFFAOYSA-N	-1	0	351.409	2.916	50	0		FFAARM
O=C(Nc1ccc(-c2nc(=O)o[n-]2)cc1)C1(c2ccccc2)CCOCC1	ZINC000065547402	205359061	/nfs/dbraw/zinc/35/90/61/205359061.db2.gz	XCNMOPBUFBEDKV-UHFFFAOYSA-N	-1	0	365.389	2.717	50	0		FFAARM
O=C1NC[C@@H](c2ccccc2)Cc2[n-]c(-c3nc(-c4cccnc4)no3)nc21	ZINC000065372183	205341269	/nfs/dbraw/zinc/34/12/69/205341269.db2.gz	GRXXBMZVTAPDRF-AWEZNQCLSA-N	-1	0	372.388	2.591	50	0		FFAARM
CS(=O)(=O)CCn1cnc(-c2ccccc2)c1-c1ccccc1C(=O)[O-]	ZINC000065384108	205343091	/nfs/dbraw/zinc/34/30/91/205343091.db2.gz	KIFOIFRCULEHSW-UHFFFAOYSA-N	-1	0	370.430	2.960	50	0		FFAARM
COc1ccc(C([O-])=CS(=O)(=O)c2ccc(F)cc2F)cc1OC	ZINC000067172814	205366983	/nfs/dbraw/zinc/36/69/83/205366983.db2.gz	IRMKLMLSTASSKP-UHFFFAOYSA-N	-1	0	356.346	2.639	50	0		FFAARM
Cc1ccc(CN2C[C@@H](C(=O)Nc3ccc(C(=O)[O-])cc3)CC2=O)cc1	ZINC000067244982	205368886	/nfs/dbraw/zinc/36/88/86/205368886.db2.gz	YWQZOTLGMRSAIV-INIZCTEOSA-N	-1	0	352.390	2.680	50	0		FFAARM
CCc1ccccc1-c1cc(C(=O)[O-])cc(S(=O)(=O)NCCOC)c1	ZINC000071763430	205444165	/nfs/dbraw/zinc/44/41/65/205444165.db2.gz	ATFWQXJVSCZKAR-UHFFFAOYSA-N	-1	0	363.435	2.539	50	0		FFAARM
O=C([O-])C1(NC(=O)[C@H]2CC(=O)N(c3cccc(Cl)c3)C2)CCCCC1	ZINC000071802769	205449174	/nfs/dbraw/zinc/44/91/74/205449174.db2.gz	DIZJRGSUZAWKEH-LBPRGKRZSA-N	-1	0	364.829	2.597	50	0		FFAARM
COc1ccccc1OC1(C(=O)[O-])CCN(C(=O)c2ccoc2C)CC1	ZINC000072481498	205564669	/nfs/dbraw/zinc/56/46/69/205564669.db2.gz	OPLVUWNIBUYRNV-UHFFFAOYSA-N	-1	0	359.378	2.735	50	0		FFAARM
O=C([O-])c1ccc([C@H]2CCCN(C(=O)CCC(=O)NC3CCCC3)C2)cc1	ZINC000095361094	205732284	/nfs/dbraw/zinc/73/22/84/205732284.db2.gz	IRRFFYUGBZQKOX-KRWDZBQOSA-N	-1	0	372.465	2.930	50	0		FFAARM
Cc1ccc(C(=O)N2C[C@H]3COc4ccccc4C[C@@]3(C(=O)[O-])C2)s1	ZINC000096136568	205830901	/nfs/dbraw/zinc/83/09/01/205830901.db2.gz	JGVMDNBREYJFFA-IFXJQAMLSA-N	-1	0	357.431	2.835	50	0		FFAARM
O=C([O-])c1ccc(C(=O)N2CC[C@@H](NC(=O)OCc3ccccc3)C2)cc1	ZINC000097137295	205899713	/nfs/dbraw/zinc/89/97/13/205899713.db2.gz	OLGSISOWPKLMNS-QGZVFWFLSA-N	-1	0	368.389	2.526	50	0		FFAARM
COc1ccc([C@@H]2CC(c3ccco3)=NN2C(=O)CCC(=O)[O-])cc1OC	ZINC000097165272	205901295	/nfs/dbraw/zinc/90/12/95/205901295.db2.gz	XAOFPUSHEUDSHB-AWEZNQCLSA-N	-1	0	372.377	2.839	50	0		FFAARM
COc1cc(S(=O)(=O)Nc2ccc(F)cc2C)cc(C(=O)[O-])c1OC	ZINC000045946238	206080045	/nfs/dbraw/zinc/08/00/45/206080045.db2.gz	NKHFEHJCHLWRAA-UHFFFAOYSA-N	-1	0	369.370	2.650	50	0		FFAARM
COc1cc(S(=O)(=O)Nc2ccc(C)c(F)c2)cc(C(=O)[O-])c1OC	ZINC000045946233	206080948	/nfs/dbraw/zinc/08/09/48/206080948.db2.gz	RQTMCBNXKWWWKG-UHFFFAOYSA-N	-1	0	369.370	2.650	50	0		FFAARM
CN(c1ccccc1)c1ccccc1C(=O)N1CCO[C@H](CC(=O)[O-])C1	ZINC000237064393	206084458	/nfs/dbraw/zinc/08/44/58/206084458.db2.gz	NKHLRHMDDMQMEJ-MRXNPFEDSA-N	-1	0	354.406	2.770	50	0		FFAARM
COc1ccc(-c2cc(C(=O)N3CCCC[C@@H]3CCC(=O)[O-])[nH]n2)cc1	ZINC000237403442	206101726	/nfs/dbraw/zinc/10/17/26/206101726.db2.gz	UYVPWLOUDZGMKG-CQSZACIVSA-N	-1	0	357.410	2.945	50	0		FFAARM
C[C@@H](CCc1ccccc1F)C(=O)N(CCC(=O)[O-])C1CCOCC1	ZINC000237348231	206102193	/nfs/dbraw/zinc/10/21/93/206102193.db2.gz	VYLVMIPSDYNUHG-AWEZNQCLSA-N	-1	0	351.418	2.877	50	0		FFAARM
COc1ccc(-c2cnc(CCC(=O)N3CC[C@](C)(C(=O)[O-])C3)o2)cc1	ZINC000237443112	206103878	/nfs/dbraw/zinc/10/38/78/206103878.db2.gz	MLZJEMNUYQAREM-IBGZPJMESA-N	-1	0	358.394	2.606	50	0		FFAARM
C[C@@H](Oc1cccc(Br)c1)C(=O)N1CCC(C(=O)[O-])CC1	ZINC000237497688	206105570	/nfs/dbraw/zinc/10/55/70/206105570.db2.gz	DESWYNDPBVWLDQ-SNVBAGLBSA-N	-1	0	356.216	2.540	50	0		FFAARM
Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)N2CCC[C@@H](CCC(=O)[O-])C2)cc1	ZINC000237731574	206107708	/nfs/dbraw/zinc/10/77/08/206107708.db2.gz	IZDYYGJHULGZFJ-FUHWJXTLSA-N	-1	0	372.465	2.589	50	0		FFAARM
Cc1nc(Cc2ccccc2)sc1C(=O)N(CC(=O)[O-])C1CCOCC1	ZINC000237657829	206108107	/nfs/dbraw/zinc/10/81/07/206108107.db2.gz	KQXLDOGVDCISNS-UHFFFAOYSA-N	-1	0	374.462	2.748	50	0		FFAARM
O=C([O-])CCN(C[C@@H]1CCCO1)C(=O)c1sccc1Br	ZINC000238095226	206113780	/nfs/dbraw/zinc/11/37/80/206113780.db2.gz	DFZUPGMYXXIHAQ-VIFPVBQESA-N	-1	0	362.245	2.607	50	0		FFAARM
O=C([O-])CC[C@H]1CCCN(C(=O)C2(c3cccc(F)c3)CCOCC2)C1	ZINC000238006485	206110668	/nfs/dbraw/zinc/11/06/68/206110668.db2.gz	LGZSRFPPFHXXLG-OAHLLOKOSA-N	-1	0	363.429	2.977	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)[C@H]1CCCOC1)c1ccc(Br)cc1	ZINC000237963733	206111495	/nfs/dbraw/zinc/11/14/95/206111495.db2.gz	OFVZEKGKGQKNJG-AAEUAGOBSA-N	-1	0	356.216	2.508	50	0		FFAARM
O=C([O-])C1CCN(C(=O)C2(c3cccc(Br)c3)CC2)CC1	ZINC000238020695	206112181	/nfs/dbraw/zinc/11/21/81/206112181.db2.gz	JZZUOWHJWIYZLE-UHFFFAOYSA-N	-1	0	352.228	2.804	50	0		FFAARM
Cc1c(C(=O)Nc2ccccc2C)sc2ncn([C@H](C)C(=O)[O-])c(=O)c12	ZINC000000958445	206142601	/nfs/dbraw/zinc/14/26/01/206142601.db2.gz	SSRZDNMJRDPYIF-LLVKDONJSA-N	-1	0	371.418	2.973	50	0		FFAARM
COc1ccc(Br)cc1[C@@H]1SC[C@H](C(=O)[O-])N1C(C)=O	ZINC000002763437	206156836	/nfs/dbraw/zinc/15/68/36/206156836.db2.gz	UZGPXPRWSYHLDM-PWSUYJOCSA-N	-1	0	360.229	2.505	50	0		FFAARM
COc1cc2c(cc(C(=O)N[C@@H](C(=O)[O-])c3ccccc3)n2C)c(OC)c1	ZINC000004000382	206163640	/nfs/dbraw/zinc/16/36/40/206163640.db2.gz	FBAZFYHDGPTECI-GOSISDBHSA-N	-1	0	368.389	2.751	50	0	biogenic	FFAARM
O=S(=O)([N-]c1ccc(-c2ccc3nncn3n2)cc1)c1cccs1	ZINC000005150843	206190083	/nfs/dbraw/zinc/19/00/83/206190083.db2.gz	LXTRYTDISWHWCQ-UHFFFAOYSA-N	-1	0	357.420	2.654	50	0		FFAARM
CCc1nc2sc([C@@H](c3cccs3)N3CCOCC3)c([O-])n2n1	ZINC000004584941	206179168	/nfs/dbraw/zinc/17/91/68/206179168.db2.gz	NMAABRBUKWUVCF-GFCCVEGCSA-N	-1	0	350.469	2.542	50	0		FFAARM
CCc1nc2sc([C@@H](c3cccs3)N3CCC(O)CC3)c([O-])n2n1	ZINC000004585191	206179838	/nfs/dbraw/zinc/17/98/38/206179838.db2.gz	PSKVZQXLXTVOGA-CYBMUJFWSA-N	-1	0	364.496	2.666	50	0		FFAARM
COc1ccc(OC)c2c1cc(C(=O)NCC1CCC(C(=O)[O-])CC1)n2C	ZINC000006719403	206203832	/nfs/dbraw/zinc/20/38/32/206203832.db2.gz	PODWZCWMESZPGN-UHFFFAOYSA-N	-1	0	374.437	2.816	50	0		FFAARM
O=C(c1ccc2c(=O)[nH]c(=S)[n-]c2c1)N1CCS[C@H]2CCCC[C@H]21	ZINC000170656850	206279999	/nfs/dbraw/zinc/27/99/99/206279999.db2.gz	PMTQRYJXNAMOOZ-KGLIPLIRSA-N	-1	0	361.492	2.712	50	0		FFAARM
O=C([N-]S(=O)(=O)Cc1ccccc1Cl)c1cc2c(s1)CCOC2	ZINC000170656515	206280159	/nfs/dbraw/zinc/28/01/59/206280159.db2.gz	LTQWEUOGXYTNAA-UHFFFAOYSA-N	-1	0	371.867	2.734	50	0		FFAARM
O=C([O-])[C@@H]1CCCN1S(=O)(=O)c1cc(C(F)(F)F)ccc1Cl	ZINC000013027773	206300484	/nfs/dbraw/zinc/30/04/84/206300484.db2.gz	BMYQIKMOBPFNPY-VIFPVBQESA-N	-1	0	357.737	2.597	50	0		FFAARM
COC(=O)c1ccc2c(c1)[n-]c(=S)n(Cc1cccc(OC)c1)c2=O	ZINC000009319328	206313146	/nfs/dbraw/zinc/31/31/46/206313146.db2.gz	OTUWCPOSKAPUIP-UHFFFAOYSA-N	-1	0	356.403	2.903	50	0		FFAARM
O=C([O-])[C@H]1CS/C(=C/c2ccc(N3C(=O)c4ccccc4C3=O)cc2)N1	ZINC000020445355	206331941	/nfs/dbraw/zinc/33/19/41/206331941.db2.gz	SOFHKMSFBFBXPX-INQNZLQJSA-N	-1	0	366.398	2.575	50	0		FFAARM
Cn1cnc(S(=O)(=O)[N-]c2ccccc2-c2cn3ccsc3n2)c1	ZINC000206908306	206337366	/nfs/dbraw/zinc/33/73/66/206337366.db2.gz	JTYIMIUPEBKTHE-UHFFFAOYSA-N	-1	0	359.436	2.597	50	0		FFAARM
CC(=O)Nc1ncc(S(=O)(=O)[N-][C@H](C2CCCC2)C(F)(F)F)s1	ZINC000287898305	257127738	/nfs/dbraw/zinc/12/77/38/257127738.db2.gz	SAGIXPRRMZBKPU-SNVBAGLBSA-N	-1	0	371.406	2.501	50	0		FFAARM
CN1C(=O)C[C@@H](C(=O)[O-])C12CCN(c1ccc3cccc(Cl)c3n1)CC2	ZINC000095360477	132207759	/nfs/dbraw/zinc/20/77/59/132207759.db2.gz	GWGQICTURIMLCQ-ZDUSSCGKSA-N	-1	0	373.840	2.790	50	0		FFAARM
O=C([O-])CCc1ccc(S(=O)(=O)N2CCCc3ccc(F)cc32)cc1	ZINC000071818204	136141239	/nfs/dbraw/zinc/14/12/39/136141239.db2.gz	JJPUGKOKGBBVJX-UHFFFAOYSA-N	-1	0	363.410	2.984	50	0		FFAARM
Cn1c(=O)c2ccc(C(=O)NC(C)(C)c3ccccc3)cc2[n-]c1=S	ZINC000103863538	222345085	/nfs/dbraw/zinc/34/50/85/222345085.db2.gz	YNEQXTHTPNMMEK-UHFFFAOYSA-N	-1	0	353.447	2.887	50	0		FFAARM
O=C([O-])Cn1ccc([C@@H]2CCCN(C(=O)c3ccc(Cl)s3)C2)n1	ZINC000426387161	263573150	/nfs/dbraw/zinc/57/31/50/263573150.db2.gz	WKIBTHWKRQUTSX-SNVBAGLBSA-N	-1	0	353.831	2.702	50	0		FFAARM
C[C@H](C1CC1)N(C)S(=O)(=O)c1cc(C(=O)[O-])sc1Br	ZINC000036785293	506418087	/nfs/dbraw/zinc/41/80/87/506418087.db2.gz	PWQDKAKZLGDVBH-ZCFIWIBFSA-N	-1	0	368.274	2.628	50	0		FFAARM
Cc1cc2c(cc1C)N[C@@H](CC(=O)Nc1cccc(C(=O)[O-])c1)C(=O)N2	ZINC000000639817	506226372	/nfs/dbraw/zinc/22/63/72/506226372.db2.gz	WEVACZPYYADBPH-INIZCTEOSA-N	-1	0	353.378	2.763	50	0		FFAARM
COc1cccc([C@H]2N[C@H](C(=O)[O-])Cc3c4ccccc4[nH]c32)c1OC	ZINC000000771866	506232302	/nfs/dbraw/zinc/23/23/02/506232302.db2.gz	ZKLBZOHWBKUYBF-DOTOQJQBSA-N	-1	0	352.390	2.873	50	0	biogenic	FFAARM
O=C([O-])[C@H](Cc1ccc(Cl)cc1)NS(=O)(=O)c1ccc(Cl)cc1	ZINC000000846290	506235686	/nfs/dbraw/zinc/23/56/86/506235686.db2.gz	MBKIFDZRLANKGM-AWEZNQCLSA-N	-1	0	374.245	2.968	50	0		FFAARM
Cc1cc(C)c(C)c(S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)[O-])c1C	ZINC000000948470	506239784	/nfs/dbraw/zinc/23/97/84/506239784.db2.gz	STQXOMYIGNWPDF-KRWDZBQOSA-N	-1	0	361.463	2.894	50	0		FFAARM
Cc1cc(C)n2nc(S(=O)(=O)[N-]c3ccc(Cl)cc3Cl)nc2n1	ZINC000000970383	506242528	/nfs/dbraw/zinc/24/25/28/506242528.db2.gz	ALQZQWQUEINUQC-UHFFFAOYSA-N	-1	0	372.237	2.849	50	0		FFAARM
CC(C)=CC(=O)Nc1ccc(S(=O)(=O)[N-]c2nc(C)cc(C)n2)cc1	ZINC000000956512	506240771	/nfs/dbraw/zinc/24/07/71/506240771.db2.gz	JUKLXJXYAATVRF-UHFFFAOYSA-N	-1	0	360.439	2.799	50	0		FFAARM
Cc1cc([N-]S(=O)(=O)c2ccc(NC(=O)c3ccoc3C)cc2)no1	ZINC000001115048	506249799	/nfs/dbraw/zinc/24/97/99/506249799.db2.gz	ZPAOVVJJAFLQBQ-UHFFFAOYSA-N	-1	0	361.379	2.938	50	0		FFAARM
CCOc1ccccc1N1C[C@@H](C(=O)Nc2ccc(C(=O)[O-])cc2)CC1=O	ZINC000001072513	506247164	/nfs/dbraw/zinc/24/71/64/506247164.db2.gz	LFWDBBNGSYCHAV-AWEZNQCLSA-N	-1	0	368.389	2.775	50	0		FFAARM
COc1ccc(-c2nnc(SCC(=O)NCCC(C)C)[n-]c2=O)cc1	ZINC000032778629	506294326	/nfs/dbraw/zinc/29/43/26/506294326.db2.gz	DWEAFJXIMHMVSY-UHFFFAOYSA-N	-1	0	362.455	2.507	50	0		FFAARM
O=C([O-])CCNC(=O)/C(=C/c1ccccc1)NC(=O)c1ccccc1Cl	ZINC000002982907	506305508	/nfs/dbraw/zinc/30/55/08/506305508.db2.gz	WLYXJMZQUZYZPO-VBKFSLOCSA-N	-1	0	372.808	2.702	50	0		FFAARM
CNC(=O)c1ccc(S(=O)(=O)[N-]c2cccc(Cl)c2N(C)C)cc1	ZINC000032926267	506312458	/nfs/dbraw/zinc/31/24/58/506312458.db2.gz	WKSJEILNUIDNCN-UHFFFAOYSA-N	-1	0	367.858	2.566	50	0		FFAARM
Cc1ccccc1-n1nnnc1C1([N-]C(=O)C(F)(F)F)CCCCC1	ZINC000004568313	506383132	/nfs/dbraw/zinc/38/31/32/506383132.db2.gz	LPMGCONAAVZOAV-UHFFFAOYSA-N	-1	0	353.348	2.809	50	0		FFAARM
O=C([O-])/C=C/C(=O)N1N=C(c2cccc([N+](=O)[O-])c2)C[C@@H]1c1ccccc1	ZINC000005450642	506444256	/nfs/dbraw/zinc/44/42/56/506444256.db2.gz	GZNVPNTXVDNWID-OAGJVSPASA-N	-1	0	365.345	2.913	50	0		FFAARM
O=C([O-])CCCCCCCNc1ccn(OCc2ccccc2)c(=O)n1	ZINC000038963067	506447835	/nfs/dbraw/zinc/44/78/35/506447835.db2.gz	MYONMDAKRWEJON-UHFFFAOYSA-N	-1	0	359.426	2.709	50	0		FFAARM
O=C([O-])CCc1nc2nc(-c3ccc(F)cc3)cc(C(F)(F)F)n2n1	ZINC000012399063	506860462	/nfs/dbraw/zinc/86/04/62/506860462.db2.gz	RVLFFBSUJNSVPU-UHFFFAOYSA-N	-1	0	354.263	2.966	50	0		FFAARM
COC(=O)c1sccc1NC(=O)C[C@@H](C(=O)[O-])c1ccc(F)cc1	ZINC000012929369	506915502	/nfs/dbraw/zinc/91/55/02/506915502.db2.gz	LCOQHMUONUCMAP-LLVKDONJSA-N	-1	0	351.355	2.871	50	0		FFAARM
COc1ccc([C@H](CC(=O)[O-])NC(=O)c2cccc(OC)c2OC)cc1	ZINC000013187453	506932618	/nfs/dbraw/zinc/93/26/18/506932618.db2.gz	NXJPAWLNPAHLSF-HNNXBMFYSA-N	-1	0	359.378	2.658	50	0		FFAARM
COc1ccc(OC)c([C@H](C)NC(=O)COc2ccccc2C(=O)[O-])c1	ZINC000013411525	506940625	/nfs/dbraw/zinc/94/06/25/506940625.db2.gz	JGZKFIFHXPBUCX-LBPRGKRZSA-N	-1	0	359.378	2.658	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)c1ccc(N2CCCC2=O)cc1)c1cccs1	ZINC000013389757	506940927	/nfs/dbraw/zinc/94/09/27/506940927.db2.gz	BGAABSZUZYXPHK-AWEZNQCLSA-N	-1	0	358.419	2.821	50	0		FFAARM
COc1ccc(CCC(=O)NCCc2ccc(C(=O)[O-])cc2)cc1OC	ZINC000013442068	506941661	/nfs/dbraw/zinc/94/16/61/506941661.db2.gz	FJUJOPCYLABAMX-UHFFFAOYSA-N	-1	0	357.406	2.694	50	0		FFAARM
CS(=O)(=O)[N-]c1nc2ccc(NC(=O)Cc3ccccc3)cc2s1	ZINC000015862003	507065334	/nfs/dbraw/zinc/06/53/34/507065334.db2.gz	HWSXXUAWXYOTHD-UHFFFAOYSA-N	-1	0	361.448	2.849	50	0		FFAARM
O=C([O-])CSCC(=O)Nc1sccc1C(=O)Nc1ccccc1	ZINC000017072700	507113645	/nfs/dbraw/zinc/11/36/45/507113645.db2.gz	MYPOKQBKLRCSOI-UHFFFAOYSA-N	-1	0	350.421	2.757	50	0		FFAARM
O=c1cc(CSc2nnnn2-c2ccccc2)[n-]n1-c1ccccc1	ZINC000018181009	507143465	/nfs/dbraw/zinc/14/34/65/507143465.db2.gz	BLTAUPJKGROXFQ-UHFFFAOYSA-N	-1	0	350.407	2.547	50	0		FFAARM
COc1cccc(C=Cc2cc(C(F)(F)F)nc(=O)[nH]2)c1OCC(=O)[O-]	ZINC000020000896	507208447	/nfs/dbraw/zinc/20/84/47/507208447.db2.gz	SGYUILRQHUTSIZ-AATRIKPKSA-N	-1	0	370.283	2.843	50	0		FFAARM
CC(=O)NC1=NN(C(C)=O)[C@@H](c2ccc(-c3cccc(C(=O)[O-])c3)o2)S1	ZINC000020895467	507237819	/nfs/dbraw/zinc/23/78/19/507237819.db2.gz	URHKYMLMDQGRCF-OAHLLOKOSA-N	-1	0	373.390	2.646	50	0		FFAARM
O=C(CN1c2cccc3cccc(c23)S1(=O)=O)[N-]OCc1ccccc1	ZINC000025284742	507483480	/nfs/dbraw/zinc/48/34/80/507483480.db2.gz	HCXZURJTLNLCPZ-UHFFFAOYSA-N	-1	0	368.414	2.597	50	0		FFAARM
O=C([O-])[C@H]1CCCN(c2nc(=O)c3scc(-c4ccccc4)c3[nH]2)C1	ZINC000049421364	507620841	/nfs/dbraw/zinc/62/08/41/507620841.db2.gz	YGPYZQSMCXBYRR-LBPRGKRZSA-N	-1	0	355.419	2.953	50	0		FFAARM
Cc1ccccc1-c1ncc(-c2nccn2CCc2n[nH]c(=O)[n-]2)s1	ZINC000072170568	507768931	/nfs/dbraw/zinc/76/89/31/507768931.db2.gz	NQLUCVLAPCIJQW-UHFFFAOYSA-N	-1	0	352.423	2.636	50	0		FFAARM
O=C([O-])[C@H]1c2[nH]cnc2CCN1Cc1nc(-c2ccc(F)cc2)cs1	ZINC000072426279	507788348	/nfs/dbraw/zinc/78/83/48/507788348.db2.gz	FXOAFIRWMVUKEI-MRXNPFEDSA-N	-1	0	358.398	2.856	50	0		FFAARM
O=C([O-])c1ccnc(-c2ccnc(NCCc3cn4ccccc4n3)n2)c1	ZINC000072475270	507795218	/nfs/dbraw/zinc/79/52/18/507795218.db2.gz	GRNOQTKXEDNGDX-UHFFFAOYSA-N	-1	0	360.377	2.539	50	0		FFAARM
O=C([O-])[C@@H]1c2nc[nH]c2CCN1C(=O)c1ccc2c(c1)[nH]c1c2CCCC1	ZINC000072474316	507795299	/nfs/dbraw/zinc/79/52/99/507795299.db2.gz	GUPUXPFFPWGDHD-SFHVURJKSA-N	-1	0	364.405	2.594	50	0		FFAARM
Cc1nc(N(C)C)ncc1C(=O)N1CCC[C@H](c2cccc(C(=O)[O-])c2)C1	ZINC000095383201	508181226	/nfs/dbraw/zinc/18/12/26/508181226.db2.gz	KKSIXRXBZGGSKX-INIZCTEOSA-N	-1	0	368.437	2.569	50	0		FFAARM
O=C([O-])c1ccc([C@@H]2CCCN(C(=O)c3nnc4n3CCCCC4)C2)cc1	ZINC000095390260	508183402	/nfs/dbraw/zinc/18/34/02/508183402.db2.gz	JCHBOZBTOKCFJS-MRXNPFEDSA-N	-1	0	368.437	2.723	50	0		FFAARM
COC(=O)C[C@H](c1ccc(Cl)cc1)c1c([O-])nc2ccccn2c1=O	ZINC000096117239	508206724	/nfs/dbraw/zinc/20/67/24/508206724.db2.gz	MVDHFQLMBVLTNQ-CYBMUJFWSA-N	-1	0	358.781	2.749	50	0		FFAARM
CC[C@H]1COCCN1Cc1cc(-c2ccccn2)ccc1OCC(=O)[O-]	ZINC000097259206	508222534	/nfs/dbraw/zinc/22/25/34/508222534.db2.gz	HSWSXIPDETXXJF-KRWDZBQOSA-N	-1	0	356.422	2.823	50	0		FFAARM
O=C(NC[C@@H]1CCOc2ccccc2C1)c1cc(=O)n(-c2ccccc2)[n-]1	ZINC000097636580	508227565	/nfs/dbraw/zinc/22/75/65/508227565.db2.gz	ABBDZXJQGOFVQN-OAHLLOKOSA-N	-1	0	363.417	2.537	50	0		FFAARM
CCc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccc(OC)cc4)c=3c2=O)cc1	ZINC000101418400	508241417	/nfs/dbraw/zinc/24/14/17/508241417.db2.gz	JUQCWCDCPQFJKA-ZWKOTPCHSA-N	-1	0	364.405	2.751	50	0		FFAARM
CC(=O)N(c1nc(/C=C2/NC(=S)NC2=O)cs1)c1cccc(C)c1C	ZINC000105417131	508373222	/nfs/dbraw/zinc/37/32/22/508373222.db2.gz	UZMOWWMOAWHQRM-NTUHNPAUSA-N	-1	0	372.475	2.790	50	0		FFAARM
O=C(NCCc1nc([O-])cc(=O)[nH]1)c1cccc(Oc2ccccc2)c1	ZINC000223330673	509334481	/nfs/dbraw/zinc/33/44/81/509334481.db2.gz	JAWMYJAFMLPXSS-UHFFFAOYSA-N	-1	0	351.362	2.653	50	0		FFAARM
CCOc1cc(CN2CC[N@H+](CC)C(C)(C)C2)ccc1O[C@H](C)C(=O)[O-]	ZINC000225342779	509369479	/nfs/dbraw/zinc/36/94/79/509369479.db2.gz	WJCBKAVGUWINSJ-OAHLLOKOSA-N	-1	0	364.486	2.853	50	0		FFAARM
COc1ccc(S(=O)(=O)[N-]c2cc(OC)ccn2)c(Br)c1	ZINC000225465220	509373077	/nfs/dbraw/zinc/37/30/77/509373077.db2.gz	ISOUZKGSZAXQHE-UHFFFAOYSA-N	-1	0	373.228	2.662	50	0		FFAARM
CC(C)Oc1cc(Br)cc(C(=O)N2CC[C@H](C(=O)[O-])C2)c1	ZINC000236694700	509481678	/nfs/dbraw/zinc/48/16/78/509481678.db2.gz	CIYAFJJUVYSNQF-JTQLQIEISA-N	-1	0	356.216	2.783	50	0		FFAARM
CC(C)(C(=O)[O-])n1cc(NC(=O)COc2ccc(F)cc2Cl)cn1	ZINC000193008656	509736131	/nfs/dbraw/zinc/73/61/31/509736131.db2.gz	QTLYFNWBOKGSHN-UHFFFAOYSA-N	-1	0	355.753	2.513	50	0		FFAARM
O=C([O-])CCN(C(=O)[C@H]1C[C@H]1c1cccc(Cl)c1)C1CCOCC1	ZINC000238070473	509814414	/nfs/dbraw/zinc/81/44/14/509814414.db2.gz	BCNJWUBNIBODFL-HOTGVXAUSA-N	-1	0	351.830	2.926	50	0		FFAARM
O=C([O-])CCN(Cc1ccc(F)c(F)c1)C(=O)COc1ccc(F)cc1	ZINC000238117235	509824430	/nfs/dbraw/zinc/82/44/30/509824430.db2.gz	YWOKMRZBMCVATG-UHFFFAOYSA-N	-1	0	367.323	2.986	50	0		FFAARM
COc1cc(C(C)=NNc2ccc(C(=O)[O-])cc2)ccc1S(C)(=O)=O	ZINC000252475266	509838828	/nfs/dbraw/zinc/83/88/28/509838828.db2.gz	XJCUEZCAHQPOAC-UHFFFAOYSA-N	-1	0	362.407	2.633	50	0		FFAARM
O=C(N[C@H](c1ccccn1)[C@H]1C[C@@H](O)C1)c1cc(=O)c2cccc(F)c2[n-]1	ZINC000253535337	509886145	/nfs/dbraw/zinc/88/61/45/509886145.db2.gz	UIAVMWHPESVTAT-IUUKEHGRSA-N	-1	0	367.380	2.717	50	0		FFAARM
O=C([O-])[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)CCc1nnc(-c2ccccc2)o1	ZINC000265544328	510108545	/nfs/dbraw/zinc/10/85/45/510108545.db2.gz	FIRVKGSYFSHPBG-JYJNAYRXSA-N	-1	0	369.421	2.914	50	0		FFAARM
CCO[C@@H]1C[C@@](NC(=O)c2ccc(-n3ccc(C)n3)cc2)(C(=O)[O-])C1(C)C	ZINC000262837738	510434293	/nfs/dbraw/zinc/43/42/93/510434293.db2.gz	SVOFYEKXNSZSPW-OXQOHEQNSA-N	-1	0	371.437	2.569	50	0		FFAARM
O=C([O-])[C@@H]1CCC[C@@H]1NC(=O)c1ccc(-c2noc(C(F)(F)F)n2)cc1	ZINC000262963364	510497824	/nfs/dbraw/zinc/49/78/24/510497824.db2.gz	RZDCVIJJMOIUCK-MNOVXSKESA-N	-1	0	369.299	2.739	50	0		FFAARM
CC(C)n1cnnc1-c1ccccc1[N-]S(=O)(=O)C[C@H]1CCCCO1	ZINC000175777589	510786338	/nfs/dbraw/zinc/78/63/38/510786338.db2.gz	HIGHVGPCBBVJSL-CQSZACIVSA-N	-1	0	364.471	2.837	50	0		FFAARM
CC(C)(C[C@@H]1CCCN(C(=O)c2cc(F)c(F)c([O-])c2F)C1)C(N)=O	ZINC000295780092	511513727	/nfs/dbraw/zinc/51/37/27/511513727.db2.gz	CWZIZAKZHQJLAO-VIFPVBQESA-N	-1	0	358.360	2.563	50	0		FFAARM
CN1C(=O)C[C@H](C(=O)N[C@H](CC(=O)[O-])c2cccs2)c2ccccc21	ZINC000299746324	511668672	/nfs/dbraw/zinc/66/86/72/511668672.db2.gz	WQUOUMIJEYJKJL-QWHCGFSZSA-N	-1	0	358.419	2.530	50	0		FFAARM
CCc1cnc(C)nc1-c1cccc(C(=O)N[C@H](C)c2n[n-]c(=N)s2)c1	ZINC000426518761	513967601	/nfs/dbraw/zinc/96/76/01/513967601.db2.gz	KDYIXNBMHUZZFX-SNVBAGLBSA-N	-1	0	368.466	2.939	50	0		FFAARM
CC(C)[C@@H](CC(=O)[O-])NC(=O)N1CCN(C/C=C/c2ccccc2)CC1	ZINC000426535418	513973145	/nfs/dbraw/zinc/97/31/45/513973145.db2.gz	HPCKBIMOTDFYIN-AHKGRUIUSA-N	-1	0	359.470	2.526	50	0		FFAARM
O=C([O-])CCCNC(=O)N1CCC(O)(c2cccc(C(F)(F)F)c2)CC1	ZINC000426573051	513983803	/nfs/dbraw/zinc/98/38/03/513983803.db2.gz	JXEKGJQAOJSMGQ-UHFFFAOYSA-N	-1	0	374.359	2.563	50	0		FFAARM
Cc1ccc2c(c1)CN([C@@H](C)C(=O)NCc1ccc(C(=O)[O-])cc1)CCO2	ZINC000580964015	519451811	/nfs/dbraw/zinc/45/18/11/519451811.db2.gz	KQFVQTRWDMYLOI-HNNXBMFYSA-N	-1	0	368.433	2.593	50	0		FFAARM
O=C([O-])CC[C@H]1CCCN(C(=O)/C=C\c2ccc(N3CCCC3=O)cc2)C1	ZINC000606441923	521068494	/nfs/dbraw/zinc/06/84/94/521068494.db2.gz	SQMFFWBQRWCGBI-CGICMKJESA-N	-1	0	370.449	2.930	50	0		FFAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)/C=C\c2ccc(N3CCCC3=O)cc2)C1	ZINC000606441935	521068919	/nfs/dbraw/zinc/06/89/19/521068919.db2.gz	SQMFFWBQRWCGBI-GJBHZFNWSA-N	-1	0	370.449	2.930	50	0		FFAARM
O=C([O-])[C@@H]1CCCN1C(=O)/C=C\c1ccc(OCc2ccccn2)cc1	ZINC000606442116	521069369	/nfs/dbraw/zinc/06/93/69/521069369.db2.gz	ULNRSNYCKIZETJ-YFWYWMRJSA-N	-1	0	352.390	2.749	50	0		FFAARM
COc1cc(-c2ccccc2)sc1C(=O)N1CCO[C@H](CC(=O)[O-])C1	ZINC000269054383	521897193	/nfs/dbraw/zinc/89/71/93/521897193.db2.gz	WVYHGCOQZUIJKM-CYBMUJFWSA-N	-1	0	361.419	2.739	50	0		FFAARM
O=C(N=c1[n-]nc(Cc2ccc(F)cc2)s1)NCC[C@H]1CC1(F)F	ZINC000621423348	522835717	/nfs/dbraw/zinc/83/57/17/522835717.db2.gz	RHJGCADZDHJGLW-JTQLQIEISA-N	-1	0	356.373	2.857	50	0		FFAARM
O=C([O-])COc1ccc(C(=O)N[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)cc1	ZINC000621540197	522916774	/nfs/dbraw/zinc/91/67/74/522916774.db2.gz	NTFRYHXWEHFBON-FUHWJXTLSA-N	-1	0	373.380	2.939	50	0		FFAARM
Cc1cccc(C[C@@H](CNC(=O)c2ncoc2[C@@H]2CCCO2)C(=O)[O-])c1	ZINC000237675986	524465990	/nfs/dbraw/zinc/46/59/90/524465990.db2.gz	FYUJPMMLFWZRQH-GJZGRUSLSA-N	-1	0	358.394	2.508	50	0		FFAARM
Cc1cc(C(=O)N2CC[C@@H](C(=O)[O-])C2)cc(C)c1OCc1cccnc1	ZINC000178273739	526257005	/nfs/dbraw/zinc/25/70/05/526257005.db2.gz	LMJWQNKOSSFMDR-MRXNPFEDSA-N	-1	0	354.406	2.824	50	0		FFAARM
O=C([O-])[C@H]1COCCN1C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1	ZINC000268997507	526333330	/nfs/dbraw/zinc/33/33/30/526333330.db2.gz	XEQYUONBRGFGFS-SNVBAGLBSA-N	-1	0	371.233	2.650	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)C[C@@H]1CCOC1)c1ccc(OC(F)(F)F)cc1	ZINC000299752975	527624323	/nfs/dbraw/zinc/62/43/23/527624323.db2.gz	WHAYBHGUFMSGMM-GXFFZTMASA-N	-1	0	361.316	2.644	50	0		FFAARM
CC1=C(C)C[C@H](C(=O)Nc2ccc(N3CCOCC3)cc2)[C@@H](C(=O)[O-])C1	ZINC000017073967	535239032	/nfs/dbraw/zinc/23/90/32/535239032.db2.gz	KYZBFBFWBZDZAH-ROUUACIJSA-N	-1	0	358.438	2.909	50	0		FFAARM
COc1ccccc1OC1(C(=O)[O-])CCN(c2ccc(C(C)=O)cn2)CC1	ZINC000082121622	537087774	/nfs/dbraw/zinc/08/77/74/537087774.db2.gz	DYRHQSKNHODDNB-UHFFFAOYSA-N	-1	0	370.405	2.795	50	0		FFAARM
CCOc1ccc(-n2c(=O)c3[n-][nH]n(Cc4cccc(F)c4)c=3c2=O)cc1	ZINC000101417805	570820093	/nfs/dbraw/zinc/82/00/93/570820093.db2.gz	HJYJMWWTZMIHLW-IAGOWNOFSA-N	-1	0	368.368	2.718	50	0		FFAARM
C[C@H]1Cc2ccccc2N1C(=O)c1ccc2c(c1)[n-]c(=S)n(C)c2=O	ZINC000102750861	570838054	/nfs/dbraw/zinc/83/80/54/570838054.db2.gz	IESUMEWVCOSTBS-NSHDSACASA-N	-1	0	351.431	2.814	50	0		FFAARM
COc1ccc(-n2c(=O)c3[n-][nH]n(-c4ccc(C)cc4)c=3c2=O)cc1OC	ZINC000102819027	570839917	/nfs/dbraw/zinc/83/99/17/570839917.db2.gz	HEMYIGNNRKIKML-IRXDYDNUSA-N	-1	0	366.377	2.510	50	0		FFAARM
O=C(C=C1CCCCC1)N[C@@H]1C[C@@H](C(=O)[O-])C[C@@H]1n1cc(C2CC2)nn1	ZINC000685942218	571102984	/nfs/dbraw/zinc/10/29/84/571102984.db2.gz	HNUILGZZVXADKE-INMHGKMJSA-N	-1	0	358.442	2.567	50	0		FFAARM
CC(C)(C)c1ccc([C@@H](CC(=O)[O-])NC(=O)c2cnn3cccnc23)cc1	ZINC000262515403	600392658	/nfs/dbraw/zinc/39/26/58/600392658.db2.gz	LFHZCBHXXAUOLQ-MRXNPFEDSA-N	-1	0	366.421	2.973	50	0		FFAARM
CO[C@](C)(C(=O)[O-])C(=O)N[C@H]1CCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000663046318	732376276	/nfs/dbraw/zinc/37/62/76/732376276.db2.gz	SMJQMFIVYOBALE-FFSVYQOJSA-N	-1	0	359.344	2.947	50	0		FFAARM
O=C([O-])c1cnc(NCc2ccc3c(c2)OCO3)nc1-c1ccncc1	ZINC000169751174	981380840	/nfs/dbraw/zinc/38/08/40/981380840.db2.gz	MWTPNCVGGZCIIS-UHFFFAOYSA-N	-1	0	350.334	2.578	50	0		FFAARM
O=C(CCc1cc(=O)[n-]o1)N1CC[C@@H](c2ccnc(-c3ccncc3)c2)C1	ZINC000067879707	991262970	/nfs/dbraw/zinc/26/29/70/991262970.db2.gz	LWPRDRXGPALDBU-MRXNPFEDSA-N	-1	0	364.405	2.786	50	0		FFAARM
COc1cc(/C=C2/Oc3cc(O)ccc3C2=O)ccc1OCCC(=O)[O-]	ZINC000096010315	1011562071	/nfs/dbraw/zinc/56/20/71/1011562071.db2.gz	IXWUQPLWKJBFJG-RQZCQDPDSA-N	-1	0	356.330	2.871	50	0		FFAARM
N#CC(=Cc1ccco1)C(=O)[N-]S(=O)(=O)c1ccc2c(c1)OCCCO2	ZINC000048535831	1022745939	/nfs/dbraw/zinc/74/59/39/1022745939.db2.gz	SIHXCBNGZUKHFE-XFXZXTDPSA-N	-1	0	374.374	2.693	50	0		FFAARM
O=C([O-])[C@H]1CCN(S(=O)(=O)c2ccc3c(c2)CCCO3)c2ccccc21	ZINC000656645720	1025434304	/nfs/dbraw/zinc/43/43/04/1025434304.db2.gz	QZINCDGYSKBRIE-INIZCTEOSA-N	-1	0	373.430	2.779	50	0		FFAARM
Cc1nn(C)c(C)c1CN(C(=O)c1[n-]c(=O)nc2ccccc21)C(C)C	ZINC001506401249	1059494513	/nfs/dbraw/zinc/49/45/13/1059494513.db2.gz	INNABJXIRWSNSX-UHFFFAOYSA-N	-1	0	353.426	2.737	50	0		FFAARM
COc1cccc([C@H](C)N(C)S(=O)(=O)c2cc(C(=O)[O-])ccc2F)c1	ZINC001506428009	1059514769	/nfs/dbraw/zinc/51/47/69/1059514769.db2.gz	WTKROKRZISEPHR-NSHDSACASA-N	-1	0	367.398	2.914	50	0		FFAARM
O=C([O-])c1cncc(N2CCCN(c3nc4ccccc4s3)CC2)n1	ZINC001529167854	1062199384	/nfs/dbraw/zinc/19/93/84/1062199384.db2.gz	PFUPSRMKODCXGW-UHFFFAOYSA-N	-1	0	355.423	2.501	50	0		FFAARM
Cc1cc(C)c(C)c(OCCC(=O)N(CCC(=O)[O-])C2CCOCC2)c1	ZINC000328594837	223115960	/nfs/dbraw/zinc/11/59/60/223115960.db2.gz	CTMCGBGTTPLLAR-UHFFFAOYSA-N	-1	0	363.454	2.863	50	0		FFAARM
CCOc1cc(/C=C2/SC(=O)N(C(C)C)C2=O)ccc1OCC(=O)[O-]	ZINC000000981438	203968730	/nfs/dbraw/zinc/96/87/30/203968730.db2.gz	DMYBNYPQJQOIKP-RIYZIHGNSA-N	-1	0	365.407	2.993	50	0		FFAARM
O=C([O-])CCNS(=O)(=O)c1ccc(Oc2ccccc2Cl)cc1	ZINC000001795985	204019179	/nfs/dbraw/zinc/01/91/79/204019179.db2.gz	MNMHNWSFUSLJBT-UHFFFAOYSA-N	-1	0	355.799	2.885	50	0		FFAARM
CCC[C@H](NC(=O)[C@H](C)Oc1ccc2c(C)c(C)c(=O)oc2c1)C(=O)[O-]	ZINC000002148869	204027452	/nfs/dbraw/zinc/02/74/52/204027452.db2.gz	VLNIJXQNIVYZFO-WFASDCNBSA-N	-1	0	361.394	2.547	50	0	biogenic	FFAARM
Cc1ccc(C[C@@H](CC(=O)NCCc2ccc3c(c2)OCO3)C(=O)[O-])cc1	ZINC000002944523	204069922	/nfs/dbraw/zinc/06/99/22/204069922.db2.gz	WFDVRQOVLBEPIS-KRWDZBQOSA-N	-1	0	369.417	2.716	50	0	biogenic	FFAARM
O=C([O-])c1ccc(CNS(=O)(=O)c2ccc(Br)cc2)cc1	ZINC000003025207	204074738	/nfs/dbraw/zinc/07/47/38/204074738.db2.gz	BJJKAZFQYSYZNY-UHFFFAOYSA-N	-1	0	370.224	2.626	50	0		FFAARM
Cc1nnc(NC(=O)C[C@H]([N-]C(=O)C(F)(F)F)c2ccccc2)s1	ZINC000003088154	204078435	/nfs/dbraw/zinc/07/84/35/204078435.db2.gz	FOEZHKLSBNCHFE-JTQLQIEISA-N	-1	0	358.345	2.595	50	0		FFAARM
Cc1cc(NC(=O)[N-]S(=O)(=O)c2ccc(C)cc2)n(-c2ccccc2)n1	ZINC000003176401	204081329	/nfs/dbraw/zinc/08/13/29/204081329.db2.gz	ZRODFNQEXMHHJH-UHFFFAOYSA-N	-1	0	370.434	3.000	50	0		FFAARM
COC(=O)c1ccc(Cl)c(S(=O)(=O)[N-]c2ccc(OC)cc2)c1	ZINC000003223882	204083401	/nfs/dbraw/zinc/08/34/01/204083401.db2.gz	CIZBHFQVDRXAQU-UHFFFAOYSA-N	-1	0	355.799	2.936	50	0		FFAARM
CC(C)[C@@H](O)[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)[O-]	ZINC000002583275	204045502	/nfs/dbraw/zinc/04/55/02/204045502.db2.gz	LYRGLIQVUMAZJU-RBUKOAKNSA-N	-1	0	369.417	2.995	50	0		FFAARM
COC(=O)Nc1ccc(S(=O)(=O)[N-]c2cnc3ccccc3n2)cc1	ZINC000002746944	204054796	/nfs/dbraw/zinc/05/47/96/204054796.db2.gz	VIKZNAHTYAIAPS-UHFFFAOYSA-N	-1	0	358.379	2.609	50	0		FFAARM
COc1ccc(-n2c(SCCC(=O)[O-])nnc2-c2ccncc2)cc1	ZINC000004058715	204119153	/nfs/dbraw/zinc/11/91/53/204119153.db2.gz	KYLKOSXNWIIGQR-UHFFFAOYSA-N	-1	0	356.407	2.905	50	0		FFAARM
COc1cccc([C@@H]2[C@@H](C(=O)[O-])c3cc(OC)c(OC)cc3C(=O)N2C)c1	ZINC000004563433	204146823	/nfs/dbraw/zinc/14/68/23/204146823.db2.gz	OBUCYFWXYBYFPV-ZWKOTPCHSA-N	-1	0	371.389	2.708	50	0		FFAARM
CCOc1ccccc1NC(=O)[C@H](Cc1cccc(C)c1)c1nnn[n-]1	ZINC000005444746	204209997	/nfs/dbraw/zinc/20/99/97/204209997.db2.gz	KCENNNQMIHADTE-OAHLLOKOSA-N	-1	0	351.410	2.872	50	0		FFAARM
COc1ccc(OC)c(Nc2nnc(Cc3ccc(C)cc3)c(=O)[n-]2)c1	ZINC000005154464	204194104	/nfs/dbraw/zinc/19/41/04/204194104.db2.gz	ROSOXARHFFUAFH-UHFFFAOYSA-N	-1	0	352.394	2.825	50	0		FFAARM
COc1ccc(OC)c(S(=O)(=O)[N-]c2ccn(Cc3ccccc3)n2)c1	ZINC000006502335	204250767	/nfs/dbraw/zinc/25/07/67/204250767.db2.gz	DKMIXOROGYZLGV-UHFFFAOYSA-N	-1	0	373.434	2.749	50	0		FFAARM
CC1=C(C)C[C@H](C(=O)N2CCN(CCc3ccccc3)CC2)[C@@H](C(=O)[O-])C1	ZINC000006731455	204263667	/nfs/dbraw/zinc/26/36/67/204263667.db2.gz	YVSBYFWGAAAUSZ-PMACEKPBSA-N	-1	0	370.493	2.821	50	0		FFAARM
Cc1ccc(Cl)cc1[N-]S(=O)(=O)c1c(C)nc2sccn2c1=O	ZINC000006859814	204276712	/nfs/dbraw/zinc/27/67/12/204276712.db2.gz	SVFAHADSGWALES-UHFFFAOYSA-N	-1	0	369.855	2.827	50	0		FFAARM
O=C([O-])[C@H](Cc1cc(=O)[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000009330879	204363509	/nfs/dbraw/zinc/36/35/09/204363509.db2.gz	ALLWOAVDORUJLA-INIZCTEOSA-N	-1	0	370.792	2.607	50	0	world	FFAARM
COC(=O)c1ccc(/C=C2\CC(=O)N(c3ccc(C(=O)[O-])cc3)C2=O)cc1	ZINC000009576039	204374319	/nfs/dbraw/zinc/37/43/19/204374319.db2.gz	ZHPGUVLALYRJFI-XNTDXEJSSA-N	-1	0	365.341	2.518	50	0		FFAARM
CCCSc1nc(=NC(=O)CN(C)Cc2cccc(F)c2)s[n-]1	ZINC000008749122	204344179	/nfs/dbraw/zinc/34/41/79/204344179.db2.gz	GGHRUCDWEQDDTR-UHFFFAOYSA-N	-1	0	354.476	2.672	50	0		FFAARM
O=C1N=C(SCn2nnc3ccccc32)N=C([O-])C1c1ccccc1	ZINC000013844128	204555589	/nfs/dbraw/zinc/55/55/89/204555589.db2.gz	XWHPFQUBILBGKF-UHFFFAOYSA-N	-1	0	351.391	2.637	50	0		FFAARM
CC[C@H]1CCc2c(sc(NC(=O)C[C@H](C)CC(=O)[O-])c2C(N)=O)C1	ZINC000017073064	204648117	/nfs/dbraw/zinc/64/81/17/204648117.db2.gz	MGXNAIHDNDGLSA-UWVGGRQHSA-N	-1	0	352.456	2.801	50	0		FFAARM
CC(C)OC(=O)c1c(NC(=O)COCC(=O)[O-])sc2c1CCCCC2	ZINC000017075721	204648961	/nfs/dbraw/zinc/64/89/61/204648961.db2.gz	ANEWGCJPKNWRTJ-UHFFFAOYSA-N	-1	0	369.439	2.622	50	0		FFAARM
O=C([O-])c1ccc(NC2=C(Cl)C(=O)O[C@@H]2OC(=O)c2ccccc2)cc1	ZINC000018037206	204659889	/nfs/dbraw/zinc/65/98/89/204659889.db2.gz	FPDPSVOXOMCQOT-SFHVURJKSA-N	-1	0	373.748	2.987	50	0		FFAARM
C[C@H](c1ccccc1)N1C(=O)C[C@@H](Sc2ncccc2C(=O)[O-])C1=O	ZINC000019880969	204710524	/nfs/dbraw/zinc/71/05/24/204710524.db2.gz	OZFMZIOAGPZXNE-BXUZGUMPSA-N	-1	0	356.403	2.761	50	0		FFAARM
O=C([O-])CCC(=O)Nc1ccc2[nH]cc([C@H](C(=O)[O-])[NH+]3CCCCC3)c2c1	ZINC000031819095	204921938	/nfs/dbraw/zinc/92/19/38/204921938.db2.gz	LCCVPSDKNHVBSN-GOSISDBHSA-N	-1	0	373.409	2.583	50	0		FFAARM
O=C([O-])C1CCN(C(=O)Cn2ccc3c2cccc3Br)CC1	ZINC000040285547	204993484	/nfs/dbraw/zinc/99/34/84/204993484.db2.gz	OSQFQAQVUGEMGT-UHFFFAOYSA-N	-1	0	365.227	2.727	50	0		FFAARM
COc1cc(C)c(S(=O)(=O)Nc2ccc(F)cc2C(=O)[O-])cc1OC	ZINC000071802023	205029561	/nfs/dbraw/zinc/02/95/61/205029561.db2.gz	ANBNYGNKRFSFFY-UHFFFAOYSA-N	-1	0	369.370	2.650	50	0		FFAARM
O=C(NCc1ccccc1CN1CCOCC1)c1ccc([O-])c(Cl)c1	ZINC000039981699	205048280	/nfs/dbraw/zinc/04/82/80/205048280.db2.gz	QOCBDSVDKNBGCB-UHFFFAOYSA-N	-1	0	360.841	2.808	50	0		FFAARM
O=C([O-])c1ccccc1CC(=O)Nc1cccc(CN2CCOC2=O)c1	ZINC000040158821	205061587	/nfs/dbraw/zinc/06/15/87/205061587.db2.gz	GCBVGUGKXLMPRA-UHFFFAOYSA-N	-1	0	354.362	2.518	50	0		FFAARM
COC(=O)c1cc([N-]S(=O)(=O)c2ccccc2OC)ccc1Cl	ZINC000044330225	205108035	/nfs/dbraw/zinc/10/80/35/205108035.db2.gz	XJBNANSKXFHDQE-UHFFFAOYSA-N	-1	0	355.799	2.936	50	0		FFAARM
CCOc1cccc2c1OC[C@H](C(=O)N(C)Cc1cc(C(=O)[O-])c(C)o1)C2	ZINC000299748355	205129275	/nfs/dbraw/zinc/12/92/75/205129275.db2.gz	HBJHSIZAKPSSFP-CQSZACIVSA-N	-1	0	373.405	2.895	50	0		FFAARM
COC(=O)c1sccc1S(=O)(=O)[N-]c1cccc(-n2cccn2)c1	ZINC000045774256	205124916	/nfs/dbraw/zinc/12/49/16/205124916.db2.gz	XKVLUBORWNQZJQ-UHFFFAOYSA-N	-1	0	363.420	2.521	50	0		FFAARM
O=C([O-])[C@H]1c2ccccc2C(=O)N(C2CC2)[C@@H]1c1ccc2c(c1)OCO2	ZINC000045923017	205126793	/nfs/dbraw/zinc/12/67/93/205126793.db2.gz	JHRFIVIKSLXTHD-ZWKOTPCHSA-N	-1	0	351.358	2.943	50	0		FFAARM
Cc1noc(C)c1COc1ccccc1C(=O)/N=c1\[n-]nc2ccccn21	ZINC000047232405	205143762	/nfs/dbraw/zinc/14/37/62/205143762.db2.gz	DJIGCDAWOSPBLV-UHFFFAOYSA-N	-1	0	363.377	2.587	50	0		FFAARM
Cc1cnc(C(=O)Nc2ccccc2[N-]S(=O)(=O)c2cccs2)cn1	ZINC000047458971	205146401	/nfs/dbraw/zinc/14/64/01/205146401.db2.gz	GOKUSTPMZCUQPJ-UHFFFAOYSA-N	-1	0	374.447	2.900	50	0		FFAARM
Cc1oc(CNC(=O)c2cccc(OC[C@H]3CCCO3)c2)cc1C(=O)[O-]	ZINC000299749684	205130080	/nfs/dbraw/zinc/13/00/80/205130080.db2.gz	LHNKCIBSNFWFMU-OAHLLOKOSA-N	-1	0	359.378	2.774	50	0		FFAARM
Cc1oc(CN(C)C(=O)c2ccc3c(c2)NC(=O)CS3)cc1C(=O)[O-]	ZINC000299751698	205131140	/nfs/dbraw/zinc/13/11/40/205131140.db2.gz	RIKISKIMNNEGMN-UHFFFAOYSA-N	-1	0	360.391	2.603	50	0		FFAARM
CCc1cc(=O)[nH]c(-c2cccc(NC(=O)[C@@H]3CC=CC[C@@H]3C(=O)[O-])c2)n1	ZINC000055149702	205208461	/nfs/dbraw/zinc/20/84/61/205208461.db2.gz	CTUCCGRJKBUESQ-CVEARBPZSA-N	-1	0	367.405	2.605	50	0		FFAARM
COc1ccc(CC(=O)[O-])cc1S(=O)(=O)N(C)c1cc(C)cc(C)c1	ZINC000057119804	205235459	/nfs/dbraw/zinc/23/54/59/205235459.db2.gz	SPBUMYPUHFMXFU-UHFFFAOYSA-N	-1	0	363.435	2.764	50	0		FFAARM
Cc1ccoc1C(=O)NC1CCN(C(=O)c2ccc([O-])c(Cl)c2)CC1	ZINC000058227293	205265040	/nfs/dbraw/zinc/26/50/40/205265040.db2.gz	MNFUHBOCIDTRPJ-UHFFFAOYSA-N	-1	0	362.813	2.982	50	0		FFAARM
CCc1nn2c(nc(C)c2S(=O)(=O)[N-]c2cc(C)ccc2F)s1	ZINC000065183798	205322308	/nfs/dbraw/zinc/32/23/08/205322308.db2.gz	KNSMXHXTLOFILO-UHFFFAOYSA-N	-1	0	354.432	2.910	50	0		FFAARM
O=S(=O)([N-]c1ccc2c(c1)OCO2)c1ccc(-c2ccno2)s1	ZINC000065031135	205316052	/nfs/dbraw/zinc/31/60/52/205316052.db2.gz	XHQOUJHVNJKWSF-UHFFFAOYSA-N	-1	0	350.377	2.933	50	0		FFAARM
COc1ccc([N-]S(=O)(=O)c2cc(-c3cc[nH]n3)cs2)cc1OC	ZINC000065112307	205317965	/nfs/dbraw/zinc/31/79/65/205317965.db2.gz	NAMKTBDDLZFWJS-UHFFFAOYSA-N	-1	0	365.436	2.956	50	0		FFAARM
Cc1ccc(CN2C[C@@H](C(=O)Nc3cccc(C(=O)[O-])c3)CC2=O)cc1	ZINC000067244978	205368371	/nfs/dbraw/zinc/36/83/71/205368371.db2.gz	GXUQFQABKJEQKB-INIZCTEOSA-N	-1	0	352.390	2.680	50	0		FFAARM
CN(C)C(=O)c1ccc(NC(=O)[C@H]2CC=CC[C@@H]2C(=O)[O-])cc1Cl	ZINC000067456644	205373245	/nfs/dbraw/zinc/37/32/45/205373245.db2.gz	CXWODBOEGWUBHB-RYUDHWBXSA-N	-1	0	350.802	2.647	50	0		FFAARM
Cc1cc(-c2nnc(SCC(=O)[O-])n2-c2ccccc2Cl)nn1C	ZINC000067695456	205384179	/nfs/dbraw/zinc/38/41/79/205384179.db2.gz	PIVHNDFCGGEADB-UHFFFAOYSA-N	-1	0	363.830	2.806	50	0		FFAARM
C[C@@H](c1nnc(SCC(=O)[O-])n1-c1ccccc1Cl)n1ccnc1	ZINC000067713468	205385580	/nfs/dbraw/zinc/38/55/80/205385580.db2.gz	PBTUGBMYAPSUCQ-JTQLQIEISA-N	-1	0	363.830	2.903	50	0		FFAARM
CC(=O)c1cccc(-n2c(Cc3cccnc3)nnc2SCC(=O)[O-])c1	ZINC000067847063	205396665	/nfs/dbraw/zinc/39/66/65/205396665.db2.gz	ZFBCNEJIHCYINF-UHFFFAOYSA-N	-1	0	368.418	2.632	50	0		FFAARM
O=C([O-])c1cc(Br)cc(S(=O)(=O)NC2CCCCC2)c1	ZINC000071552322	205432618	/nfs/dbraw/zinc/43/26/18/205432618.db2.gz	LXPMCQHTCHLGFM-UHFFFAOYSA-N	-1	0	362.245	2.758	50	0		FFAARM
O=C([O-])C1(Oc2ccccc2)CCN(C(=O)c2ncoc2C2CC2)CC1	ZINC000072432464	205545274	/nfs/dbraw/zinc/54/52/74/205545274.db2.gz	VKTOVSCAWICUFB-UHFFFAOYSA-N	-1	0	356.378	2.690	50	0		FFAARM
COc1ccc([C@H]2CC(c3ccco3)=NN2C(=O)CCC(=O)[O-])cc1OC	ZINC000097165273	205900696	/nfs/dbraw/zinc/90/06/96/205900696.db2.gz	XAOFPUSHEUDSHB-CQSZACIVSA-N	-1	0	372.377	2.839	50	0		FFAARM
CN(Cc1ccc(C(=O)[O-])cc1)C(=O)c1cccc(N2CCCC2=O)c1	ZINC000237070792	206083699	/nfs/dbraw/zinc/08/36/99/206083699.db2.gz	OOTYNVDCLXAADN-UHFFFAOYSA-N	-1	0	352.390	2.784	50	0		FFAARM
COc1ccc(-c2n[nH]cc2C(=O)N2CCC[C@H](CCC(=O)[O-])C2)cc1	ZINC000237387260	206102137	/nfs/dbraw/zinc/10/21/37/206102137.db2.gz	DBXLDNIFIQLFQT-CYBMUJFWSA-N	-1	0	357.410	2.802	50	0		FFAARM
Cc1nc2cc(F)ccc2cc1C(=O)N(CCC(=O)[O-])C[C@H]1CCCO1	ZINC000237744997	206106782	/nfs/dbraw/zinc/10/67/82/206106782.db2.gz	VQTFVHHODDPARJ-OAHLLOKOSA-N	-1	0	360.385	2.778	50	0		FFAARM
C[C@]1(C(=O)[O-])CCN(C(=O)C2(c3cccc(Cl)c3)CCOCC2)C1	ZINC000237639537	206107347	/nfs/dbraw/zinc/10/73/47/206107347.db2.gz	KGLRZKDKZLXMLY-KRWDZBQOSA-N	-1	0	351.830	2.711	50	0		FFAARM
C[C@]1(C(=O)[O-])CCN(C(=O)CCc2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000237641401	206107405	/nfs/dbraw/zinc/10/74/05/206107405.db2.gz	FIOWMNUUPCXHRF-KRWDZBQOSA-N	-1	0	363.801	2.646	50	0		FFAARM
Cc1nc(COc2cccc(C(=O)N3CC[C@@](C)(C(=O)[O-])C3)c2)cs1	ZINC000237762653	206108532	/nfs/dbraw/zinc/10/85/32/206108532.db2.gz	RCKQNWZWRVSVHX-GOSISDBHSA-N	-1	0	360.435	2.967	50	0		FFAARM
O=C([O-])C1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)CC1	ZINC000238026746	206112895	/nfs/dbraw/zinc/11/28/95/206112895.db2.gz	UZDHDNHZFSSDIO-UONOGXRCSA-N	-1	0	352.228	2.876	50	0		FFAARM
O=C([O-])CCN(C(=O)[C@@H]1C[C@H]1c1ccc(F)c(F)c1)C1CCOCC1	ZINC000238068750	206113000	/nfs/dbraw/zinc/11/30/00/206113000.db2.gz	XEUOFGUYUYJKCA-UONOGXRCSA-N	-1	0	353.365	2.551	50	0		FFAARM
O=C([O-])CCN(C(=O)c1sccc1Br)C1CCOCC1	ZINC000238076595	206113112	/nfs/dbraw/zinc/11/31/12/206113112.db2.gz	ZGMJLXXZSLPBOW-UHFFFAOYSA-N	-1	0	362.245	2.607	50	0		FFAARM
O=C([O-])C[C@H]1CN(C(=O)c2ccc(-c3ccc(F)cc3)cc2F)CCO1	ZINC000238059509	206113753	/nfs/dbraw/zinc/11/37/53/206113753.db2.gz	NPERHMOJDHGNRJ-HNNXBMFYSA-N	-1	0	361.344	2.948	50	0		FFAARM
O=C([O-])CCN(C[C@@H]1CCCO1)C(=O)[C@H]1C[C@@H]1c1c(F)cccc1F	ZINC000238089733	206112375	/nfs/dbraw/zinc/11/23/75/206112375.db2.gz	CCHKOIYYXZQFDD-AVGNSLFASA-N	-1	0	353.365	2.551	50	0		FFAARM
O=C([O-])[C@H]1CCN(C(=O)c2ccn(-c3ccc(Cl)c(Cl)c3)n2)C1	ZINC000238102182	206112738	/nfs/dbraw/zinc/11/27/38/206112738.db2.gz	PTVQGFBAGLHLDZ-VIFPVBQESA-N	-1	0	354.193	2.726	50	0		FFAARM
Cc1ccc(-c2noc(CCC(=O)N3CCCC[C@H]3C(=O)[O-])n2)cc1F	ZINC000136531440	206130180	/nfs/dbraw/zinc/13/01/80/206130180.db2.gz	CHMYISRPONROKI-AWEZNQCLSA-N	-1	0	361.373	2.582	50	0		FFAARM
Cc1cc(C)c(S(=O)(=O)NC[C@H](CCC(=O)[O-])C(F)(F)F)c(C)c1	ZINC000001802377	206151115	/nfs/dbraw/zinc/15/11/15/206151115.db2.gz	NXVBIDWCYZNJET-LBPRGKRZSA-N	-1	0	367.389	2.933	50	0		FFAARM
CCn1c2ccccc2c([O-])c(C(=O)NCc2ccc(OC)cc2)c1=O	ZINC000100621137	206223350	/nfs/dbraw/zinc/22/33/50/206223350.db2.gz	DBRNSBSQSGJQQL-UHFFFAOYSA-N	-1	0	352.390	2.666	50	0		FFAARM
Cc1nc(C)n(Cc2cccc(NC(=O)CC3(C(=O)[O-])CCCC3)c2)n1	ZINC000170021885	206270136	/nfs/dbraw/zinc/27/01/36/206270136.db2.gz	IYYGXGWPEBBJQK-UHFFFAOYSA-N	-1	0	356.426	2.917	50	0		FFAARM
COc1cc2nc(O)c(C(=O)N[C@H](C)c3ccccc3)c([O-])c2cc1OC	ZINC000017029092	206322242	/nfs/dbraw/zinc/32/22/42/206322242.db2.gz	YDSSPXRGUGAOQG-LLVKDONJSA-N	-1	0	368.389	2.742	50	0	biogenic	FFAARM
C[C@@H]1CN([C@H](c2sc3ncnn3c2[O-])c2cccc(F)c2)C[C@H](C)O1	ZINC000017246947	206323705	/nfs/dbraw/zinc/32/37/05/206323705.db2.gz	VCWKKHRFLOLDAF-WDMOLILDSA-N	-1	0	362.430	2.834	50	0		FFAARM
CN(CC(=O)[O-])c1ncc(CN2CCCC[C@@H]2c2cccc(F)c2)cn1	ZINC000215400432	206345447	/nfs/dbraw/zinc/34/54/47/206345447.db2.gz	ITMCWAHJKAMMRN-QGZVFWFLSA-N	-1	0	358.417	2.864	50	0		FFAARM
Cc1noc(C)c1[C@@H]1CCCN1C(=O)c1cc(=O)n(-c2ccccc2)[n-]1	ZINC000219031427	206377784	/nfs/dbraw/zinc/37/77/84/206377784.db2.gz	JSXKFVFEOIVPOE-INIZCTEOSA-N	-1	0	352.394	2.748	50	0		FFAARM
Cc1csc([C@@](O)(CC(=O)[N-]OCc2ccccc2)C(F)(F)F)n1	ZINC000058417866	221118264	/nfs/dbraw/zinc/11/82/64/221118264.db2.gz	HDBMJJYEHRIROL-AWEZNQCLSA-N	-1	0	360.357	2.840	50	0		FFAARM
Cc1cc(N2CCC(Oc3ccc4c(c3)CCC4)(C(=O)[O-])CC2)ncn1	ZINC000082135233	132196785	/nfs/dbraw/zinc/19/67/85/132196785.db2.gz	VDTZCDKREKIEOX-UHFFFAOYSA-N	-1	0	353.422	2.776	50	0		FFAARM
O=C([O-])c1cccc(N2CCC[C@@H](c3nccn3Cc3ccccn3)C2)n1	ZINC000095353233	132206802	/nfs/dbraw/zinc/20/68/02/132206802.db2.gz	KGXADGWFFKHRMO-OAHLLOKOSA-N	-1	0	363.421	2.804	50	0		FFAARM
Cc1cc(C)cc(N2CCN(c3ccc(Cl)c(C(=O)[O-])n3)CC2=O)c1	ZINC000095515412	132213587	/nfs/dbraw/zinc/21/35/87/132213587.db2.gz	YCVPAIGITKQVLN-UHFFFAOYSA-N	-1	0	359.813	2.903	50	0		FFAARM
O=C([O-])C1(NC(=O)c2cc(N3CCCCC3)ccc2Cl)CCOCC1	ZINC000252497033	132292770	/nfs/dbraw/zinc/29/27/70/132292770.db2.gz	PXRRAFUCTPPXIZ-UHFFFAOYSA-N	-1	0	366.845	2.694	50	0		FFAARM
CCOc1ccccc1N1CCN(C(=O)[C@@H]2CCCC[C@H]2C(=O)[O-])CC1	ZINC000002739287	132384001	/nfs/dbraw/zinc/38/40/01/132384001.db2.gz	JOYNFTZYFAUFHS-HZPDHXFCSA-N	-1	0	360.454	2.625	50	0		FFAARM
O=C([O-])c1cccc(S(=O)(=O)N2CCCc3c(F)cc(F)cc32)c1	ZINC000032597982	132925369	/nfs/dbraw/zinc/92/53/69/132925369.db2.gz	RHRXRZKYWRCZTI-UHFFFAOYSA-N	-1	0	353.346	2.805	50	0		FFAARM
CCn1cc(C)c(C(=O)[O-])c1CC(=O)NCCN1CCCc2ccccc21	ZINC000064983787	136134295	/nfs/dbraw/zinc/13/42/95/136134295.db2.gz	STKFVWJPLKIRHS-UHFFFAOYSA-N	-1	0	369.465	2.626	50	0		FFAARM
O=C([O-])[C@@H]1CC=CC[C@H]1C(=O)Nc1cccc(C(=O)N2CCCCC2)c1	ZINC000000794641	506232129	/nfs/dbraw/zinc/23/21/29/506232129.db2.gz	XMSLPTJAWDQIRU-IAGOWNOFSA-N	-1	0	356.422	2.918	50	0		FFAARM
COc1ccc(C(=O)NCCc2n[n-]c(=S)n2-c2ccccc2)cc1	ZINC000032579258	506266712	/nfs/dbraw/zinc/26/67/12/506266712.db2.gz	LIKRWGVRKPTSGN-UHFFFAOYSA-N	-1	0	354.435	2.911	50	0		FFAARM
CCCC[C@@H](NC(=O)[C@@H](C)Oc1ccc2c(C)cc(=O)oc2c1)C(=O)[O-]	ZINC000002097474	506272464	/nfs/dbraw/zinc/27/24/64/506272464.db2.gz	CKGWKEONMUYSQY-IUODEOHRSA-N	-1	0	361.394	2.628	50	0	biogenic	FFAARM
CCOc1ccc(S(=O)(=O)Nc2ccc(N(C)C)c(C(=O)[O-])c2)cc1	ZINC000033253669	506350528	/nfs/dbraw/zinc/35/05/28/506350528.db2.gz	HSMLJQPSHMFVIN-UHFFFAOYSA-N	-1	0	364.423	2.650	50	0		FFAARM
CCCOc1cccc(-c2nnc(CCC(=O)N[C@H](C)CC)c(=O)[n-]2)c1	ZINC000034765223	506369902	/nfs/dbraw/zinc/36/99/02/506369902.db2.gz	BFPDITFUMPPAHY-CYBMUJFWSA-N	-1	0	358.442	2.880	50	0		FFAARM
COc1ccc(CNc2ccc(N3CCOCC3)c(C(=O)[O-])c2)c(OC)c1	ZINC000004386319	506375158	/nfs/dbraw/zinc/37/51/58/506375158.db2.gz	GAYYJDAIMVZESH-UHFFFAOYSA-N	-1	0	372.421	2.851	50	0		FFAARM
CC(=O)N1CCCSc2ccc(S(=O)(=O)[N-]c3cccnc3)cc21	ZINC000035556368	506387470	/nfs/dbraw/zinc/38/74/70/506387470.db2.gz	MGSBJQGANYMVTB-UHFFFAOYSA-N	-1	0	363.464	2.731	50	0		FFAARM
COc1cc(NS(=O)(=O)c2cc(F)ccc2C)c(C(=O)[O-])cc1OC	ZINC000041705563	506544202	/nfs/dbraw/zinc/54/42/02/506544202.db2.gz	TXKMDSKJIKZERH-UHFFFAOYSA-N	-1	0	369.370	2.650	50	0		FFAARM
Cc1cn(C)c(CC(=O)N2CCN(c3cccc(C)c3)[C@H](C)C2)c1C(=O)[O-]	ZINC000008607755	506661136	/nfs/dbraw/zinc/66/11/36/506661136.db2.gz	ZWHPYUFFNJLUAV-MRXNPFEDSA-N	-1	0	369.465	2.620	50	0		FFAARM
O=C([O-])[C@H]1CC=CC[C@H]1C(=O)Nc1ccc(-c2nnc3n2CCCC3)cc1	ZINC000066903841	506689554	/nfs/dbraw/zinc/68/95/54/506689554.db2.gz	VHKJVSIFRCBIBW-CVEARBPZSA-N	-1	0	366.421	2.887	50	0		FFAARM
O=C([O-])[C@H]1CCC(=O)N(Cc2ccccc2)[C@@H]1c1ccc2c(c1)OCO2	ZINC000012336761	506852210	/nfs/dbraw/zinc/85/22/10/506852210.db2.gz	QZLGYHOJUHNZKB-HNAYVOBHSA-N	-1	0	353.374	2.980	50	0		FFAARM
CC(=O)OC(OC(C)=O)(c1ncccn1)c1cc(Cl)cc(Cl)c1[O-]	ZINC000012364485	506853137	/nfs/dbraw/zinc/85/31/37/506853137.db2.gz	HJYYUMUODLCOCN-UHFFFAOYSA-N	-1	0	371.176	2.816	50	0		FFAARM
C[C@H](NC(=O)Cc1csc(-c2ccc(OC(F)(F)F)cc2)n1)C(=O)[O-]	ZINC000012391733	506857179	/nfs/dbraw/zinc/85/71/79/506857179.db2.gz	JOMLDWRZDDIRNZ-QMMMGPOBSA-N	-1	0	374.340	2.841	50	0		FFAARM
CON(C)C(=O)c1ccc2c(c1)[n-]c(=S)n(CCc1ccccc1)c2=O	ZINC000012742295	506893828	/nfs/dbraw/zinc/89/38/28/506893828.db2.gz	ZABMEFWLAKNXJP-UHFFFAOYSA-N	-1	0	369.446	2.935	50	0		FFAARM
CN(Cc1nc(=O)c2sccc2[n-]1)C(=O)c1ccc(OC(F)F)cc1	ZINC000012747802	506896096	/nfs/dbraw/zinc/89/60/96/506896096.db2.gz	HLGIRSIYSRJIFL-UHFFFAOYSA-N	-1	0	365.361	2.858	50	0		FFAARM
COc1ccc([C@@H](CC(=O)[O-])NC(=O)CCOc2ccccc2OC)cc1	ZINC000013188109	506932774	/nfs/dbraw/zinc/93/27/74/506932774.db2.gz	ZDBHJNVHSBDARM-MRXNPFEDSA-N	-1	0	373.405	2.805	50	0		FFAARM
COc1ccc([C@@H](CC(=O)[O-])NC(=O)CCOc2ccccc2)cc1OC	ZINC000013183288	506932797	/nfs/dbraw/zinc/93/27/97/506932797.db2.gz	JYYJQXCHPXRSTQ-MRXNPFEDSA-N	-1	0	373.405	2.805	50	0		FFAARM
COc1ccc(CNC(=O)c2cccc(OC(F)F)c2)cc1C(=O)[O-]	ZINC000013392871	506941603	/nfs/dbraw/zinc/94/16/03/506941603.db2.gz	OGZCKHBQDPSSPX-UHFFFAOYSA-N	-1	0	351.305	2.925	50	0		FFAARM
Cn1c([O-])c(C(c2ccc(F)cc2)c2ccc(F)cc2)c(=O)n(C)c1=O	ZINC000013957369	506959472	/nfs/dbraw/zinc/95/94/72/506959472.db2.gz	CQLJTYCYVOGJDK-UHFFFAOYSA-N	-1	0	358.344	2.763	50	0		FFAARM
CCc1cccc(OCC(=O)N(C)Cc2nc(=O)c3sccc3[n-]2)c1	ZINC000014371028	506988955	/nfs/dbraw/zinc/98/89/55/506988955.db2.gz	ARZSKGFTKYNPGX-UHFFFAOYSA-N	-1	0	357.435	2.584	50	0		FFAARM
Cc1c(NC(=O)CC2(C(=O)[O-])CCCCC2)c(=O)n(-c2ccccc2)n1C	ZINC000016482497	507092149	/nfs/dbraw/zinc/09/21/49/507092149.db2.gz	GREWBPQBGJBFIR-UHFFFAOYSA-N	-1	0	371.437	2.848	50	0		FFAARM
CCn1c(=O)c2ccc(C(=O)N(C)Cc3ccccc3)cc2[n-]c1=S	ZINC000017334632	507122986	/nfs/dbraw/zinc/12/29/86/507122986.db2.gz	FAZMFEDMHXJCCF-UHFFFAOYSA-N	-1	0	353.447	2.977	50	0		FFAARM
Cc1cc2ncn([C@H]3CC(=O)N(c4ccc(C(=O)[O-])cc4)C3=O)c2cc1C	ZINC000018093501	507137647	/nfs/dbraw/zinc/13/76/47/507137647.db2.gz	IGWXTXWMPLNGBU-KRWDZBQOSA-N	-1	0	363.373	2.856	50	0		FFAARM
CCc1ccc(OC)c(S(=O)(=O)[N-]c2ccc3c(c2)CCC(=O)N3)c1	ZINC000022732874	507305462	/nfs/dbraw/zinc/30/54/62/507305462.db2.gz	ZXNCREKUROBTCD-UHFFFAOYSA-N	-1	0	360.435	2.943	50	0		FFAARM
CC1(C)[C@H](C(=O)[O-])[C@H]1C(=O)Nc1ccccc1C(=O)Nc1nccs1	ZINC000071286570	507700204	/nfs/dbraw/zinc/70/02/04/507700204.db2.gz	FXUARFZWLTWCJT-RYUDHWBXSA-N	-1	0	359.407	2.691	50	0		FFAARM
CC1(C)[C@@H](C(=O)[O-])[C@@H]1C(=O)Nc1ccc(F)c(C(=O)Nc2cccnc2)c1	ZINC000071289104	507700458	/nfs/dbraw/zinc/70/04/58/507700458.db2.gz	VHNLFDDIVPXBAZ-HUUCEWRRSA-N	-1	0	371.368	2.768	50	0		FFAARM
CCOc1cc2c(cc1CN1CCn3nc(CCC(=O)[O-])cc3C1)CCC2	ZINC000072167005	507768406	/nfs/dbraw/zinc/76/84/06/507768406.db2.gz	GQYNKSPXXUCVIU-UHFFFAOYSA-N	-1	0	369.465	2.804	50	0		FFAARM
CC(=O)N[C@H](CC(=O)NC1(C(=O)[O-])CCCCC1)c1ccc(Cl)cc1	ZINC000072276992	507772605	/nfs/dbraw/zinc/77/26/05/507772605.db2.gz	WJEBYJXQTFTVQR-OAHLLOKOSA-N	-1	0	366.845	2.811	50	0		FFAARM
COc1ccc(C2=NO[C@](CC(=O)Nc3ccccc3F)(C(=O)[O-])C2)cc1	ZINC000072404107	507783232	/nfs/dbraw/zinc/78/32/32/507783232.db2.gz	WCSCTYMLHVPKAM-LJQANCHMSA-N	-1	0	372.352	2.811	50	0		FFAARM
C[C@H](CNc1nccc(-c2cc(C(=O)[O-])ccn2)n1)Oc1cccnc1	ZINC000072418281	507786095	/nfs/dbraw/zinc/78/60/95/507786095.db2.gz	HJMWEDHSASRESR-GFCCVEGCSA-N	-1	0	351.366	2.511	50	0		FFAARM
CSc1nncn1-c1cccc([N-]S(=O)(=O)c2cccs2)c1	ZINC000031555721	507820162	/nfs/dbraw/zinc/82/01/62/507820162.db2.gz	URMGDEZONRBQAH-UHFFFAOYSA-N	-1	0	352.466	2.852	50	0		FFAARM
O=C([O-])[C@H](Cc1ccncc1)n1cc(-c2ccc3cccc(F)c3n2)nn1	ZINC000095363415	508176883	/nfs/dbraw/zinc/17/68/83/508176883.db2.gz	PTAXDKWLGASIMA-KRWDZBQOSA-N	-1	0	363.352	2.896	50	0		FFAARM
Cc1ccc([C@@H](NC(=O)C2CCN(C(=O)C3CCCC3)CC2)C(=O)[O-])cc1	ZINC000095526303	508195380	/nfs/dbraw/zinc/19/53/80/508195380.db2.gz	GQRDBMQSTIIQLM-GOSISDBHSA-N	-1	0	372.465	2.666	50	0		FFAARM
O=C([O-])[C@@]1(NC(=O)c2nc3ccccn3c2F)CCCc2ccccc21	ZINC000095527632	508196301	/nfs/dbraw/zinc/19/63/01/508196301.db2.gz	AECXGPJNJQMBHT-LJQANCHMSA-N	-1	0	353.353	2.520	50	0		FFAARM
CC(C)c1ccc(N2C[C@H](C(=O)NC3(C(=O)[O-])CCCC3)CC2=O)cc1	ZINC000095529148	508196840	/nfs/dbraw/zinc/19/68/40/508196840.db2.gz	JOQRFHZTEGGVOD-OAHLLOKOSA-N	-1	0	358.438	2.677	50	0		FFAARM
Cc1nc(-c2ccc(C)cc2)c(CC(=O)NCCSCC(=O)[O-])s1	ZINC000095970668	508199778	/nfs/dbraw/zinc/19/97/78/508199778.db2.gz	YQDCYDPIUUJRLT-UHFFFAOYSA-N	-1	0	364.492	2.903	50	0		FFAARM
CC(=O)c1cccc([N-]S(=O)(=O)c2c(C)[nH]c(C)c2-c2nc(C)no2)c1	ZINC000096379753	508214356	/nfs/dbraw/zinc/21/43/56/508214356.db2.gz	YTBGCIZNQLTVRR-UHFFFAOYSA-N	-1	0	374.422	2.993	50	0		FFAARM
COc1ccc([C@H]2CC(c3ccco3)=NN2C(=O)CCC(=O)[O-])c(OC)c1	ZINC000097104895	508219529	/nfs/dbraw/zinc/21/95/29/508219529.db2.gz	HYJXVILVVXLLJV-OAHLLOKOSA-N	-1	0	372.377	2.839	50	0		FFAARM
CS(=O)(=O)[N-]c1cc2occ(NC=O)c(=O)c2cc1Oc1ccccc1	ZINC000100018451	508238136	/nfs/dbraw/zinc/23/81/36/508238136.db2.gz	ANMATWQYLIFGOK-UHFFFAOYSA-N	-1	0	374.374	2.525	50	0	investigational	FFAARM
Cc1c(-n2c(=O)c3ccccc3[n-]c2=S)c(=O)n(-c2ccccc2)n1C	ZINC000100290948	508238988	/nfs/dbraw/zinc/23/89/88/508238988.db2.gz	PXLCNHSNRFDHEL-UHFFFAOYSA-N	-1	0	364.430	2.846	50	0		FFAARM
CCn1c2ccccc2c([O-])c(C(=O)Nc2ccccc2C(=O)OC)c1=O	ZINC000100543097	508239541	/nfs/dbraw/zinc/23/95/41/508239541.db2.gz	BQROTTGPJNMYNV-UHFFFAOYSA-N	-1	0	366.373	2.766	50	0		FFAARM
C[C@H]1CCc2cc(F)cc3c([O-])c(C(=O)NCc4cccnc4)c(=O)n1c23	ZINC000100630054	508239968	/nfs/dbraw/zinc/23/99/68/508239968.db2.gz	AIYVCKRQIPKGLQ-NSHDSACASA-N	-1	0	367.380	2.678	50	0		FFAARM
Cc1ccc(-n2c(=O)c3[n-][nH]n(Cc4cccc(F)c4)c=3c2=O)cc1C	ZINC000101418501	508241455	/nfs/dbraw/zinc/24/14/55/508241455.db2.gz	NMASCJJRCPNVDC-SJORKVTESA-N	-1	0	352.369	2.936	50	0		FFAARM
Cc1ccc(C(=O)N(Cc2nn3c([n-]2)nc(C)cc3=O)c2ccccc2)cc1	ZINC000101582016	508248783	/nfs/dbraw/zinc/24/87/83/508248783.db2.gz	PUFFMJCAZCBIMI-UHFFFAOYSA-N	-1	0	373.416	2.881	50	0		FFAARM
CC(C)c1nc(-c2ccccc2[N-]S(=O)(=O)C[C@H]2CCCCO2)n[nH]1	ZINC000076936208	508263983	/nfs/dbraw/zinc/26/39/83/508263983.db2.gz	KZUPHSRWAOTERN-CYBMUJFWSA-N	-1	0	364.471	2.906	50	0		FFAARM
COc1ccc([C@H]2c3c([nH]c(=O)[nH]c3=O)N=C3c4ccccc4C(=O)C32)cc1	ZINC000102650195	508280501	/nfs/dbraw/zinc/28/05/01/508280501.db2.gz	XPXJZIGBKCJCBN-CQSZACIVSA-N	-1	0	373.368	2.621	50	0		FFAARM
O=C([O-])c1ccnc(-c2ccnc(NCCc3noc(C4CCC4)n3)n2)c1	ZINC000077538910	508330559	/nfs/dbraw/zinc/33/05/59/508330559.db2.gz	RPYNVHMLZNYNLT-UHFFFAOYSA-N	-1	0	366.381	2.542	50	0		FFAARM
CC(C)c1nc(N2CCc3nc(-c4ccc(C(=O)[O-])cc4)[nH]c3C2)no1	ZINC000222678962	509320064	/nfs/dbraw/zinc/32/00/64/509320064.db2.gz	CWMFMRAALRLLLU-UHFFFAOYSA-N	-1	0	353.382	2.844	50	0		FFAARM
C/C(=C/C(=O)N1CCO[C@H](CC(=O)[O-])C1)c1cccc(C(F)(F)F)c1	ZINC000236628642	509466852	/nfs/dbraw/zinc/46/68/52/509466852.db2.gz	UNIBESDVWNKIGB-SMJHDNPOSA-N	-1	0	357.328	2.811	50	0		FFAARM
CC(C)COc1cn(-c2ccccc2)nc1C(=O)N1CCC[C@H]1C(=O)[O-]	ZINC000236705469	509486045	/nfs/dbraw/zinc/48/60/45/509486045.db2.gz	FFGZJERAAXSKJV-HNNXBMFYSA-N	-1	0	357.410	2.596	50	0		FFAARM
CCC(CC)(CNC(=O)C[C@H]1c2ccccc2C=CN1C(C)=O)C(=O)[O-]	ZINC000236844794	509516685	/nfs/dbraw/zinc/51/66/85/509516685.db2.gz	BFMCYTJWDOBHNV-KRWDZBQOSA-N	-1	0	358.438	2.958	50	0		FFAARM
COCc1c(C(=O)N(C)C[C@@H](C)c2nnn[n-]2)sc2cccc(F)c21	ZINC000183433682	509788047	/nfs/dbraw/zinc/78/80/47/509788047.db2.gz	VDVVWKNKSVWUCW-SECBINFHSA-N	-1	0	363.418	2.576	50	0		FFAARM
O=C([O-])c1n[nH]c2c1CN(C(=O)c1ccc(N3CCCC3)c(Cl)c1)CC2	ZINC000244787751	509870098	/nfs/dbraw/zinc/87/00/98/509870098.db2.gz	QDAZSJARYQLSSB-UHFFFAOYSA-N	-1	0	374.828	2.560	50	0		FFAARM
O=C([O-])c1ccc(C(=O)N2CCCC[C@H]2CNC(=O)c2ccccc2)s1	ZINC000262716231	510382655	/nfs/dbraw/zinc/38/26/55/510382655.db2.gz	CRQZJOOHDYSPCU-AWEZNQCLSA-N	-1	0	372.446	2.871	50	0		FFAARM
CC(C)C[C@H](NC(=O)c1ccc(CN2C[C@@H](C)O[C@H](C)C2)cc1)C(=O)[O-]	ZINC000185317185	510803481	/nfs/dbraw/zinc/80/34/81/510803481.db2.gz	NKEILEYWIPSLQD-RKVPGOIHSA-N	-1	0	362.470	2.525	50	0		FFAARM
Cc1c(C(=O)[O-])sc2ncnc(NC[C@H]3COc4ccccc4O3)c12	ZINC000299768569	511674759	/nfs/dbraw/zinc/67/47/59/511674759.db2.gz	PGPDWOIODOEEAI-JTQLQIEISA-N	-1	0	357.391	2.950	50	0		FFAARM
CCn1c(C)nc2cc(NS(=O)(=O)c3ccccc3)cc(C(=O)[O-])c21	ZINC000299791213	511682807	/nfs/dbraw/zinc/68/28/07/511682807.db2.gz	DHBWMJOVZPNIIV-UHFFFAOYSA-N	-1	0	359.407	2.864	50	0		FFAARM
O=C([O-])Cn1ccc([C@H]2CCCN(C(=O)c3ccc(Cl)s3)C2)n1	ZINC000426387160	513925325	/nfs/dbraw/zinc/92/53/25/513925325.db2.gz	WKIBTHWKRQUTSX-JTQLQIEISA-N	-1	0	353.831	2.702	50	0		FFAARM
O=C([O-])c1csc(CCNC(=O)N2CCCC[C@@H]2c2cccnc2)n1	ZINC000426414246	513934067	/nfs/dbraw/zinc/93/40/67/513934067.db2.gz	FNVFHYZIDBLVNH-CQSZACIVSA-N	-1	0	360.439	2.716	50	0		FFAARM
O=C([O-])Cn1nccc1[C@@H]1CCC[N@H+](Cc2cnn(-c3ccccc3)c2)C1	ZINC000426535918	513972982	/nfs/dbraw/zinc/97/29/82/513972982.db2.gz	QXZAAUXHJXSBOQ-QGZVFWFLSA-N	-1	0	365.437	2.533	50	0		FFAARM
N=c1[n-]nc(CCNC(=O)N2CCCCC[C@H]2c2cccc(F)c2)s1	ZINC000584892126	518526662	/nfs/dbraw/zinc/52/66/62/518526662.db2.gz	KXEPHCCOMAXYDJ-AWEZNQCLSA-N	-1	0	363.462	3.129	50	0		FFAARM
Cn1[n-]c(C(=O)NCC2(c3cccc(OC(F)(F)F)c3)CCC2)cc1=O	ZINC000585112984	518545643	/nfs/dbraw/zinc/54/56/43/518545643.db2.gz	RQOQMGLMPIVGBT-UHFFFAOYSA-N	-1	0	369.343	2.876	50	0		FFAARM
Cc1nc(COc2ccc(/C=C\C(=O)N3CC[C@H](C(=O)[O-])C3)cc2)cs1	ZINC000606442071	521068443	/nfs/dbraw/zinc/06/84/43/521068443.db2.gz	PDKXSKGBKVXXAB-QZDDGCDVSA-N	-1	0	372.446	2.977	50	0		FFAARM
CCOc1cc(/C=C\C(=O)N2CCC[C@@H]2C(=O)[O-])cc(Cl)c1OC	ZINC000606441004	521069074	/nfs/dbraw/zinc/06/90/74/521069074.db2.gz	CAVOBAPHBWXXRC-FMFIFOJESA-N	-1	0	353.802	2.836	50	0		FFAARM
CN(CC(=O)[O-])c1ncc(CN2CCCC[C@H]2c2cccc(F)c2)cn1	ZINC000244685614	522528592	/nfs/dbraw/zinc/52/85/92/522528592.db2.gz	ITMCWAHJKAMMRN-KRWDZBQOSA-N	-1	0	358.417	2.864	50	0		FFAARM
C[C@@H](Oc1ccc(NC(=O)[C@@H]2OCCc3ccccc32)cc1F)C(=O)[O-]	ZINC000630258904	522745012	/nfs/dbraw/zinc/74/50/12/522745012.db2.gz	VBYZBSYGGZLDFJ-PIGZYNQJSA-N	-1	0	359.353	2.930	50	0		FFAARM
COc1cccc(CC(=O)N2C[C@@H](c3ccccc3)[C@H](C(=O)[O-])C2)c1OC	ZINC000091595717	525870370	/nfs/dbraw/zinc/87/03/70/525870370.db2.gz	RSRYNQJZAAVHQI-DLBZAZTESA-N	-1	0	369.417	2.573	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)C[C@H]1CCCO1)c1ccc(OC(F)(F)F)cc1	ZINC000299382506	527624169	/nfs/dbraw/zinc/62/41/69/527624169.db2.gz	WVOJKUUBBCVWLX-CHWSQXEVSA-N	-1	0	361.316	2.786	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)C[C@@H]1CCCO1)c1cccc(Br)c1	ZINC000238128112	527624774	/nfs/dbraw/zinc/62/47/74/527624774.db2.gz	KXSSFYQDWFKMQP-QWHCGFSZSA-N	-1	0	356.216	2.650	50	0		FFAARM
O=C([O-])[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1OCCc2ccccc21	ZINC000299743747	527648271	/nfs/dbraw/zinc/64/82/71/527648271.db2.gz	LZMGZBQTOBXXPZ-RTBURBONSA-N	-1	0	364.401	2.594	50	0		FFAARM
Cc1ccc(Cc2c(C)nc3[n-]c(CN4CCC(C)CC4)nn3c2=O)cc1	ZINC000101802875	570824239	/nfs/dbraw/zinc/82/42/39/570824239.db2.gz	VAUFSCXKWPBRAL-UHFFFAOYSA-N	-1	0	365.481	2.857	50	0		FFAARM
CCOc1ccc(-n2[nH][n-]c3c(=O)n(-c4ccc(C)cc4)c(=O)c2=3)cc1	ZINC000102820440	570839795	/nfs/dbraw/zinc/83/97/95/570839795.db2.gz	RNPJXVASVLJZKQ-DLBZAZTESA-N	-1	0	350.378	2.892	50	0		FFAARM
CCn1c(=O)c2ccc(C(=O)Nc3ccc4c(c3)CCO4)cc2[n-]c1=S	ZINC000103050027	570843004	/nfs/dbraw/zinc/84/30/04/570843004.db2.gz	JNIUEPSCEVCRDN-UHFFFAOYSA-N	-1	0	367.430	2.892	50	0		FFAARM
Cc1cccc(Oc2ncccc2NC(=O)N2CCO[C@@H](C(=O)[O-])C2)c1C	ZINC000669496604	600008933	/nfs/dbraw/zinc/00/89/33/600008933.db2.gz	OTBQOVCYAMVMDQ-MRXNPFEDSA-N	-1	0	371.393	2.808	50	0		FFAARM
O=C(NN=Cc1ccccc1Cl)c1nc2ccc([N+](=O)[O-])cc2c(=O)[n-]1	ZINC000254341457	975317443	/nfs/dbraw/zinc/31/74/43/975317443.db2.gz	BVNWERPMTOPLND-UHFFFAOYSA-N	-1	0	371.740	2.661	50	0		FFAARM
CCCCCc1nc(CN2CCOCC2)n(-c2ccc(C(=O)[O-])cc2)n1	ZINC000952863608	1010985155	/nfs/dbraw/zinc/98/51/55/1010985155.db2.gz	UZVLNUNKMKOXJW-UHFFFAOYSA-N	-1	0	358.442	2.530	50	0		FFAARM
COc1ccc(C)cc1[C@H](C(=O)[O-])N(C)Cc1nc(-c2ccncc2)no1	ZINC000055392998	1018397215	/nfs/dbraw/zinc/39/72/15/1018397215.db2.gz	PAAALHCQSZDWQA-QGZVFWFLSA-N	-1	0	368.393	2.706	50	0		FFAARM
CC(C)c1ccc(C(=O)N2CC[C@H](Cc3ccc(C(=O)[O-])cc3)C2)c(=O)[nH]1	ZINC000072447183	1019898704	/nfs/dbraw/zinc/89/87/04/1019898704.db2.gz	ODJPXMOIOYBYRK-OAHLLOKOSA-N	-1	0	368.433	2.901	50	0		FFAARM
Cc1ccc(NC(=O)C2(C(=O)[O-])CCC2)cc1NC(=O)CN1CCCCC1	ZINC000663116726	1026595186	/nfs/dbraw/zinc/59/51/86/1026595186.db2.gz	JHQRKFZVKPJGNI-UHFFFAOYSA-N	-1	0	373.453	2.613	50	0		FFAARM
Cc1ccc(C(=O)N2C[C@@H](c3ccc4c(c3)OCO4)[C@H](C(=O)[O-])C2)cc1	ZINC000091643522	1026930597	/nfs/dbraw/zinc/93/05/97/1026930597.db2.gz	HWPIJRNNJKIPCX-JKSUJKDBSA-N	-1	0	353.374	2.664	50	0		FFAARM
Cc1nc([C@@H](C)N(C)S(=O)(=O)c2ccccc2C(=O)[O-])c(C)s1	ZINC001506397105	1059489600	/nfs/dbraw/zinc/48/96/00/1059489600.db2.gz	YWUUUAVPPXLYLT-SECBINFHSA-N	-1	0	354.453	2.840	50	0		FFAARM
CC(=O)N1CCc2cc(C(=O)N[C@H](CC(=O)[O-])c3ccc(F)cc3)ccc21	ZINC000013257900	203854973	/nfs/dbraw/zinc/85/49/73/203854973.db2.gz	OOPHOHFILVNEIH-QGZVFWFLSA-N	-1	0	370.380	2.681	50	0		FFAARM
C[C@H]1CCc2cc(F)cc3c([O-])c(C(=O)NCc4ccncc4)c(=O)n1c23	ZINC000002355390	204035315	/nfs/dbraw/zinc/03/53/15/204035315.db2.gz	XBZYVYXPWKSSJF-NSHDSACASA-N	-1	0	367.380	2.678	50	0		FFAARM
CCc1ccc(N2C(=O)C[C@H](Sc3ncccc3C(=O)[O-])C2=O)cc1	ZINC000002890067	204066021	/nfs/dbraw/zinc/06/60/21/204066021.db2.gz	RBVQGZPCFNGEKB-AWEZNQCLSA-N	-1	0	356.403	2.766	50	0		FFAARM
COc1cc(OC)cc(C(C)(C)OC(=O)N[C@@H](CCSC)C(=O)[O-])c1	ZINC000002559997	204043608	/nfs/dbraw/zinc/04/36/08/204043608.db2.gz	QCULCVFOTCCMFO-AWEZNQCLSA-N	-1	0	371.455	2.871	50	0		FFAARM
COc1cc(C=O)c(Br)c(I)c1[O-]	ZINC000002766628	204056008	/nfs/dbraw/zinc/05/60/08/204056008.db2.gz	WYZMALSLBNWCHX-UHFFFAOYSA-N	-1	0	356.941	2.580	50	0		FFAARM
CCC[C@H]1CCc2c(sc(NC(=O)CCCC(=O)[O-])c2C(N)=O)C1	ZINC000004124222	204123560	/nfs/dbraw/zinc/12/35/60/204123560.db2.gz	LVBKZTKMCICHRK-JTQLQIEISA-N	-1	0	352.456	2.945	50	0		FFAARM
COc1cc(OC)cc(C(=O)Nc2cc(OC)c(OC)cc2C(=O)[O-])c1	ZINC000004594365	204149403	/nfs/dbraw/zinc/14/94/03/204149403.db2.gz	UCYQSSICCXOZML-UHFFFAOYSA-N	-1	0	361.350	2.672	50	0	biogenic	FFAARM
COc1ccc(C(=O)N[C@H](CC(=O)[O-])c2ccc(OC)c(OC)c2)cc1	ZINC000004689548	204155319	/nfs/dbraw/zinc/15/53/19/204155319.db2.gz	RALWDDQKQRAAGT-OAHLLOKOSA-N	-1	0	359.378	2.658	50	0	biogenic	FFAARM
O=C1NC(c2ccccc2)=N[C@]1([N-]c1ccc(Cl)cn1)C(F)(F)F	ZINC000004718008	204158055	/nfs/dbraw/zinc/15/80/55/204158055.db2.gz	NLTIAFOPZHZEPC-AWEZNQCLSA-N	-1	0	354.719	2.982	50	0		FFAARM
CC(=O)c1[n-]n(-c2ccccc2C)c2c(O)n(-c3ccc(C)cc3)c(=O)c1-2	ZINC000004811405	204165479	/nfs/dbraw/zinc/16/54/79/204165479.db2.gz	QFZJMGYATJXYAD-IEBWSBKVSA-N	-1	0	361.401	2.627	50	0		FFAARM
O=C([O-])Cn1nnc(-c2ccc(OCc3c(F)cccc3Cl)cc2)n1	ZINC000005050503	204188678	/nfs/dbraw/zinc/18/86/78/204188678.db2.gz	XQPLRGNZCMBGGQ-UHFFFAOYSA-N	-1	0	362.748	2.796	50	0		FFAARM
COc1ccc(-c2nc(NC(=O)CSCC(=O)[O-])sc2C)cc1	ZINC000005921683	204230730	/nfs/dbraw/zinc/23/07/30/204230730.db2.gz	NXYDQTDVBUIBNJ-UHFFFAOYSA-N	-1	0	352.437	2.883	50	0		FFAARM
COc1ccccc1[N-]S(=O)(=O)c1ccc2c(c1)C[C@H](C)N2C(C)=O	ZINC000006729995	204263655	/nfs/dbraw/zinc/26/36/55/204263655.db2.gz	BBYHTSJFZJGYIJ-LBPRGKRZSA-N	-1	0	360.435	2.794	50	0		FFAARM
O=C([O-])[C@H]1CCCC[C@@H]1C(=O)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000006742286	204264734	/nfs/dbraw/zinc/26/47/34/204264734.db2.gz	BBIVYBWGMMORSX-IRXDYDNUSA-N	-1	0	364.873	2.875	50	0		FFAARM
O=c1c2[n-][nH]n(Cc3cccc(F)c3)c=2c(=O)n1-c1ccc(F)c(F)c1	ZINC000006770613	204267710	/nfs/dbraw/zinc/26/77/10/204267710.db2.gz	NJSMIBPSWNKKPB-CABCVRRESA-N	-1	0	360.295	2.597	50	0		FFAARM
CCC(=O)c1ccc(OCC(=O)N2Cc3ccccc3C[C@@H]2C(=O)[O-])cc1	ZINC000007786619	204308323	/nfs/dbraw/zinc/30/83/23/204308323.db2.gz	XNWXBBCIZWPVFY-GOSISDBHSA-N	-1	0	367.401	2.696	50	0		FFAARM
O=C([O-])c1cc2c(cc1NC(=O)c1ccc3c(c1)OCCO3)OCCCO2	ZINC000007986582	204313151	/nfs/dbraw/zinc/31/31/51/204313151.db2.gz	KAZBCZFBGGZXAL-UHFFFAOYSA-N	-1	0	371.345	2.570	50	0		FFAARM
Cc1nc(-c2ccccc2)nc(SCCN2CCOCC2)c1C(=O)[O-]	ZINC000009340391	204364435	/nfs/dbraw/zinc/36/44/35/204364435.db2.gz	MAKKBANEYKIZAY-UHFFFAOYSA-N	-1	0	359.451	2.575	50	0		FFAARM
CCc1nc2sc(C(=O)NCC(=O)[O-])c(N)c2c(C(F)(F)F)c1C	ZINC000008748679	204343721	/nfs/dbraw/zinc/34/37/21/204343721.db2.gz	GLDKYRZAGSZPIM-UHFFFAOYSA-N	-1	0	361.345	2.583	50	0		FFAARM
CCOc1cccc(O[C@H]2C[C@@H](C(=O)[O-])N(C(=O)OC(C)(C)C)C2)c1	ZINC000014632525	204584552	/nfs/dbraw/zinc/58/45/52/204584552.db2.gz	GVWFEWSPHMSSBL-GJZGRUSLSA-N	-1	0	351.399	2.927	50	0		FFAARM
COc1ccc([C@H]2CCCN2C(=O)c2ccc(C(=O)[O-])nc2)c(OC)c1	ZINC000298166422	204967291	/nfs/dbraw/zinc/96/72/91/204967291.db2.gz	YUIPROBNNMZQDD-MRXNPFEDSA-N	-1	0	356.378	2.774	50	0		FFAARM
O=C([O-])CN(CC(=O)NCc1ccccc1C(F)(F)F)c1ccccc1	ZINC000034926523	204985907	/nfs/dbraw/zinc/98/59/07/204985907.db2.gz	DBDMUPKKTKKBRO-UHFFFAOYSA-N	-1	0	366.339	2.913	50	0		FFAARM
CC[C@@H](O)[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)[O-]	ZINC000038528959	205040971	/nfs/dbraw/zinc/04/09/71/205040971.db2.gz	VSKJOSVYDOHRGI-QZTJIDSGSA-N	-1	0	355.390	2.749	50	0		FFAARM
O=C([O-])CCNC(=O)c1nc(SCc2ccccc2)ncc1Cl	ZINC000041154684	205090432	/nfs/dbraw/zinc/09/04/32/205090432.db2.gz	WMQRTLGTWZPSCM-UHFFFAOYSA-N	-1	0	351.815	2.627	50	0		FFAARM
O=C([O-])[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1cc(N2CCCC2=O)ccc1F	ZINC000299748983	205129293	/nfs/dbraw/zinc/12/92/93/205129293.db2.gz	ITGQBULXBUWDHJ-JLZZUVOBSA-N	-1	0	374.412	2.810	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)C[C@@H]1CCOC1)c1ccc(Br)cc1	ZINC000299742082	205125119	/nfs/dbraw/zinc/12/51/19/205125119.db2.gz	GTNTZGAZHPDWIT-GWCFXTLKSA-N	-1	0	356.216	2.508	50	0		FFAARM
O=C([O-])[C@@H]1Cc2ccccc2CN1C(=O)c1cnn(Cc2ccccc2)c1	ZINC000299747326	205126330	/nfs/dbraw/zinc/12/63/30/205126330.db2.gz	CQIBXOUGERWXMQ-IBGZPJMESA-N	-1	0	361.401	2.583	50	0		FFAARM
CN(Cc1ccc(C(=O)[O-])cc1)C(=O)[C@H]1CC(=O)N(C)[C@H]1c1cccs1	ZINC000299749482	205131012	/nfs/dbraw/zinc/13/10/12/205131012.db2.gz	KMOPJIKNQUWDKJ-WMLDXEAASA-N	-1	0	372.446	2.624	50	0		FFAARM
Cc1oc(CN(C)C(=O)c2ccc(CN3CCCC3=O)cc2)cc1C(=O)[O-]	ZINC000299751343	205131630	/nfs/dbraw/zinc/13/16/30/205131630.db2.gz	QLSZGFGKVKIEIQ-UHFFFAOYSA-N	-1	0	370.405	2.681	50	0		FFAARM
Cc1nc(-c2cccc(Cl)c2)sc1C(=O)N1CCOC[C@@H]1C(=O)[O-]	ZINC000299750560	205132517	/nfs/dbraw/zinc/13/25/17/205132517.db2.gz	NWOAEPNMAPIYFA-GFCCVEGCSA-N	-1	0	366.826	2.698	50	0		FFAARM
COc1ccc(NC(C)=O)c([N-]S(=O)(=O)c2ccc(F)c(F)c2F)c1	ZINC000057121899	205235324	/nfs/dbraw/zinc/23/53/24/205235324.db2.gz	CXNKTDPGYXTWHL-UHFFFAOYSA-N	-1	0	374.340	2.872	50	0		FFAARM
Cc1ccccc1[N-]S(=O)(=O)c1cc2n(c1)CCN(CC(C)C)C2=O	ZINC000065254804	205330010	/nfs/dbraw/zinc/33/00/10/205330010.db2.gz	QLSYUNBIKKFGNB-UHFFFAOYSA-N	-1	0	361.467	2.709	50	0		FFAARM
CCc1nn2c(nc(C)c2S(=O)(=O)[N-]c2cc(F)ccc2C)s1	ZINC000065183799	205321297	/nfs/dbraw/zinc/32/12/97/205321297.db2.gz	FSNGKEDHIBRASH-UHFFFAOYSA-N	-1	0	354.432	2.910	50	0		FFAARM
CCc1nc2sc(C)nn2c1S(=O)(=O)[N-]c1cc(F)cc(F)c1	ZINC000065183903	205322077	/nfs/dbraw/zinc/32/20/77/205322077.db2.gz	ZDHNOMQDEWCSMS-UHFFFAOYSA-N	-1	0	358.395	2.741	50	0		FFAARM
Cc1n[nH]c(C)c1[C@H](NC(=O)c1ccc2cccc(Cl)c2n1)C(=O)[O-]	ZINC000067654349	205379385	/nfs/dbraw/zinc/37/93/85/205379385.db2.gz	PTVBVGJAZWGIAD-HNNXBMFYSA-N	-1	0	358.785	2.784	50	0		FFAARM
Cc1ccc([N-]S(=O)(=O)c2ccc3c(c2)NC(=O)[C@H](C)CS3)nc1	ZINC000015730619	220162803	/nfs/dbraw/zinc/16/28/03/220162803.db2.gz	DYXQGWRUVRAMRC-LLVKDONJSA-N	-1	0	363.464	2.871	50	0		FFAARM
O=S(=O)([N-]c1cc(-c2ccccc2)on1)c1ccc2c(c1)OCCO2	ZINC000085235201	205662112	/nfs/dbraw/zinc/66/21/12/205662112.db2.gz	CTFFAZZMQXVRQX-UHFFFAOYSA-N	-1	0	358.375	2.914	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)CCc2ccc(O)cc2)C[C@H]1c1cccc(F)c1	ZINC000091933029	205705748	/nfs/dbraw/zinc/70/57/48/205705748.db2.gz	RKIHPZFLQPINFB-ZWKOTPCHSA-N	-1	0	357.381	2.791	50	0		FFAARM
CC(C)n1cnnc1SCC(=O)N[C@H](C(=O)[O-])c1ccc(Cl)cc1	ZINC000095463956	205760882	/nfs/dbraw/zinc/76/08/82/205760882.db2.gz	DAOFTQQWZOJNRC-ZDUSSCGKSA-N	-1	0	368.846	2.547	50	0		FFAARM
Cc1[nH]c2c(cccc2F)c1CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)[O-]	ZINC000095516361	205776832	/nfs/dbraw/zinc/77/68/32/205776832.db2.gz	VMIZOLMAPCXXQR-KRWDZBQOSA-N	-1	0	370.380	2.676	50	0		FFAARM
O=C([O-])[C@@H]1CCCN(C(=O)C2(c3ccccc3Cl)CCOCC2)C1	ZINC000109621858	206060894	/nfs/dbraw/zinc/06/08/94/206060894.db2.gz	QYJUCSBIXPMZOK-CYBMUJFWSA-N	-1	0	351.830	2.711	50	0		FFAARM
COC(=O)c1ccccc1S(=O)(=O)[N-]c1ccc2c(c1)OC(C)(C)O2	ZINC000048332294	206083017	/nfs/dbraw/zinc/08/30/17/206083017.db2.gz	WXWATBZPVHTTIV-UHFFFAOYSA-N	-1	0	363.391	2.781	50	0		FFAARM
CN(Cc1ccc(C(=O)[O-])cc1)C(=O)c1cccc(CN2CCCC2=O)c1	ZINC000237070705	206085273	/nfs/dbraw/zinc/08/52/73/206085273.db2.gz	OPDXXINIFWTLID-UHFFFAOYSA-N	-1	0	366.417	2.779	50	0		FFAARM
O=C([O-])CC1(CC(=O)N[C@H]2CCN(c3ncccc3F)C2)CCCCC1	ZINC000238091654	206112959	/nfs/dbraw/zinc/11/29/59/206112959.db2.gz	XQUFSWMAJBEIJX-AWEZNQCLSA-N	-1	0	363.433	2.731	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)C1CCOCC1)c1ccc(Br)cc1	ZINC000238202081	206114629	/nfs/dbraw/zinc/11/46/29/206114629.db2.gz	BKBQVFXSLUZUHU-ZDUSSCGKSA-N	-1	0	356.216	2.508	50	0		FFAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)[C@H]2COc3ccc(Cl)cc3C2)C1	ZINC000237965140	206111844	/nfs/dbraw/zinc/11/18/44/206111844.db2.gz	UYWQRDVXUKKWFN-GXTWGEPZSA-N	-1	0	351.830	2.995	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)C[C@@H]1CCCO1)c1cccc(Br)c1	ZINC000237936033	206111902	/nfs/dbraw/zinc/11/19/02/206111902.db2.gz	KXSSFYQDWFKMQP-STQMWFEESA-N	-1	0	356.216	2.650	50	0		FFAARM
O=C([O-])c1ccc(CNC(=O)C2(c3cccc(F)c3)CCOCC2)cc1	ZINC000238106176	206112544	/nfs/dbraw/zinc/11/25/44/206112544.db2.gz	OWFMURIDSCPIQA-UHFFFAOYSA-N	-1	0	357.381	2.889	50	0		FFAARM
CSCC[C@@H](NC(=O)C1(NC(=O)OC(C)(C)C)CCCCC1)C(=O)[O-]	ZINC000004023199	206164334	/nfs/dbraw/zinc/16/43/34/206164334.db2.gz	OTYYNVTUJGDDBX-GFCCVEGCSA-N	-1	0	374.503	2.537	50	0	biogenic	FFAARM
O=C([O-])[C@@H]1[C@H]2C=C[C@]3(CN(C(c4ccccc4)c4ccccc4)C(=O)[C@H]13)O2	ZINC000005219309	206190947	/nfs/dbraw/zinc/19/09/47/206190947.db2.gz	QDKJBAZDSXUQIO-QSNWEANLSA-N	-1	0	361.397	2.643	50	0		FFAARM
CCc1nc2sc([C@H](c3cccs3)N3CCC(O)CC3)c([O-])n2n1	ZINC000004585192	206178923	/nfs/dbraw/zinc/17/89/23/206178923.db2.gz	PSKVZQXLXTVOGA-ZDUSSCGKSA-N	-1	0	364.496	2.666	50	0		FFAARM
COc1ccc(NS(=O)(=O)c2cc(C(=O)[O-])cc(C)c2C)cc1OC	ZINC000008105842	206246212	/nfs/dbraw/zinc/24/62/12/206246212.db2.gz	VXIKHJCTZWDLFB-UHFFFAOYSA-N	-1	0	365.407	2.820	50	0		FFAARM
O=C([O-])c1cc(S(=O)(=O)NCc2ccccc2)ccc1Br	ZINC000004636306	206238936	/nfs/dbraw/zinc/23/89/36/206238936.db2.gz	ILPCMKHMYPICTQ-UHFFFAOYSA-N	-1	0	370.224	2.626	50	0		FFAARM
C[S@@](=O)C[C@H](NC(=O)c1ccc2[n-]c(=S)oc2c1)c1ccccc1	ZINC000170649101	206278142	/nfs/dbraw/zinc/27/81/42/206278142.db2.gz	KWDZMZFXSKQPSO-LFPIHBKWSA-N	-1	0	360.460	2.966	50	0		FFAARM
Cc1cc(C)cc(-n2nnnc2SCc2nc(=O)c3sccc3[n-]2)c1	ZINC000012680838	206295059	/nfs/dbraw/zinc/29/50/59/206295059.db2.gz	RAOSJWWCYKEXKV-UHFFFAOYSA-N	-1	0	370.463	2.869	50	0		FFAARM
COc1ccc(Br)cc1/C=C/C(=O)N1CCC(C(=O)[O-])CC1	ZINC000013167328	206301848	/nfs/dbraw/zinc/30/18/48/206301848.db2.gz	DUGPPQIBJHWIND-GORDUTHDSA-N	-1	0	368.227	2.794	50	0		FFAARM
C[C@@H]1CN([C@H](c2sc3ncnn3c2[O-])c2ccc(F)cc2)C[C@H](C)O1	ZINC000017246942	206322764	/nfs/dbraw/zinc/32/27/64/206322764.db2.gz	BESIFSPXZFVYLU-WDMOLILDSA-N	-1	0	362.430	2.834	50	0		FFAARM
O=C([O-])c1cccnc1SCC(=O)Nc1ccc(C(F)(F)F)cn1	ZINC000215725053	206349663	/nfs/dbraw/zinc/34/96/63/206349663.db2.gz	ZAGKZAONJWUCLA-UHFFFAOYSA-N	-1	0	357.313	2.924	50	0		FFAARM
CCc1nc2sc([C@@H](c3ccc(C)cc3)N3CCN(C)CC3)c([O-])n2n1	ZINC000022577878	206378926	/nfs/dbraw/zinc/37/89/26/206378926.db2.gz	XGKXOOAIEPFJHG-MRXNPFEDSA-N	-1	0	371.510	2.704	50	0		FFAARM
C[C@@H]1CN([C@H](c2sc3ncnn3c2[O-])c2ccc(F)cc2)C[C@@H](C)O1	ZINC000022609698	206388450	/nfs/dbraw/zinc/38/84/50/206388450.db2.gz	BESIFSPXZFVYLU-GYSYKLTISA-N	-1	0	362.430	2.834	50	0		FFAARM
NC(=O)Nc1cccc([N-]S(=O)(=O)c2ccccc2Br)c1	ZINC000029322794	206488097	/nfs/dbraw/zinc/48/80/97/206488097.db2.gz	DFEVKHNHUXPECT-UHFFFAOYSA-N	-1	0	370.228	2.741	50	0		FFAARM
O=C([O-])Cc1ccc(S(=O)(=O)N2C[C@@H]3CCC(=O)c4cccc2c43)cc1	ZINC000274291150	255859018	/nfs/dbraw/zinc/85/90/18/255859018.db2.gz	KHNIJHRYRMZQEZ-ZDUSSCGKSA-N	-1	0	371.414	2.583	50	0		FFAARM
COc1cccc(N2CCN(C(=O)c3ccc([O-])c(Cl)c3)CC2=O)c1	ZINC000082096996	132194622	/nfs/dbraw/zinc/19/46/22/132194622.db2.gz	SLGCFISSJFHRAL-UHFFFAOYSA-N	-1	0	360.797	2.543	50	0		FFAARM
Cc1cccc2[nH]c([C@H]3CCCN(c4ncncc4CC(=O)[O-])C3)nc21	ZINC000095363779	132208171	/nfs/dbraw/zinc/20/81/71/132208171.db2.gz	RRXAKMJIUZIQAN-ZDUSSCGKSA-N	-1	0	351.410	2.672	50	0		FFAARM
COc1ccc(F)c(CN2CCN(c3ccc(C(=O)[O-])cc3)CC2)c1F	ZINC000097505639	132229273	/nfs/dbraw/zinc/22/92/73/132229273.db2.gz	STLZQFDWXNOSTG-UHFFFAOYSA-N	-1	0	362.376	2.994	50	0		FFAARM
O=C([O-])C1CCN(c2nc3ccsc3c(=O)n2Cc2ccccc2)CC1	ZINC000033268124	136117659	/nfs/dbraw/zinc/11/76/59/136117659.db2.gz	FMJREPXOOBXTFT-UHFFFAOYSA-N	-1	0	369.446	2.807	50	0		FFAARM
C[C@H]1CCCCN1c1ccc(C(N)=O)cc1NC(=O)c1ncccc1[O-]	ZINC000055224723	136126168	/nfs/dbraw/zinc/12/61/68/136126168.db2.gz	BUFFDFVGGRSSBG-LBPRGKRZSA-N	-1	0	354.410	2.517	50	0		FFAARM
Cc1cccc(OCC(=O)NC(=S)Nc2cccc(C(=O)[O-])c2C)c1	ZINC000001159465	263143386	/nfs/dbraw/zinc/14/33/86/263143386.db2.gz	WGVYJLKVHMANRD-UHFFFAOYSA-N	-1	0	358.419	2.894	50	0		FFAARM
O=C([O-])[C@@]1(NC(=O)OCC2c3ccccc3-c3ccccc32)CC[C@H](O)C1	ZINC000002583467	263326058	/nfs/dbraw/zinc/32/60/58/263326058.db2.gz	FPTJRPYTKCYJLR-YEJXKQKISA-N	-1	0	367.401	2.893	50	0		FFAARM
O=C([O-])Cn1cnc2scc(-c3ccc(Br)cc3)c2c1=O	ZINC000000952356	506239843	/nfs/dbraw/zinc/23/98/43/506239843.db2.gz	OYGYCAINVYZWQY-UHFFFAOYSA-N	-1	0	365.208	2.972	50	0		FFAARM
O=C(NCC1CC1)c1ccccc1[N-]S(=O)(=O)c1ccc(F)cc1F	ZINC000001042616	506246155	/nfs/dbraw/zinc/24/61/55/506246155.db2.gz	HEXBDMBQXISLNJ-UHFFFAOYSA-N	-1	0	366.389	2.905	50	0		FFAARM
CCc1cccc([N-]S(=O)(=O)c2cc3n(c2)CCCN(CC)C3=O)c1	ZINC000065258760	506277668	/nfs/dbraw/zinc/27/76/68/506277668.db2.gz	LCYPGVIQJWTZFS-UHFFFAOYSA-N	-1	0	361.467	2.717	50	0		FFAARM
Cc1cc(C)[nH]c(=N[N-]S(=O)(=O)c2cc(Cl)sc2Cl)n1	ZINC000032717107	506282300	/nfs/dbraw/zinc/28/23/00/506282300.db2.gz	ZJBWLMZTMLBCTN-UHFFFAOYSA-N	-1	0	353.256	2.767	50	0		FFAARM
CCc1nc2[n-]c(C)nn2c(=O)c1NC(=O)Nc1cc(C)ccc1OC	ZINC000033266187	506353912	/nfs/dbraw/zinc/35/39/12/506353912.db2.gz	AOUGXHHQNMUPCK-UHFFFAOYSA-N	-1	0	356.386	2.662	50	0		FFAARM
CSCC[C@H](NC(=O)N1CCC(Cc2ccccc2)CC1)C(=O)[O-]	ZINC000005253298	506432242	/nfs/dbraw/zinc/43/22/42/506432242.db2.gz	CIHKCSYQCSTYMH-INIZCTEOSA-N	-1	0	350.484	2.857	50	0		FFAARM
O=C([O-])CCc1cn(CC2CCN(C(=O)C3CCCCCC3)CC2)nn1	ZINC000055153010	506686943	/nfs/dbraw/zinc/68/69/43/506686943.db2.gz	IFSCIWYPNPKQKB-UHFFFAOYSA-N	-1	0	362.474	2.504	50	0		FFAARM
COc1cc2c(cc1OC)CN(C(=O)Nc1ccc(C(=O)[O-])cc1)CC2	ZINC000011766985	506792375	/nfs/dbraw/zinc/79/23/75/506792375.db2.gz	LVUQPUZWXVZLNT-UHFFFAOYSA-N	-1	0	356.378	2.992	50	0	biogenic	FFAARM
COc1ccc([C@@H](CC(=O)[O-])NC(=O)[C@@H]2COc3ccccc3C2)cc1	ZINC000013427428	506941648	/nfs/dbraw/zinc/94/16/48/506941648.db2.gz	VPVQFLCASGYOGY-DOTOQJQBSA-N	-1	0	355.390	2.579	50	0		FFAARM
COc1ccc(-c2noc(COc3ccc(CC(=O)[O-])cc3)n2)c(OC)c1	ZINC000013421388	506942005	/nfs/dbraw/zinc/94/20/05/506942005.db2.gz	ZYIAZLSZQMLXAI-UHFFFAOYSA-N	-1	0	370.361	2.960	50	0		FFAARM
O=C([O-])[C@@H]1CC=CC[C@@H]1C(=O)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000013737109	506956401	/nfs/dbraw/zinc/95/64/01/506956401.db2.gz	MKUFWNNCCCXWQI-DLBZAZTESA-N	-1	0	362.857	2.651	50	0		FFAARM
Cc1ccc(C)c(-c2n[nH]cc2[C@H]2CC(=O)Nc3[nH]nc(C(=O)[O-])c32)c1	ZINC000067921593	507051838	/nfs/dbraw/zinc/05/18/38/507051838.db2.gz	MIUGAABLISTNQN-LLVKDONJSA-N	-1	0	351.366	2.589	50	0		FFAARM
COc1cccc(N2CCN(Cc3ccccc3C(=O)[O-])[C@H](C)C2=O)c1	ZINC000067975577	507074745	/nfs/dbraw/zinc/07/47/45/507074745.db2.gz	HWRGBEOABMBFGX-CQSZACIVSA-N	-1	0	354.406	2.631	50	0		FFAARM
O=C([O-])C1CCN(C(=O)c2nccnc2-c2nc3ccccc3s2)CC1	ZINC000016780001	507107707	/nfs/dbraw/zinc/10/77/07/507107707.db2.gz	GXWONGMYBPMSOS-UHFFFAOYSA-N	-1	0	368.418	2.690	50	0		FFAARM
CCCCC1C(=O)N=C(SCC(=O)Nc2ccccc2OC)N=C1[O-]	ZINC000017198133	507118645	/nfs/dbraw/zinc/11/86/45/507118645.db2.gz	CYKAJFMFWXVZSD-UHFFFAOYSA-N	-1	0	363.439	2.558	50	0		FFAARM
Cc1cc(F)ccc1[N-]S(=O)(=O)c1ccc(-c2ccc(=O)[nH]n2)s1	ZINC000020574756	507226605	/nfs/dbraw/zinc/22/66/05/507226605.db2.gz	UFLQFNOIFQXLGU-UHFFFAOYSA-N	-1	0	365.411	2.747	50	0		FFAARM
COc1cc(C)c(S(=O)(=O)Nc2cccc(C(=O)[O-])c2)cc1OC	ZINC000026527717	507593945	/nfs/dbraw/zinc/59/39/45/507593945.db2.gz	UEVPUHZZHBBIJD-UHFFFAOYSA-N	-1	0	351.380	2.511	50	0		FFAARM
CCCCC[C@H](O)/C=C/[C@H]1O[C@H](O)C[C@H](O)[C@H]1C/C=C\CCCC(=O)[O-]	ZINC000071756356	507713003	/nfs/dbraw/zinc/71/30/03/507713003.db2.gz	XNRNNGPBEPRNAR-HKNQZBHFSA-N	-1	0	370.486	2.769	50	0		FFAARM
CCOC(=O)c1csc(=NC(=O)c2nc(C)sc2CC(C)C)[n-]1	ZINC000072403961	507782944	/nfs/dbraw/zinc/78/29/44/507782944.db2.gz	WNFYLMUWKLDLRW-UHFFFAOYSA-N	-1	0	353.469	3.536	50	0		FFAARM
CCc1nccc(CN2CCC(Oc3ccccc3F)(C(=O)[O-])CC2)n1	ZINC000072421950	507787719	/nfs/dbraw/zinc/78/77/19/507787719.db2.gz	PTOJBLKISPOGDG-UHFFFAOYSA-N	-1	0	359.401	2.676	50	0		FFAARM
CC(C)(C)c1ccn(C2(C(=O)[O-])CCN(C(=O)C[C@H]3C=CCC3)CC2)n1	ZINC000072453507	507793481	/nfs/dbraw/zinc/79/34/81/507793481.db2.gz	QCLUQIFNXVUMAD-HNNXBMFYSA-N	-1	0	359.470	2.939	50	0		FFAARM
COc1ccc(NC(=O)CC2(C(=O)[O-])CCCC2)cc1N1CCCC1=O	ZINC000030521923	507809973	/nfs/dbraw/zinc/80/99/73/507809973.db2.gz	OZYPGMFGUDZBTA-UHFFFAOYSA-N	-1	0	360.410	2.796	50	0		FFAARM
CCC[C@@]1(C(=O)[O-])CCCN(C(=O)c2cc(=O)[nH]c3cc(F)ccc32)C1	ZINC000091350804	507982381	/nfs/dbraw/zinc/98/23/81/507982381.db2.gz	NCFJKGWKIYLQIS-LJQANCHMSA-N	-1	0	360.385	2.774	50	0		FFAARM
Cc1cc(C)c(S(=O)(=O)[N-]c2ccc(N3CCOCC3)cn2)c(C)c1	ZINC000110121491	508008774	/nfs/dbraw/zinc/00/87/74/508008774.db2.gz	TZJGGJCEEFOASU-UHFFFAOYSA-N	-1	0	361.467	2.644	50	0		FFAARM
Cc1nn(CC(=O)N2CCC[C@@H](c3ccc(C(=O)[O-])cc3)C2)c(C)c1C	ZINC000095360302	508175770	/nfs/dbraw/zinc/17/57/70/508175770.db2.gz	OAXLTBHNBSBSCM-GOSISDBHSA-N	-1	0	355.438	2.913	50	0		FFAARM
CN(CC(=O)N1CCC[C@H](c2ccc(C(=O)[O-])cc2)C1)Cc1cccnc1	ZINC000095384262	508182184	/nfs/dbraw/zinc/18/21/84/508182184.db2.gz	MIRQVKPBWNQYDN-IBGZPJMESA-N	-1	0	367.449	2.618	50	0		FFAARM
COc1ccc(Cn2cc([C@H](C(=O)[O-])N(C)Cc3cccnc3)cn2)cc1	ZINC000095389461	508183828	/nfs/dbraw/zinc/18/38/28/508183828.db2.gz	WQXQHTNDFDEQMD-LJQANCHMSA-N	-1	0	366.421	2.593	50	0		FFAARM
CCOC(=O)c1csc(=NC(=O)c2ccc3ccn(CCOC)c3c2)[n-]1	ZINC000095479551	508189084	/nfs/dbraw/zinc/18/90/84/508189084.db2.gz	NQYHMNSVBTXQTN-UHFFFAOYSA-N	-1	0	373.434	3.173	50	0		FFAARM
CC(C)(NC(=O)c1cc(-c2ccccc2)c(N2CCOCC2)s1)C(=O)[O-]	ZINC000095969793	508200129	/nfs/dbraw/zinc/20/01/29/508200129.db2.gz	MMBNNHWSKPXQOR-UHFFFAOYSA-N	-1	0	374.462	2.845	50	0		FFAARM
COC(=O)[C@H]1Oc2c(c(=O)oc3ccccc23)[C@@H]1c1ccc(C(=O)[O-])cc1	ZINC000096335820	508213556	/nfs/dbraw/zinc/21/35/56/508213556.db2.gz	DLNHLZWTNXWJPT-YOEHRIQHSA-N	-1	0	366.325	2.557	50	0		FFAARM
COc1cc(/C=C2/N=C(c3cccc(F)c3)OC2=O)ccc1OCC(=O)[O-]	ZINC000096892167	508215808	/nfs/dbraw/zinc/21/58/08/508215808.db2.gz	STMULLWLXLVUAT-VGOFMYFVSA-N	-1	0	371.320	2.642	50	0		FFAARM
COc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccccc4)c=3c2=O)cc1Cl	ZINC000101168554	508240897	/nfs/dbraw/zinc/24/08/97/508240897.db2.gz	TVLMVWSDOOYSDP-HOTGVXAUSA-N	-1	0	370.796	2.842	50	0		FFAARM
C[C@H]1CCCC[C@H]1NC(=O)CSc1nc(=O)cc([O-])n1C1CCCC1	ZINC000102137533	508268221	/nfs/dbraw/zinc/26/82/21/508268221.db2.gz	VIRVFJULUIPRBD-GXTWGEPZSA-N	-1	0	365.499	2.851	50	0		FFAARM
CCCC[C@@H]1C(=O)N(C)CCN1Cc1cc(Cl)ccc1OCC(=O)[O-]	ZINC000077471946	508320427	/nfs/dbraw/zinc/32/04/27/508320427.db2.gz	BLTQUPJCMKOEGN-OAHLLOKOSA-N	-1	0	368.861	2.636	50	0		FFAARM
Cc1cc(S(C)(=O)=O)c(C)c(S(=O)(=O)[N-]c2ccc(C)nc2C)c1	ZINC000128745830	508638214	/nfs/dbraw/zinc/63/82/14/508638214.db2.gz	YLTPRGZSUJYSSF-UHFFFAOYSA-N	-1	0	368.480	2.520	50	0		FFAARM
COc1ccc(-c2cnc(CCC(=O)N3CCC[C@@H](C(=O)[O-])C3)o2)cc1	ZINC000136160681	508675703	/nfs/dbraw/zinc/67/57/03/508675703.db2.gz	FHEQCQCDRXTIHW-CQSZACIVSA-N	-1	0	358.394	2.606	50	0		FFAARM
CCC(CC)(CNC(=O)C[C@@H]1c2ccccc2C=CN1C(C)=O)C(=O)[O-]	ZINC000236846076	509517291	/nfs/dbraw/zinc/51/72/91/509517291.db2.gz	BFMCYTJWDOBHNV-QGZVFWFLSA-N	-1	0	358.438	2.958	50	0		FFAARM
CCOc1ccc(-c2nc(CC(=O)N3CC[C@H](C(=O)[O-])C3)cs2)cc1	ZINC000236869826	509520519	/nfs/dbraw/zinc/52/05/19/509520519.db2.gz	HUILBNKVXUANDI-ZDUSSCGKSA-N	-1	0	360.435	2.684	50	0		FFAARM
CCO[C@@H](C)c1nc(CC(=O)N2Cc3ccccc3C[C@@H]2C(=O)[O-])cs1	ZINC000237037327	509556501	/nfs/dbraw/zinc/55/65/01/509556501.db2.gz	KOMLTUODQSJEAM-BLLLJJGKSA-N	-1	0	374.462	2.821	50	0		FFAARM
C[C@H](Oc1ccccc1Br)C(=O)N1CCC(C(=O)[O-])CC1	ZINC000237675386	509708191	/nfs/dbraw/zinc/70/81/91/509708191.db2.gz	HVJOPQMLVOMJSW-JTQLQIEISA-N	-1	0	356.216	2.540	50	0		FFAARM
Cc1nc(-c2ccc3c(c2)CCN3C(=O)CN2CCC[C@@H]2C(=O)[O-])cs1	ZINC000237696846	509713707	/nfs/dbraw/zinc/71/37/07/509713707.db2.gz	GNBNWSLPRQTNTO-QGZVFWFLSA-N	-1	0	371.462	2.557	50	0		FFAARM
CN(c1ccccc1)S(=O)(=O)[N-]C(=O)CCc1cccc(Cl)c1	ZINC000252491580	509842341	/nfs/dbraw/zinc/84/23/41/509842341.db2.gz	LOAQGNJNLLJUQK-UHFFFAOYSA-N	-1	0	352.843	2.770	50	0		FFAARM
COc1ccc(C(C)(C)C)cc1S(=O)(=O)[N-]c1ccccc1C(N)=O	ZINC000252506352	509845810	/nfs/dbraw/zinc/84/58/10/509845810.db2.gz	VZYVNKPEMGXFGA-UHFFFAOYSA-N	-1	0	362.451	2.892	50	0		FFAARM
COc1cccc2cc(C(N)=O)c(=Nc3cccc(/C=C/C(=O)[O-])c3)oc21	ZINC000252640200	509856358	/nfs/dbraw/zinc/85/63/58/509856358.db2.gz	YREGUCCVYVBXOV-HYHZBMSMSA-N	-1	0	364.357	2.871	50	0		FFAARM
CCOC(=O)c1ccc2nc(NC(=O)[C@@H]3CC[C@@H](C(=O)[O-])C3)sc2c1	ZINC000253473056	509884545	/nfs/dbraw/zinc/88/45/45/509884545.db2.gz	REMWYSZLJZYGFU-NXEZZACHSA-N	-1	0	362.407	2.912	50	0		FFAARM
O=C(N[C@@H](c1ccccn1)[C@H]1C[C@@H](O)C1)c1cc(=O)c2cccc(F)c2[n-]1	ZINC000253535335	509885593	/nfs/dbraw/zinc/88/55/93/509885593.db2.gz	UIAVMWHPESVTAT-FTLABTOESA-N	-1	0	367.380	2.717	50	0		FFAARM
CC[C@@](C)(NC(=O)c1cccc(C(=O)N(C)c2ccccc2)c1)C(=O)[O-]	ZINC000262506292	510302555	/nfs/dbraw/zinc/30/25/55/510302555.db2.gz	ZYQGNZCRMXBVBX-HXUWFJFHSA-N	-1	0	354.406	2.946	50	0		FFAARM
C[C@H](c1ccccc1)N1C[C@H](C(=O)Nc2cccc(CC(=O)[O-])c2)CC1=O	ZINC000263144417	510583487	/nfs/dbraw/zinc/58/34/87/510583487.db2.gz	KETJNWHZLTUWRN-RHSMWYFYSA-N	-1	0	366.417	2.862	50	0		FFAARM
Cc1cc2ncc(C(=O)N[C@@H](C(=O)[O-])c3cccc(C)c3C)c(C)n2n1	ZINC000263148757	510585858	/nfs/dbraw/zinc/58/58/58/510585858.db2.gz	URDLAGVMLDEFCG-QGZVFWFLSA-N	-1	0	352.394	2.519	50	0		FFAARM
O=C([O-])CCN(C[C@@H]1CCCO1)C(=O)[C@@H]1C[C@H]1c1cccc(F)c1F	ZINC000408513243	513083618	/nfs/dbraw/zinc/08/36/18/513083618.db2.gz	FGULFEMWQFQOKV-FPMFFAJLSA-N	-1	0	353.365	2.551	50	0		FFAARM
O=C([O-])[C@@H]1CCCN(C(=O)C2(c3cccc(Br)c3)CC2)C1	ZINC000268942379	526271989	/nfs/dbraw/zinc/27/19/89/526271989.db2.gz	MNMQYBGYNYNJLA-LLVKDONJSA-N	-1	0	352.228	2.804	50	0		FFAARM
Cc1nn(-c2ccccc2)c(Cl)c1/C=C/C(=O)N1CC[C@@H](C(=O)[O-])C1	ZINC000178267902	527546508	/nfs/dbraw/zinc/54/65/08/527546508.db2.gz	DLNIBFNUYGHJBE-SBDDDAINSA-N	-1	0	359.813	2.780	50	0		FFAARM
O=C([O-])C[C@@H]1CN(C(=O)c2ccc(COc3ccccc3)cc2)CCO1	ZINC000262828146	527629702	/nfs/dbraw/zinc/62/97/02/527629702.db2.gz	RTILCCQGDFPWCZ-GOSISDBHSA-N	-1	0	355.390	2.581	50	0		FFAARM
CC1(C)[C@@H](C(=O)[O-])[C@@H]1C(=O)Nc1ccc2c(c1)N(C(=O)C1CC1)CCC2	ZINC000071285603	535015619	/nfs/dbraw/zinc/01/56/19/535015619.db2.gz	NHAQLKDPSRCBOA-HZPDHXFCSA-N	-1	0	356.422	2.671	50	0		FFAARM
C[C@@H](OC1CCCCCC1)C(=O)[N-]S(=O)(=O)c1ccc(Cl)cn1	ZINC000120156954	570542647	/nfs/dbraw/zinc/54/26/47/570542647.db2.gz	TVVQDWZNMZLTIU-LLVKDONJSA-N	-1	0	360.863	2.668	50	0		FFAARM
CCOc1cccc(CNC(=O)c2ccc3c(c2)[n-]c(=S)n(C)c3=O)c1	ZINC000103545000	570851447	/nfs/dbraw/zinc/85/14/47/570851447.db2.gz	XJEVXOQHEFFDIN-UHFFFAOYSA-N	-1	0	369.446	2.551	50	0		FFAARM
CCCS(=O)(=O)[N-]C(=O)Cn1c(C)c(Br)c2ccccc21	ZINC000122796045	571182207	/nfs/dbraw/zinc/18/22/07/571182207.db2.gz	CGQPRHIFQDKRAJ-UHFFFAOYSA-N	-1	0	373.272	2.568	50	0		FFAARM
Cc1cc2ncc(C(=O)N[C@@H](c3ccccc3)[C@@H](C)C(=O)[O-])c(C)n2n1	ZINC000262544430	601169240	/nfs/dbraw/zinc/16/92/40/601169240.db2.gz	VPRSZWIAUXAALY-SJKOYZFVSA-N	-1	0	352.394	2.538	50	0		FFAARM
COc1c(C)cc([C@@H](C(=O)[O-])N2CCN(CC(F)(F)F)CC2)cc1C	ZINC001529142882	1062184797	/nfs/dbraw/zinc/18/47/97/1062184797.db2.gz	UUCMBGOZLWQWFV-AWEZNQCLSA-N	-1	0	360.376	2.618	50	0		FFAARM
O=C([O-])[C@@H]1CCCCN1C(=O)c1nc(C2CC2)n(-c2ccccc2Cl)n1	ZINC000136522484	203818925	/nfs/dbraw/zinc/81/89/25/203818925.db2.gz	PSTMXDYTLQLCMF-AWEZNQCLSA-N	-1	0	374.828	2.877	50	0		FFAARM
COc1ccc2c(c1)n(C)c(-c1ccc3c(c1)OCO3)c(C(=O)[O-])c2=O	ZINC000000717515	203945509	/nfs/dbraw/zinc/94/55/09/203945509.db2.gz	YYEDAJVLXGRLBG-UHFFFAOYSA-N	-1	0	353.330	2.641	50	0		FFAARM
COc1ccc([C@H](CC(=O)[O-])NC(=O)c2ccc(OC)c(OC)c2)cc1	ZINC000001470745	204009239	/nfs/dbraw/zinc/00/92/39/204009239.db2.gz	GTAHVMZWPGIQBI-HNNXBMFYSA-N	-1	0	359.378	2.658	50	0	biogenic	FFAARM
CCn1ncc(S(=O)(=O)[N-]c2ccn(Cc3ccccc3C)n2)c1C	ZINC000002804646	204059075	/nfs/dbraw/zinc/05/90/75/204059075.db2.gz	KLSRLYRSVBSSAP-UHFFFAOYSA-N	-1	0	359.455	2.565	50	0		FFAARM
CCN1C(=O)S/C(=C\c2ccc(O[C@H](C)C(=O)[O-])c(OC)c2)C1=O	ZINC000003672816	204111012	/nfs/dbraw/zinc/11/10/12/204111012.db2.gz	MSHCZQFUCBHKIN-PGEKAQRJSA-N	-1	0	351.380	2.603	50	0		FFAARM
[NH3+][C@](CC1c2ccccc2Oc2ccccc21)(C(=O)[O-])[C@H]1C[C@@H]1C(=O)[O-]	ZINC000003826602	204112232	/nfs/dbraw/zinc/11/22/32/204112232.db2.gz	VLZBRVJVCCNPRJ-KPHUOKFYSA-N	-1	0	353.374	2.817	50	0	in-vivo	FFAARM
NC(=O)c1c(NC(=O)[C@@H]2CCCC[C@@H]2C(=O)[O-])sc2c1CCCCC2	ZINC000004150409	204124607	/nfs/dbraw/zinc/12/46/07/204124607.db2.gz	JTUBJJWMUUKQGL-MNOVXSKESA-N	-1	0	364.467	2.945	50	0		FFAARM
COc1ccc(C)cc1[N-]S(=O)(=O)c1ccc(OC)c(NC(C)=O)c1	ZINC000004742685	204159887	/nfs/dbraw/zinc/15/98/87/204159887.db2.gz	XPWPSZQHXJUJIM-UHFFFAOYSA-N	-1	0	364.423	2.771	50	0		FFAARM
Cc1ccc(C(=O)N/C(=C/c2ccccc2)C(=O)NCCCC(=O)[O-])cc1	ZINC000004351245	204133934	/nfs/dbraw/zinc/13/39/34/204133934.db2.gz	WMTLDVAKKNVUNY-NBVRZTHBSA-N	-1	0	366.417	2.747	50	0	biogenic	FFAARM
COc1cccc(Cn2[nH][n-]c3c(=O)n(-c4ccc(Cl)cc4)c(=O)c2=3)c1	ZINC000004483462	204140741	/nfs/dbraw/zinc/14/07/41/204140741.db2.gz	STYUSGHAVRJFAX-CVEARBPZSA-N	-1	0	370.796	2.842	50	0		FFAARM
COc1cc2c(cc1OC)[C@H](C(=O)[O-])[C@@H](c1ccccc1OC)N(C)C2=O	ZINC000004563444	204146846	/nfs/dbraw/zinc/14/68/46/204146846.db2.gz	RTULEOKBRLRJCC-ZWKOTPCHSA-N	-1	0	371.389	2.708	50	0		FFAARM
NC(=O)c1ccc([N-]S(=O)(=O)c2c(F)cc(F)c(Cl)c2F)cc1	ZINC000005602207	204216889	/nfs/dbraw/zinc/21/68/89/204216889.db2.gz	VTCSRQFOUFSZIU-UHFFFAOYSA-N	-1	0	364.732	2.657	50	0		FFAARM
O=C(NC1CC1)c1cccc([N-]S(=O)(=O)c2ccc(F)cc2F)c1	ZINC000007325518	204295485	/nfs/dbraw/zinc/29/54/85/204295485.db2.gz	QYASDPJXVNUBDB-UHFFFAOYSA-N	-1	0	352.362	2.658	50	0		FFAARM
CC(=O)N1CCc2cc(S(=O)(=O)[N-]c3cccc4cccnc43)ccc21	ZINC000007325375	204295790	/nfs/dbraw/zinc/29/57/90/204295790.db2.gz	GBGJKDPSLIZSIO-UHFFFAOYSA-N	-1	0	367.430	2.945	50	0		FFAARM
CC1CCN(C(=O)C(=O)Nc2sc3c(c2C(=O)[O-])CCCC3)CC1	ZINC000006759386	204266782	/nfs/dbraw/zinc/26/67/82/204266782.db2.gz	FCUUFEXUWKQVGI-UHFFFAOYSA-N	-1	0	350.440	2.522	50	0		FFAARM
CCc1ccccc1[N-]S(=O)(=O)c1c(C)nc2scc(C)n2c1=O	ZINC000006784763	204270768	/nfs/dbraw/zinc/27/07/68/204270768.db2.gz	GYAFYVKJJLKRHX-UHFFFAOYSA-N	-1	0	363.464	2.736	50	0		FFAARM
COc1ccc(Cl)cc1S(=O)(=O)[N-]c1ccc2c(c1)COC2=O	ZINC000006784624	204270971	/nfs/dbraw/zinc/27/09/71/204270971.db2.gz	ILVZGBZQYKTVBT-UHFFFAOYSA-N	-1	0	353.783	2.820	50	0		FFAARM
CCOC(=O)c1cc(S(=O)(=O)[N-]c2ccc(F)c(Cl)c2)cn1C	ZINC000006800613	204271163	/nfs/dbraw/zinc/27/11/63/204271163.db2.gz	AEPPJDAYTXIQKC-UHFFFAOYSA-N	-1	0	360.794	2.795	50	0		FFAARM
COc1cc(S(=O)(=O)[N-]c2cccnc2)c(C)cc1Br	ZINC000007428391	204297943	/nfs/dbraw/zinc/29/79/43/204297943.db2.gz	MFUSCNDVOBQRJF-UHFFFAOYSA-N	-1	0	357.229	2.962	50	0		FFAARM
Cc1ccc([N-]S(=O)(=O)c2c(C)nc3sccn3c2=O)cc1Cl	ZINC000006822859	204275163	/nfs/dbraw/zinc/27/51/63/204275163.db2.gz	DXTVGCWPIJQNJF-UHFFFAOYSA-N	-1	0	369.855	2.827	50	0		FFAARM
O=C1CCCN1c1ccccc1[N-]S(=O)(=O)c1cc(F)ccc1F	ZINC000007726695	204304055	/nfs/dbraw/zinc/30/40/55/204304055.db2.gz	MSDCTMYVZXZVQJ-UHFFFAOYSA-N	-1	0	352.362	2.892	50	0		FFAARM
COC(=O)c1sccc1S(=O)(=O)[N-]c1ccccc1OC(F)F	ZINC000009338380	204363247	/nfs/dbraw/zinc/36/32/47/204363247.db2.gz	KGGUGSGOKPDKCU-UHFFFAOYSA-N	-1	0	363.363	2.937	50	0		FFAARM
CCS(=O)(=O)c1ccc([O-])c(NC(=O)CCCOc2ccccc2)c1	ZINC000009387596	204366406	/nfs/dbraw/zinc/36/64/06/204366406.db2.gz	IPWYNVPQQBKOHP-UHFFFAOYSA-N	-1	0	363.435	2.984	50	0		FFAARM
Cc1cc(Cl)ccc1[N-]S(=O)(=O)c1ccc(-c2ccc(=O)[nH]n2)o1	ZINC000015728258	204617739	/nfs/dbraw/zinc/61/77/39/204617739.db2.gz	QMDSTHISVGRQTR-UHFFFAOYSA-N	-1	0	365.798	2.793	50	0		FFAARM
CCOc1ccc(N[C@@H]2CC(=O)N(c3cccc(C(=O)[O-])c3)C2=O)cc1	ZINC000016900994	204643401	/nfs/dbraw/zinc/64/34/01/204643401.db2.gz	KCWHBKNMEQOJJT-MRXNPFEDSA-N	-1	0	354.362	2.528	50	0		FFAARM
COc1ccc(-c2ccc(S(=O)(=O)N3CCC[C@@H]3C(=O)[O-])cc2)cc1	ZINC000036293942	205008447	/nfs/dbraw/zinc/00/84/47/205008447.db2.gz	HKJZCSFHYGTQEW-QGZVFWFLSA-N	-1	0	361.419	2.600	50	0		FFAARM
O=C([O-])c1ccccc1NC(=O)N1CCc2[nH]cnc2[C@H]1c1ccccn1	ZINC000040309537	205023875	/nfs/dbraw/zinc/02/38/75/205023875.db2.gz	BWLSBRACRPQXRV-QGZVFWFLSA-N	-1	0	363.377	2.683	50	0	biogenic	FFAARM
COc1cccc([C@@H](c2sc3ncnn3c2[O-])N2CCCC2)c1OC	ZINC000041634548	205090942	/nfs/dbraw/zinc/09/09/42/205090942.db2.gz	KBXJRUUKRIEYBR-ZDUSSCGKSA-N	-1	0	360.439	2.699	50	0		FFAARM
Cc1oc(CNC(=O)[C@H](c2ccccc2)N2CCCCC2=O)cc1C(=O)[O-]	ZINC000299742294	205123817	/nfs/dbraw/zinc/12/38/17/205123817.db2.gz	AZAIQAAGXGROSX-SFHVURJKSA-N	-1	0	370.405	2.656	50	0		FFAARM
O=C([O-])c1cccc(CNC(=O)CC[C@H]2Cc3ccccc3NC2=O)c1	ZINC000299743727	205126452	/nfs/dbraw/zinc/12/64/52/205126452.db2.gz	LZHFKPCXXYPPSF-HNNXBMFYSA-N	-1	0	352.390	2.592	50	0		FFAARM
CN(Cc1ccc(C(=O)[O-])cc1)C(=O)[C@@H]1CC(=O)N(C)[C@H]1c1cccs1	ZINC000299749481	205130482	/nfs/dbraw/zinc/13/04/82/205130482.db2.gz	KMOPJIKNQUWDKJ-RHSMWYFYSA-N	-1	0	372.446	2.624	50	0		FFAARM
COc1ccc(CC(=O)[O-])cc1S(=O)(=O)Nc1cc(C)ccc1F	ZINC000054294841	205198669	/nfs/dbraw/zinc/19/86/69/205198669.db2.gz	QMVGRIKRBMFOIO-UHFFFAOYSA-N	-1	0	353.371	2.571	50	0		FFAARM
CCc1cc(=O)[nH]c(-c2cccc(NC(=O)[C@@H]3CC=CC[C@H]3C(=O)[O-])c2)n1	ZINC000055149706	205208737	/nfs/dbraw/zinc/20/87/37/205208737.db2.gz	CTUCCGRJKBUESQ-HZPDHXFCSA-N	-1	0	367.405	2.605	50	0		FFAARM
CCN(CCOc1ccc(F)cc1)C(=O)c1cccc(NCC(=O)[O-])c1	ZINC000055167755	205210036	/nfs/dbraw/zinc/21/00/36/205210036.db2.gz	AELICBYRGJLLCV-UHFFFAOYSA-N	-1	0	360.385	2.863	50	0		FFAARM
COc1cccc2c1OCCCN(C(=O)c1ccccc1NCC(=O)[O-])C2	ZINC000055243228	205211754	/nfs/dbraw/zinc/21/17/54/205211754.db2.gz	CIGXXNNXIGQALH-UHFFFAOYSA-N	-1	0	370.405	2.617	50	0		FFAARM
C[C@@H](c1ccccc1)N(CCC(=O)[O-])C(=O)CCC(=O)NC1CCCC1	ZINC000055404142	205217567	/nfs/dbraw/zinc/21/75/67/205217567.db2.gz	OKLWFZAWZWVBED-HNNXBMFYSA-N	-1	0	360.454	2.890	50	0		FFAARM
CC(C)(C)NC(=O)c1ccc([N-]S(=O)(=O)c2c[nH]c3ncccc23)cc1	ZINC000058161436	205252615	/nfs/dbraw/zinc/25/26/15/205252615.db2.gz	VWRYDMBHGMQTOP-UHFFFAOYSA-N	-1	0	372.450	2.892	50	0		FFAARM
O=C([O-])c1ccc2c(c1)S[C@@H](CC(=O)Nc1cccc(F)c1)C(=O)N2	ZINC000061719602	205286711	/nfs/dbraw/zinc/28/67/11/205286711.db2.gz	OACPXCPRSSQEBL-AWEZNQCLSA-N	-1	0	360.366	2.966	50	0		FFAARM
Cc1ccc([N-]S(=O)(=O)c2cc3n(c2)CCN(C(C)C)C3=O)cc1C	ZINC000065254767	205330092	/nfs/dbraw/zinc/33/00/92/205330092.db2.gz	XQZNJHATDYVXDR-UHFFFAOYSA-N	-1	0	361.467	2.770	50	0		FFAARM
COc1ncccc1[N-]S(=O)(=O)c1ccc(Br)c(C)c1	ZINC000040437400	205370705	/nfs/dbraw/zinc/37/07/05/205370705.db2.gz	FTDVIJPFJIDREB-UHFFFAOYSA-N	-1	0	357.229	2.962	50	0		FFAARM
COc1cc(NC(=O)[C@@H]2[C@H](C(=O)[O-])C2(C)C)ccc1-c1ccc(CO)o1	ZINC000071281933	205422963	/nfs/dbraw/zinc/42/29/63/205422963.db2.gz	VRFQOPXZDFOKBE-JKSUJKDBSA-N	-1	0	359.378	2.743	50	0		FFAARM
COc1cc(NC(=O)[C@H]2[C@@H](C(=O)[O-])C2(C)C)ccc1-c1ccc(CO)o1	ZINC000071281939	205423775	/nfs/dbraw/zinc/42/37/75/205423775.db2.gz	VRFQOPXZDFOKBE-CVEARBPZSA-N	-1	0	359.378	2.743	50	0		FFAARM
CSCc1nc2ccccc2n1CC(=O)NC1(C(=O)[O-])CCCCC1	ZINC000071802805	205448996	/nfs/dbraw/zinc/44/89/96/205448996.db2.gz	UNCKCIMOHPLAFK-UHFFFAOYSA-N	-1	0	361.467	2.803	50	0		FFAARM
Cc1cc(C)n([C@@H]2CCN(c3nccc(-c4cc(C(=O)[O-])ccn4)n3)C2)n1	ZINC000072448110	205551756	/nfs/dbraw/zinc/55/17/56/205551756.db2.gz	WXJASMSBKACWRF-OAHLLOKOSA-N	-1	0	364.409	2.502	50	0		FFAARM
COc1ccc(Cn2[nH][n-]c3c(=O)n(-c4cccc(Cl)c4)c(=O)c2=3)cc1	ZINC000101418087	205960833	/nfs/dbraw/zinc/96/08/33/205960833.db2.gz	HUGQHDQFZAMNIF-CVEARBPZSA-N	-1	0	370.796	2.842	50	0		FFAARM
CCn1c(=O)c2ccc(C(=O)NCc3ccccc3OC)cc2[n-]c1=S	ZINC000102171085	205971110	/nfs/dbraw/zinc/97/11/10/205971110.db2.gz	NMYCNSIVXZCXTG-UHFFFAOYSA-N	-1	0	369.446	2.644	50	0		FFAARM
CCO[C@@H]1CCCN(C(=O)c2ccc(-n3ncc(C(=O)[O-])c3C)cc2)C1	ZINC000236893491	205996676	/nfs/dbraw/zinc/99/66/76/205996676.db2.gz	YBECWSANUCHOFL-MRXNPFEDSA-N	-1	0	357.410	2.520	50	0		FFAARM
COc1cc(S(=O)(=O)Nc2ccccc2C)cc(C(=O)[O-])c1OC	ZINC000045946267	206079723	/nfs/dbraw/zinc/07/97/23/206079723.db2.gz	XIXCOHSEKQTRJJ-UHFFFAOYSA-N	-1	0	351.380	2.511	50	0		FFAARM
C[C@@H](CC(=O)N1CCO[C@@H](CC(=O)[O-])C1)c1ccc(C(F)(F)F)cc1	ZINC000237334959	206099789	/nfs/dbraw/zinc/09/97/89/206099789.db2.gz	WGVZSJSKMQQKSZ-FZMZJTMJSA-N	-1	0	359.344	2.901	50	0		FFAARM
Cc1cc(C)n(-c2ccc(C(=O)N3[C@H](C(=O)[O-])C[C@@H]4CCCC[C@@H]43)cn2)n1	ZINC000237787403	206109021	/nfs/dbraw/zinc/10/90/21/206109021.db2.gz	BFRDHTVWBXNBED-XIRDDKMYSA-N	-1	0	368.437	2.742	50	0		FFAARM
C[C@H](Oc1cccc(Br)c1)C(=O)N1CC[C@@](C)(C(=O)[O-])C1	ZINC000237646115	206107567	/nfs/dbraw/zinc/10/75/67/206107567.db2.gz	QEQGPSIJJJPDES-ZUZCIYMTSA-N	-1	0	356.216	2.540	50	0		FFAARM
C[C@@]1(C(=O)[O-])CCN(C(=O)CCc2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000237644165	206107703	/nfs/dbraw/zinc/10/77/03/206107703.db2.gz	FIOWMNUUPCXHRF-QGZVFWFLSA-N	-1	0	363.801	2.646	50	0		FFAARM
Cn1c2ccccc2c(Cl)c1C(=O)N(CC(=O)[O-])C1CCOCC1	ZINC000237708897	206108238	/nfs/dbraw/zinc/10/82/38/206108238.db2.gz	FXFPRWZJIHUZGB-UHFFFAOYSA-N	-1	0	350.802	2.538	50	0		FFAARM
O=C([O-])CCN(C[C@H]1CCCO1)C(=O)Cc1c[nH]c2cc(Cl)ccc12	ZINC000238102149	206113283	/nfs/dbraw/zinc/11/32/83/206113283.db2.gz	YYMXPLXZETYQGM-CQSZACIVSA-N	-1	0	364.829	2.846	50	0		FFAARM
O=C([O-])CCN(C[C@@H]1CCCO1)C(=O)[C@H]1C[C@@H]1c1cc(F)ccc1F	ZINC000238089790	206113946	/nfs/dbraw/zinc/11/39/46/206113946.db2.gz	YZZHXJWSWDJHIW-GUTXKFCHSA-N	-1	0	353.365	2.551	50	0		FFAARM
O=C([O-])[C@H]1CCCCN1C(=O)C1CCN(c2nc3ccccc3o2)CC1	ZINC000238039778	206113998	/nfs/dbraw/zinc/11/39/98/206113998.db2.gz	FOTCJYWKCUTSFZ-OAHLLOKOSA-N	-1	0	357.410	2.510	50	0		FFAARM
O=C([O-])CCN(Cc1cccc(F)c1F)C(=O)[C@@H]1CC12CCOCC2	ZINC000238146398	206116120	/nfs/dbraw/zinc/11/61/20/206116120.db2.gz	CGGMKQGVIJMRSV-ZDUSSCGKSA-N	-1	0	353.365	2.585	50	0		FFAARM
O=C([O-])[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc(CN2CCCC2=O)cc1	ZINC000237983467	206111327	/nfs/dbraw/zinc/11/13/27/206111327.db2.gz	BREKUPJPNOEFLC-BZSNNMDCSA-N	-1	0	370.449	2.667	50	0		FFAARM
O=C([O-])c1ccc(C(=O)NC2(c3ccc(Cl)cc3)CCOCC2)cn1	ZINC000238004187	206111664	/nfs/dbraw/zinc/11/16/64/206111664.db2.gz	RNLQDNGKEHVEFM-UHFFFAOYSA-N	-1	0	360.797	2.869	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)C[C@H]1CCCO1)c1cccc(Br)c1	ZINC000237937336	206111973	/nfs/dbraw/zinc/11/19/73/206111973.db2.gz	KXSSFYQDWFKMQP-OLZOCXBDSA-N	-1	0	356.216	2.650	50	0		FFAARM
Cc1oc2cc3oc(=O)c(CCC(=O)NCC(=O)[O-])c(C)c3cc2c1C	ZINC000002103101	206153277	/nfs/dbraw/zinc/15/32/77/206153277.db2.gz	YCPRQBGISSWVDV-UHFFFAOYSA-N	-1	0	357.362	2.598	50	0	biogenic	FFAARM
CN(CCN1CCOC1=O)C(=O)c1c([O-])c(Cl)cc(Cl)c1Cl	ZINC000150951127	206150764	/nfs/dbraw/zinc/15/07/64/206150764.db2.gz	ODPCDOWVTYEVEO-UHFFFAOYSA-N	-1	0	367.616	2.877	50	0		FFAARM
COc1cc(-c2coc3cc([O-])c(OC)c(O)c3c2=O)cc(O)c1OC	ZINC000005732527	206197843	/nfs/dbraw/zinc/19/78/43/206197843.db2.gz	TUGWPJJTQNLKCL-UHFFFAOYSA-N	-1	0	360.318	2.603	50	0	biogenic,in-vitro	FFAARM
O=C([O-])c1cc(S(=O)(=O)NCc2ccncc2)c(Cl)cc1Cl	ZINC000007718857	206244468	/nfs/dbraw/zinc/24/44/68/206244468.db2.gz	ZALCWAZAJVTWNM-UHFFFAOYSA-N	-1	0	361.206	2.565	50	0		FFAARM
O=C([O-])c1cccc(NC(=S)NC(=O)COc2ccc(Cl)cc2)c1	ZINC000002229078	206229843	/nfs/dbraw/zinc/22/98/43/206229843.db2.gz	SXKLDJDILSNNCM-UHFFFAOYSA-N	-1	0	364.810	2.930	50	0		FFAARM
Cc1cc(C)cc(OCC(=O)NC(=S)Nc2ccc(C(=O)[O-])cc2)c1	ZINC000004561162	206237761	/nfs/dbraw/zinc/23/77/61/206237761.db2.gz	FPJOVUQOSACWAE-UHFFFAOYSA-N	-1	0	358.419	2.894	50	0		FFAARM
Cc1cc(S(=O)(=O)[N-]c2ccccc2C(N)=O)ccc1Br	ZINC000005126705	206239527	/nfs/dbraw/zinc/23/95/27/206239527.db2.gz	MUUALIIOGUJMPT-UHFFFAOYSA-N	-1	0	369.240	2.657	50	0		FFAARM
COc1ccc(OC)c([N-]S(=O)(=O)c2ccc3c(c2)OCCCO3)c1	ZINC000012252102	206289237	/nfs/dbraw/zinc/28/92/37/206289237.db2.gz	HKWCGMCLOHTOAY-UHFFFAOYSA-N	-1	0	365.407	2.666	50	0		FFAARM
CCO[C@H]1C[C@@H](O)C12CCN(C(=O)c1ccc3[n-]c(=S)oc3c1)CC2	ZINC000175191556	206290552	/nfs/dbraw/zinc/29/05/52/206290552.db2.gz	PNBQRYVVBYUBDN-CABCVRRESA-N	-1	0	362.451	2.509	50	0		FFAARM
CCc1nc2sc([C@@H](c3ccccc3)N3CCN(CC)CC3)c([O-])n2n1	ZINC000022577987	206379363	/nfs/dbraw/zinc/37/93/63/206379363.db2.gz	PBWFQMBVQULEDS-MRXNPFEDSA-N	-1	0	371.510	2.786	50	0		FFAARM
CCc1nc2sc([C@H](c3cccc(C)c3)N3CCN(C)CC3)c([O-])n2n1	ZINC000022577873	206379655	/nfs/dbraw/zinc/37/96/55/206379655.db2.gz	QPJCJGFEYPFEEU-INIZCTEOSA-N	-1	0	371.510	2.704	50	0		FFAARM
CSc1c[nH]nc1[N-]S(=O)(=O)c1cccc(Br)c1F	ZINC000225400151	206477199	/nfs/dbraw/zinc/47/71/99/206477199.db2.gz	ZGHMANFORAIADH-UHFFFAOYSA-N	-1	0	366.237	2.834	50	0		FFAARM
CC(=O)Nc1ncc(S(=O)(=O)[N-][C@@H](C2CCCC2)C(F)(F)F)s1	ZINC000287898301	257127580	/nfs/dbraw/zinc/12/75/80/257127580.db2.gz	SAGIXPRRMZBKPU-JTQLQIEISA-N	-1	0	371.406	2.501	50	0		FFAARM
O=C([O-])[C@]1(CC2CC2)CCCN(C(=O)c2ccccc2N2CCOCC2)C1	ZINC000091440361	132201893	/nfs/dbraw/zinc/20/18/93/132201893.db2.gz	ZDLZYICLIOKCKU-NRFANRHFSA-N	-1	0	372.465	2.630	50	0		FFAARM
O=C([O-])c1ccc(C(=O)N[C@H]2CCCN(c3ccccc3Cl)C2=O)o1	ZINC000238040648	132249011	/nfs/dbraw/zinc/24/90/11/132249011.db2.gz	UFKPWMXNXCLHQK-NSHDSACASA-N	-1	0	362.769	2.557	50	0		FFAARM
O=C([O-])c1ccc(COc2nc3ccccc3nc2N2CCOCC2)cc1	ZINC000008852793	132844162	/nfs/dbraw/zinc/84/41/62/132844162.db2.gz	LXBPBOGHLPPVNR-UHFFFAOYSA-N	-1	0	365.389	2.744	50	0		FFAARM
O=C([O-])C[C@H]1Oc2ccccc2N(CCOc2ccc(Cl)cc2)C1=O	ZINC000055370427	136126641	/nfs/dbraw/zinc/12/66/41/136126641.db2.gz	OOGFKXYWAODHRF-MRXNPFEDSA-N	-1	0	361.781	2.988	50	0		FFAARM
COc1ccc(C(=O)[O-])cc1S(=O)(=O)N1CCCc2ccc(F)cc21	ZINC000055601238	136127304	/nfs/dbraw/zinc/12/73/04/136127304.db2.gz	MOADHVPIYONNGY-UHFFFAOYSA-N	-1	0	365.382	2.674	50	0		FFAARM
CN(C)c1nccnc1N1CCC[C@](Cc2ccccc2F)(C(=O)[O-])C1	ZINC000071440027	136139338	/nfs/dbraw/zinc/13/93/38/136139338.db2.gz	GPQRKOWATJKSHD-LJQANCHMSA-N	-1	0	358.417	2.596	50	0		FFAARM
COc1cccc(CC2(C(=O)[O-])CCN(c3ncnc4[nH]ccc43)CC2)c1	ZINC000071765137	136140991	/nfs/dbraw/zinc/14/09/91/136140991.db2.gz	ZXEDJILHJITPGO-UHFFFAOYSA-N	-1	0	366.421	2.880	50	0		FFAARM
O=C([O-])C1(c2ccccc2)CCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000000717956	506230333	/nfs/dbraw/zinc/23/03/33/506230333.db2.gz	XZDAWXYZDBMQMI-UHFFFAOYSA-N	-1	0	363.410	2.633	50	0		FFAARM
CCC(CC)C(=O)Nc1ccc(S(=O)(=O)[N-]c2nccc(C)n2)cc1	ZINC000000795325	506231705	/nfs/dbraw/zinc/23/17/05/506231705.db2.gz	JEVQYXCBFBVWFP-UHFFFAOYSA-N	-1	0	362.455	2.961	50	0		FFAARM
O=C(Cc1cccs1)Nc1ccc(S(=O)(=O)[N-]c2ncccn2)cc1	ZINC000000917478	506241043	/nfs/dbraw/zinc/24/10/43/506241043.db2.gz	HZCJPWVLCMLMKF-UHFFFAOYSA-N	-1	0	374.447	2.520	50	0		FFAARM
COc1ccc2oc(=O)c(C(=O)Nc3ccc(CC(=O)[O-])cc3)cc2c1	ZINC000001072285	506247288	/nfs/dbraw/zinc/24/72/88/506247288.db2.gz	YVCYROQTUALIQB-UHFFFAOYSA-N	-1	0	353.330	2.681	50	0		FFAARM
O=C([O-])[C@@H]1CC=CC[C@H]1C(=O)N1CCN(C/C=C/c2ccccc2)CC1	ZINC000001114436	506250608	/nfs/dbraw/zinc/25/06/08/506250608.db2.gz	JLTLXEFNRIBPCX-DCQHUWKXSA-N	-1	0	354.450	2.511	50	0		FFAARM
O=C([O-])[C@H]1CC(=O)CN1C(=O)OCC1c2ccccc2-c2ccccc21	ZINC000002382676	506278718	/nfs/dbraw/zinc/27/87/18/506278718.db2.gz	MDDIUNABQLYFNA-GOSISDBHSA-N	-1	0	351.358	2.664	50	0		FFAARM
COc1cc2c(cc1OC)[C@H](C(=O)[O-])[C@@H]1c3ccccc3CCN1C2=O	ZINC000032916818	506312521	/nfs/dbraw/zinc/31/25/21/506312521.db2.gz	XWMZLQGDUVBINT-ROUUACIJSA-N	-1	0	353.374	2.625	50	0		FFAARM
CN1C(=S)N(c2ccccc2)C(=O)/C1=C\c1ccccc1OCC(=O)[O-]	ZINC000033859354	506363429	/nfs/dbraw/zinc/36/34/29/506363429.db2.gz	RFUPSKVBWWDPDE-RVDMUPIBSA-N	-1	0	368.414	2.754	50	0		FFAARM
CC(=O)OC/C(=C(\C(=O)[O-])c1ccccc1)c1ccc(S(C)(=O)=O)cc1	ZINC000035942603	506392236	/nfs/dbraw/zinc/39/22/36/506392236.db2.gz	RPWJWEFMAVOUBY-ISLYRVAYSA-N	-1	0	374.414	2.649	50	0		FFAARM
CC(NCCc1ccccc1)=C1C(=O)[N-]C(=O)N(c2ccc(C)cc2)C1=O	ZINC000005625997	506450893	/nfs/dbraw/zinc/45/08/93/506450893.db2.gz	JBQSCCXIFWCRQT-OBGWFSINSA-N	-1	0	363.417	2.684	50	0		FFAARM
COc1ccc(S(=O)(=O)Nc2ccc(C(=O)[O-])c(C)c2)cc1OC	ZINC000066290436	506470501	/nfs/dbraw/zinc/47/05/01/506470501.db2.gz	CGHFVUNDDADGNJ-UHFFFAOYSA-N	-1	0	351.380	2.511	50	0		FFAARM
O=C([O-])[C@@]1(NC(=O)c2ccc(Br)cc2Cl)CCSC1	ZINC000043511089	506752837	/nfs/dbraw/zinc/75/28/37/506752837.db2.gz	CYIGERIAYYRHOH-GFCCVEGCSA-N	-1	0	364.648	2.793	50	0		FFAARM
O=S(=O)([N-]c1cnn(Cc2ccccc2)c1)c1ccc2c(c1)OCCO2	ZINC000055663743	506819522	/nfs/dbraw/zinc/81/95/22/506819522.db2.gz	LYXZYBLXOUDVFF-UHFFFAOYSA-N	-1	0	371.418	2.503	50	0		FFAARM
NC(=O)c1ccc(S(=O)(=O)[N-]c2ccccc2OCC(F)(F)F)cc1	ZINC000012541951	506874626	/nfs/dbraw/zinc/87/46/26/506874626.db2.gz	MBSDDDJVNNBEIY-UHFFFAOYSA-N	-1	0	374.340	2.527	50	0		FFAARM
C[C@@H](Sc1ccccc1C(=O)[O-])C(=O)NCc1ccc2c(c1)OCO2	ZINC000012978259	506920142	/nfs/dbraw/zinc/92/01/42/506920142.db2.gz	XXWQWDLPKIVLLR-LLVKDONJSA-N	-1	0	359.403	2.911	50	0		FFAARM
Cc1ccc(-n2[n-]c(CSc3nnnn3-c3ccccc3)cc2=O)cc1	ZINC000013569126	506945270	/nfs/dbraw/zinc/94/52/70/506945270.db2.gz	VRNHCGGSZDVYQE-UHFFFAOYSA-N	-1	0	364.434	2.742	50	0		FFAARM
CCc1ccc(NC2=N[C@H](CC(=O)Nc3ccccc3OC)C([O-])=N2)cc1	ZINC000013691187	506951235	/nfs/dbraw/zinc/95/12/35/506951235.db2.gz	PFPCQYABALEXLH-MRXNPFEDSA-N	-1	0	366.421	2.553	50	0		FFAARM
O=C(CCc1ccccc1)Nc1cc(=O)nc2[n-]c(Cc3ccccc3)nn21	ZINC000016994763	507111182	/nfs/dbraw/zinc/11/11/82/507111182.db2.gz	RITABOCSAKFYJS-UHFFFAOYSA-N	-1	0	373.416	2.992	50	0		FFAARM
Cc1ccc(Cl)cc1N1CCN(C(=O)[C@@H]2CC=CC[C@@H]2C(=O)[O-])CC1	ZINC000017074676	507114676	/nfs/dbraw/zinc/11/46/76/507114676.db2.gz	QCRHNPNJUYZFQQ-CVEARBPZSA-N	-1	0	362.857	2.964	50	0		FFAARM
CCOc1ccc(N2C(=O)C[C@@H](Sc3ncccc3C(=O)[O-])C2=O)cc1	ZINC000019789799	507201623	/nfs/dbraw/zinc/20/16/23/507201623.db2.gz	RQIPDDXUOYKDRZ-CQSZACIVSA-N	-1	0	372.402	2.603	50	0		FFAARM
COc1ccccc1N1C(=O)C[C@@H](Sc2ccccc2C(=O)[O-])C1=O	ZINC000019789449	507201693	/nfs/dbraw/zinc/20/16/93/507201693.db2.gz	DTHHLIHNAMJJEY-OAHLLOKOSA-N	-1	0	357.387	2.818	50	0		FFAARM
COc1ccccc1[N-]S(=O)(=O)c1ccc2c(c1)C(C)(C)C(=O)N2C	ZINC000020487335	507222300	/nfs/dbraw/zinc/22/23/00/507222300.db2.gz	JARCGCSHYLYOIL-UHFFFAOYSA-N	-1	0	360.435	2.750	50	0		FFAARM
O=C([O-])c1cc(-c2ccccc2F)nc2c1c(=O)[nH]c(=S)n2C1CC1	ZINC000020615233	507229699	/nfs/dbraw/zinc/22/96/99/507229699.db2.gz	KRBZRUKYAGAYEX-UHFFFAOYSA-N	-1	0	357.366	2.919	50	0		FFAARM
O=C([O-])CCNC(=O)Cc1csc(-c2ccc(OC(F)(F)F)cc2)n1	ZINC000020721897	507233046	/nfs/dbraw/zinc/23/30/46/507233046.db2.gz	VCBFQQHRCRANGO-UHFFFAOYSA-N	-1	0	374.340	2.842	50	0		FFAARM
O=C(NCc1ccccc1)c1cncc([N-]S(=O)(=O)c2ccccc2)c1	ZINC000021748303	507266398	/nfs/dbraw/zinc/26/63/98/507266398.db2.gz	ZOKAMOVJNIFCTE-UHFFFAOYSA-N	-1	0	367.430	2.812	50	0		FFAARM
CN1C(=S)N(c2ccccc2)C(=O)/C1=C\c1ccc(OCC(=O)[O-])cc1	ZINC000022623862	507300676	/nfs/dbraw/zinc/30/06/76/507300676.db2.gz	SDHZFOZRTQRRTL-LFIBNONCSA-N	-1	0	368.414	2.754	50	0		FFAARM
Cc1cc(S(=O)(=O)Nc2ccc3c(c2)CCC3)ccc1OCC(=O)[O-]	ZINC000058428695	507418742	/nfs/dbraw/zinc/41/87/42/507418742.db2.gz	UTGJLVNXANGPGJ-UHFFFAOYSA-N	-1	0	361.419	2.748	50	0		FFAARM
COc1cc(OC)c(C(=O)Nc2ccc(-c3nc(=O)o[n-]3)cc2)cc1OC	ZINC000060372922	507533110	/nfs/dbraw/zinc/53/31/10/507533110.db2.gz	XZCNSYZHGWTMFR-UHFFFAOYSA-N	-1	0	371.349	2.720	50	0		FFAARM
Cc1cnc2c(cccc2S(=O)(=O)[N-]c2ccc(-n3cccn3)nc2)c1	ZINC000026539524	507596346	/nfs/dbraw/zinc/59/63/46/507596346.db2.gz	PMFLJCMFYNSSRV-UHFFFAOYSA-N	-1	0	365.418	2.925	50	0		FFAARM
CCOC(=O)c1[nH]c2ccc(OC)cc2c1NC(=O)[C@H]1[C@@H](C(=O)[O-])C1(C)C	ZINC000071279454	507699162	/nfs/dbraw/zinc/69/91/62/507699162.db2.gz	UQYQULXLCVFVSY-OLZOCXBDSA-N	-1	0	374.393	2.649	50	0		FFAARM
CC1(C)[C@@H](C(=O)[O-])[C@@H]1C(=O)Nc1cc(Cl)ccc1C(=O)N1CCCC1	ZINC000071285648	507701007	/nfs/dbraw/zinc/70/10/07/507701007.db2.gz	NUVHWRWGGRJMPG-ZIAGYGMSSA-N	-1	0	364.829	2.871	50	0		FFAARM
C[C@H](Oc1ccccc1CN(C)Cc1nc(-c2cccnc2)no1)C(=O)[O-]	ZINC000072140118	507757141	/nfs/dbraw/zinc/75/71/41/507757141.db2.gz	SDTKNAUFFSBLKS-ZDUSSCGKSA-N	-1	0	368.393	2.616	50	0		FFAARM
COC(=O)c1[n-]c(=NC(=O)c2cccnc2)sc1CCc1ccccc1	ZINC000072401011	507782946	/nfs/dbraw/zinc/78/29/46/507782946.db2.gz	DLQMLHNXOZUBQM-UHFFFAOYSA-N	-1	0	367.430	3.362	50	0		FFAARM
O=C([O-])c1ccnc(-c2ccnc(NCCc3nc4ccccc4[nH]3)n2)c1	ZINC000072426703	507789063	/nfs/dbraw/zinc/78/90/63/507789063.db2.gz	KPCIHLQROQCIRI-UHFFFAOYSA-N	-1	0	360.377	2.768	50	0		FFAARM
CCc1nc(C)c(C(=O)N2CCC(Oc3ccccc3)(C(=O)[O-])CC2)o1	ZINC000072436071	507791574	/nfs/dbraw/zinc/79/15/74/507791574.db2.gz	CLZRFQVXMXUVET-UHFFFAOYSA-N	-1	0	358.394	2.684	50	0		FFAARM
CC(C)c1nnc([N-]C(=O)c2ccc(S(=O)(=O)NC(C)(C)C)o2)s1	ZINC000030601107	507811151	/nfs/dbraw/zinc/81/11/51/507811151.db2.gz	RGWAVJXMXYQZQS-UHFFFAOYSA-N	-1	0	372.472	2.584	50	0		FFAARM
CN(C)C(=O)c1ccc(Cl)cc1[N-]S(=O)(=O)c1cccc(F)c1	ZINC000031776872	507821644	/nfs/dbraw/zinc/82/16/44/507821644.db2.gz	KHQLZDZUDLGRTJ-UHFFFAOYSA-N	-1	0	356.806	2.982	50	0		FFAARM
Cc1cc(C(=O)N(C)[C@H](c2ccccc2)C(C)C)[nH]c2nc(=O)[n-]c(=O)c1-2	ZINC000073615297	507937603	/nfs/dbraw/zinc/93/76/03/507937603.db2.gz	LLHXPYTUVOMBLC-INIZCTEOSA-N	-1	0	366.421	2.801	50	0		FFAARM
Cc1nc(CCNC(=O)c2c[nH]nc2-c2cccc(F)c2)sc1C(=O)[O-]	ZINC000095363716	508176818	/nfs/dbraw/zinc/17/68/18/508176818.db2.gz	SIUPJHFCWRMIJR-UHFFFAOYSA-N	-1	0	374.397	2.651	50	0		FFAARM
O=C([O-])c1ccc([C@@H]2CCCN(C(=O)CCN3CCCCCC3=O)C2)cc1	ZINC000095364050	508176834	/nfs/dbraw/zinc/17/68/34/508176834.db2.gz	RPGKFCJVZNPUAN-GOSISDBHSA-N	-1	0	372.465	2.884	50	0		FFAARM
CN(CC(=O)N1CCC[C@H](c2cccc(C(=O)[O-])c2)C1)Cc1ccccn1	ZINC000095371129	508178550	/nfs/dbraw/zinc/17/85/50/508178550.db2.gz	NLXKHPCAGRNXBX-SFHVURJKSA-N	-1	0	367.449	2.618	50	0		FFAARM
O=C([O-])[C@@H]1[C@H]2C(=O)N(c3ccc(C(F)(F)F)cc3Cl)C[C@@]23C=C[C@@H]1O3	ZINC000095495822	508189176	/nfs/dbraw/zinc/18/91/76/508189176.db2.gz	QLXZJAHCWHTALL-ASHKBJFXSA-N	-1	0	373.714	2.730	50	0		FFAARM
Cc1c(C(=O)N2C[C@@H](C(=O)[O-])[C@H](c3ncc[nH]3)C2)[nH]c2c1c(C)ccc2C	ZINC000095511849	508193613	/nfs/dbraw/zinc/19/36/13/508193613.db2.gz	DGJHRMJSIKMFTB-ZIAGYGMSSA-N	-1	0	366.421	2.757	50	0		FFAARM
Cn1cnc(S(=O)(=O)[N-]c2ccc3c(c2)C(=O)Nc2ccccc2O3)c1	ZINC000096025651	508202990	/nfs/dbraw/zinc/20/29/90/508202990.db2.gz	GPELEHIJMMBPLM-UHFFFAOYSA-N	-1	0	370.390	2.579	50	0		FFAARM
CC[C@@H](C)NC(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1O	ZINC000097254611	508221981	/nfs/dbraw/zinc/22/19/81/508221981.db2.gz	IAQNQCWONVAWPM-SNVBAGLBSA-N	-1	0	354.453	2.783	50	0		FFAARM
CCOc1ccc(NC(=O)C(=O)c2c(C)[n-]n(-c3ccccc3)c2=O)cc1	ZINC000100721675	508239963	/nfs/dbraw/zinc/23/99/63/508239963.db2.gz	RCHNHGUXMZHGIG-KRWDZBQOSA-N	-1	0	365.389	2.632	50	0		FFAARM
Cc1ccc(C)c(Cn2[nH][n-]c3c(=O)n(-c4ccc(F)cc4)c(=O)c2=3)c1	ZINC000101167239	508240777	/nfs/dbraw/zinc/24/07/77/508240777.db2.gz	XUJUBVXBJAEIIF-IAGOWNOFSA-N	-1	0	352.369	2.936	50	0		FFAARM
Cc1cccc(N(Cc2nn3c([n-]2)nc(C)cc3=O)C(=O)CC(C)C)c1	ZINC000101802286	508257767	/nfs/dbraw/zinc/25/77/67/508257767.db2.gz	UNIUUVOURUWFFF-UHFFFAOYSA-N	-1	0	353.426	2.614	50	0		FFAARM
CCn1c(=O)c2ccc(C(=O)N[C@@H](C)c3ccncc3)cc2[n-]c1=S	ZINC000102169951	508268721	/nfs/dbraw/zinc/26/87/21/508268721.db2.gz	XHDNYSRVEXZLIX-NSHDSACASA-N	-1	0	354.435	2.591	50	0		FFAARM
CCn1c(=O)c2ccc(C(=O)Nc3ccc(OC)cc3)cc2[n-]c1=S	ZINC000102334494	508272291	/nfs/dbraw/zinc/27/22/91/508272291.db2.gz	FTQDSDXBBZKBSM-UHFFFAOYSA-N	-1	0	355.419	2.966	50	0		FFAARM
Cc1cc([C@H]2CCCCN2C(=O)c2cc(=O)n(-c3ccccc3)[n-]2)no1	ZINC000223199361	509330519	/nfs/dbraw/zinc/33/05/19/509330519.db2.gz	LWLVILVOGAQYID-QGZVFWFLSA-N	-1	0	352.394	2.829	50	0		FFAARM
CC(C)C[C@H](NC(=O)COc1ccc(Cl)c2cccnc12)C(=O)[O-]	ZINC000236593321	509462355	/nfs/dbraw/zinc/46/23/55/509462355.db2.gz	OVHSFTAYSCGDKT-ZDUSSCGKSA-N	-1	0	350.802	2.883	50	0		FFAARM
Cc1nn(CC(C)C)c(C)c1CC(=O)N1Cc2ccccc2C[C@H]1C(=O)[O-]	ZINC000236626374	509467673	/nfs/dbraw/zinc/46/76/73/509467673.db2.gz	YNWOZNCOWPQLRG-IBGZPJMESA-N	-1	0	369.465	2.737	50	0		FFAARM
CC(C)(C)c1ncc(/C=C/C(=O)N(CC(=O)[O-])C2CCOCC2)s1	ZINC000236634793	509467750	/nfs/dbraw/zinc/46/77/50/509467750.db2.gz	IXKHTAXWUADMPZ-SNAWJCMRSA-N	-1	0	352.456	2.546	50	0		FFAARM
CC(C)(C)n1cc(C(=O)N2CCC(C(=O)[O-])(c3ccccc3)CC2)cn1	ZINC000236776338	509501612	/nfs/dbraw/zinc/50/16/12/509501612.db2.gz	CUMVKSOGMCYLQA-UHFFFAOYSA-N	-1	0	355.438	2.897	50	0		FFAARM
CC(C)c1ccc(-c2noc(CCC(=O)N3CCC[C@H]3C(=O)[O-])n2)cc1	ZINC000236853687	509518404	/nfs/dbraw/zinc/51/84/04/509518404.db2.gz	PGSTUQIYIKEMBX-HNNXBMFYSA-N	-1	0	357.410	2.868	50	0		FFAARM
C[C@H](c1ccccc1)N1C[C@H](C(=O)N[C@H]2CCCCC[C@@H]2C(=O)[O-])CC1=O	ZINC000252515785	509849101	/nfs/dbraw/zinc/84/91/01/509849101.db2.gz	NMCNKJXDSDPABR-BGTYHANMSA-N	-1	0	372.465	2.746	50	0		FFAARM
Cc1noc([C@@H]2CCCCN2CCC(=O)Nc2ccsc2C(=O)[O-])n1	ZINC000244787998	509870893	/nfs/dbraw/zinc/87/08/93/509870893.db2.gz	QHLXRJDBPWPTFC-LBPRGKRZSA-N	-1	0	364.427	2.694	50	0		FFAARM
Cc1nn(-c2ccccc2)c(Cl)c1/C=C\C(=O)N1CC[C@H](C(=O)[O-])C1	ZINC000255132032	509920018	/nfs/dbraw/zinc/92/00/18/509920018.db2.gz	DLNIBFNUYGHJBE-WSROAFLRSA-N	-1	0	359.813	2.780	50	0		FFAARM
O=C([O-])[C@@H]1CCCN(C(=O)N[C@H](Cc2ccccn2)c2ccccc2)C1	ZINC000263408202	510694658	/nfs/dbraw/zinc/69/46/58/510694658.db2.gz	UHMCQACKDXSXKL-SJLPKXTDSA-N	-1	0	353.422	2.872	50	0		FFAARM
COc1ccc(CCC(=O)N2[C@@H]3CCCC[C@@H]3C[C@H]2C(=O)[O-])cc1OC	ZINC000263680038	510786071	/nfs/dbraw/zinc/78/60/71/510786071.db2.gz	GZJOMPUUNLBZPA-OAGGEKHMSA-N	-1	0	361.438	2.881	50	0		FFAARM
COc1ccc(COCCCC(=O)N2CCCC[C@H]2c2n[nH]c(=O)[n-]2)cc1	ZINC000408518108	513083959	/nfs/dbraw/zinc/08/39/59/513083959.db2.gz	UPRLSHJASGGTQK-INIZCTEOSA-N	-1	0	374.441	2.570	50	0		FFAARM
O=C([O-])[C@@]12CN(C(=O)CCc3cn[nH]c3)C[C@@H]1C[C@@H](c1ccccc1)CC2	ZINC000426374404	513919533	/nfs/dbraw/zinc/91/95/33/513919533.db2.gz	QAMMXPIOHZCDKW-WFXMLNOXSA-N	-1	0	367.449	2.839	50	0		FFAARM
Cc1cccc([C@H](NC(=O)N(C)Cc2cc(C(C)(C)C)n[nH]2)C(=O)[O-])c1	ZINC000426595121	513990538	/nfs/dbraw/zinc/99/05/38/513990538.db2.gz	YJLMJEZDCRZCKG-INIZCTEOSA-N	-1	0	358.442	2.983	50	0		FFAARM
CCc1cc(-c2ccc(C(=O)N[C@H](C)c3n[n-]c(=N)s3)cc2)nc(C)n1	ZINC000534655097	517985120	/nfs/dbraw/zinc/98/51/20/517985120.db2.gz	RWERARCRHSYVEI-SNVBAGLBSA-N	-1	0	368.466	2.939	50	0		FFAARM
CN(C(=O)Cc1ccc(NC(=O)C(C)(C)C(=O)[O-])cc1)c1ccccc1	ZINC000578991897	518470879	/nfs/dbraw/zinc/47/08/79/518470879.db2.gz	QITDHOQDKRYYRK-UHFFFAOYSA-N	-1	0	354.406	2.941	50	0		FFAARM
O=C([O-])[C@@H]1Cc2ccccc2CN1C(=O)c1c(Cl)nc2ccccn21	ZINC000583652263	519359594	/nfs/dbraw/zinc/35/95/94/519359594.db2.gz	WIJBNQULJNBTKP-ZDUSSCGKSA-N	-1	0	355.781	2.639	50	0		FFAARM
CC(=O)N[C@@H](CC(=O)N1CCCC[C@H]1CCC(=O)[O-])c1ccc(C)cc1	ZINC000236685251	519682265	/nfs/dbraw/zinc/68/22/65/519682265.db2.gz	OLKCOEHOGZWTKF-ROUUACIJSA-N	-1	0	360.454	2.808	50	0		FFAARM
C[C@@H]1CN(Cc2ccccc2NC(=O)c2ccc(C(=O)[O-])nc2)C[C@H](C)O1	ZINC000612566417	520024141	/nfs/dbraw/zinc/02/41/41/520024141.db2.gz	KRGMRPTUAGJCFB-OKILXGFUSA-N	-1	0	369.421	2.641	50	0		FFAARM
Cc1nc(COc2ccccc2/C=C\C(=O)N2CC[C@@H](C(=O)[O-])C2)cs1	ZINC000606441121	521068127	/nfs/dbraw/zinc/06/81/27/521068127.db2.gz	RTKZJQAFJPXUFJ-IDTUSYRASA-N	-1	0	372.446	2.977	50	0		FFAARM
O=C([O-])c1ccc2nc(/C=C/c3cn(C[C@H]4CCOC4)nn3)ccc2c1	ZINC000630950303	523267105	/nfs/dbraw/zinc/26/71/05/523267105.db2.gz	CFULCOVZJVKCBC-MUBLQREKSA-N	-1	0	350.378	2.731	50	0		FFAARM
COCCC[C@@]1(C(=O)[O-])CCCN(C(=O)NCc2cccc(F)c2)C1	ZINC000091468487	523469041	/nfs/dbraw/zinc/46/90/41/523469041.db2.gz	XTZVASPSBSKRQK-SFHVURJKSA-N	-1	0	352.406	2.629	50	0		FFAARM
C[C@H](OC1CCCCCC1)C(=O)[N-]S(=O)(=O)c1ccc(Cl)cn1	ZINC000120156828	570542682	/nfs/dbraw/zinc/54/26/82/570542682.db2.gz	TVVQDWZNMZLTIU-NSHDSACASA-N	-1	0	360.863	2.668	50	0		FFAARM
Cc1ccc(N(Cc2nn3c([n-]2)nc(C)cc3=O)C(=O)CC(C)C)cc1	ZINC000101583453	570821504	/nfs/dbraw/zinc/82/15/04/570821504.db2.gz	CGWOQIJLRMXEQI-UHFFFAOYSA-N	-1	0	353.426	2.614	50	0		FFAARM
Cn1c(=O)c2ccc(C(=O)NCCc3cccc(Cl)c3)cc2[n-]c1=S	ZINC000102177992	570828044	/nfs/dbraw/zinc/82/80/44/570828044.db2.gz	AUOIPPLGYMSPCT-UHFFFAOYSA-N	-1	0	373.865	2.848	50	0		FFAARM
O=S(=O)([N-]c1cc(C(F)(F)F)[nH]n1)c1ccccc1Br	ZINC000084507280	571087338	/nfs/dbraw/zinc/08/73/38/571087338.db2.gz	OEODUJJQYSTNPC-UHFFFAOYSA-N	-1	0	370.150	2.992	50	0		FFAARM
COc1cc2c(c(OC)c1OC)[C@H](c1ccc(C(=O)[O-])cc1)CC(=O)O2	ZINC000217992814	571351926	/nfs/dbraw/zinc/35/19/26/571351926.db2.gz	DUEXSCANESGBAU-LBPRGKRZSA-N	-1	0	358.346	2.852	50	0	biogenic	FFAARM
CC(C)(C(=O)[O-])C(=O)Nc1nccn1Cc1ccc(Br)cc1	ZINC000649465100	730886704	/nfs/dbraw/zinc/88/67/04/730886704.db2.gz	OEUSPPLQZJQAQL-UHFFFAOYSA-N	-1	0	366.215	2.743	50	0		FFAARM
O=C([O-])COc1ccccc1CN1CCN(c2ccc(Cl)cn2)CC1	ZINC000072475573	845555912	/nfs/dbraw/zinc/55/59/12/845555912.db2.gz	HBEGBGGUNJGRRK-UHFFFAOYSA-N	-1	0	361.829	2.521	50	0		FFAARM
CC(C)Oc1nn(C)c2ccc(NC(=O)[C@H]3CC=CC[C@@H]3C(=O)[O-])cc12	ZINC000675028336	971519913	/nfs/dbraw/zinc/51/99/13/971519913.db2.gz	PQMPRBTYZUIJHX-KBPBESRZSA-N	-1	0	357.410	2.966	50	0		FFAARM
COc1ccccc1-c1c(C)[n-]n2c1nc(CCCc1cn[nH]c1)cc2=O	ZINC000023398658	969293699	/nfs/dbraw/zinc/29/36/99/969293699.db2.gz	DOZMYTSESDHNQK-UHFFFAOYSA-N	-1	0	363.421	2.905	50	0		FFAARM
O=C([O-])[C@]1(CC2CC2)CCCN(c2ccc(C(=O)N3CCCC3)cn2)C1	ZINC000219610579	1008298259	/nfs/dbraw/zinc/29/82/59/1008298259.db2.gz	ARWPKHURDUFHNN-FQEVSTJZSA-N	-1	0	357.454	2.789	50	0		FFAARM
Cc1[nH]c(C(=O)[O-])c(C)c1C(=O)N1CCC[C@@H](c2nc(CC(C)C)no2)C1	ZINC001506403662	1059496958	/nfs/dbraw/zinc/49/69/58/1059496958.db2.gz	CVALMJDKRGCZRH-CYBMUJFWSA-N	-1	0	374.441	2.931	50	0		FFAARM
CCCN1CCN([C@@H](C(=O)[O-])c2ccc3cc(OC)ccc3c2)CC1=O	ZINC001506420911	1059509854	/nfs/dbraw/zinc/50/98/54/1059509854.db2.gz	DMXHVTXPUDIFLC-LJQANCHMSA-N	-1	0	356.422	2.528	50	0		FFAARM
Cc1cc(C)nc(NC(=O)[N-]S(=O)(=O)c2ccccc2C(F)(F)F)n1	ZINC000001096786	203805334	/nfs/dbraw/zinc/80/53/34/203805334.db2.gz	YJXKEYDAWGFMRY-UHFFFAOYSA-N	-1	0	374.344	2.623	50	0		FFAARM
C[C@H](NS(=O)(=O)c1ccc(Oc2ccccc2Cl)cc1)C(=O)[O-]	ZINC000000953574	203966610	/nfs/dbraw/zinc/96/66/10/203966610.db2.gz	IETNEQSPEDIHAV-JTQLQIEISA-N	-1	0	355.799	2.884	50	0		FFAARM
C[C@H](NC(=O)/C(=C/c1ccc(Cl)cc1)NC(=O)c1ccccc1)C(=O)[O-]	ZINC000002948900	204070493	/nfs/dbraw/zinc/07/04/93/204070493.db2.gz	BCGZSUJANOSRFW-IEMQHYRPSA-N	-1	0	372.808	2.700	50	0		FFAARM
Cc1nc([N-]S(=O)(=O)c2ccc(Cl)cc2)sc1C(=O)N(C)C	ZINC000002760293	204056087	/nfs/dbraw/zinc/05/60/87/204056087.db2.gz	UAWXEXFSDCMCRR-UHFFFAOYSA-N	-1	0	359.860	2.608	50	0		FFAARM
CCn1cc(S(=O)(=O)[N-]c2ccn(Cc3cccc(Cl)c3)n2)cn1	ZINC000002804771	204059910	/nfs/dbraw/zinc/05/99/10/204059910.db2.gz	YWALTDYEOPFJDJ-UHFFFAOYSA-N	-1	0	365.846	2.602	50	0		FFAARM
O=C([O-])[C@@H]1CCCC[C@@H]1C(=O)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000002808336	204060101	/nfs/dbraw/zinc/06/01/01/204060101.db2.gz	JZTMKWZSWJLPMC-DLBZAZTESA-N	-1	0	364.873	2.875	50	0		FFAARM
O=C([O-])[C@@H]1CCCN1C(=O)C(NC(=O)c1ccccc1)=C1CCCCC1	ZINC000003671318	204110628	/nfs/dbraw/zinc/11/06/28/204110628.db2.gz	DUSKWHYUEMJMSE-INIZCTEOSA-N	-1	0	356.422	2.710	50	0		FFAARM
Cc1ccc(NC(=O)[C@@H](C)n2nc(C(=O)[O-])c3ccccc3c2=O)cc1	ZINC000003517313	204104901	/nfs/dbraw/zinc/10/49/01/204104901.db2.gz	NKDGGFNGSXLNFN-GFCCVEGCSA-N	-1	0	351.362	2.603	50	0		FFAARM
CCCCN1C(=O)S/C(=C\c2ccc(OCC(=O)[O-])c(OC)c2)C1=O	ZINC000004676590	204153675	/nfs/dbraw/zinc/15/36/75/204153675.db2.gz	QPCLGDOGWSBENN-ZROIWOOFSA-N	-1	0	365.407	2.995	50	0		FFAARM
COc1cc2c(cc1OC)[C@H](C(=O)[O-])[C@@H](c1ccc(F)cc1)N(C)C2=O	ZINC000004563678	204146616	/nfs/dbraw/zinc/14/66/16/204146616.db2.gz	MIKLYYNEIZMHGU-DLBZAZTESA-N	-1	0	359.353	2.838	50	0		FFAARM
CCc1ccccc1NC(=O)[C@@H](Cc1cccc(OC)c1)c1nnn[n-]1	ZINC000005445033	204209926	/nfs/dbraw/zinc/20/99/26/204209926.db2.gz	XYRHJEZNDGYKCK-INIZCTEOSA-N	-1	0	351.410	2.736	50	0		FFAARM
O=C([O-])[C@@H]1CCCN1S(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1	ZINC000005065335	204189807	/nfs/dbraw/zinc/18/98/07/204189807.db2.gz	BTQZZDHTYVPHDY-JTQLQIEISA-N	-1	0	357.737	2.597	50	0		FFAARM
Cc1oc2cc3oc(=O)c(CC(=O)N[C@@H](C)C(=O)[O-])c(C)c3cc2c1C	ZINC000006167289	204239542	/nfs/dbraw/zinc/23/95/42/204239542.db2.gz	BQAOCSASHCTOLX-JTQLQIEISA-N	-1	0	357.362	2.596	50	0		FFAARM
Cc1nn(-c2ccc(Cl)cc2)c2sc(C(=O)Nc3nnn[n-]3)cc12	ZINC000006683021	204261293	/nfs/dbraw/zinc/26/12/93/204261293.db2.gz	KMSHSYFTUXSKLB-UHFFFAOYSA-N	-1	0	359.802	2.814	50	0		FFAARM
O=C([O-])c1ccccc1NC(=O)c1cccc(NC(=O)[C@@H]2CCCO2)c1	ZINC000008189561	204321783	/nfs/dbraw/zinc/32/17/83/204321783.db2.gz	SUEXDFTXTPGVEC-INIZCTEOSA-N	-1	0	354.362	2.755	50	0		FFAARM
CC(=O)Nc1cc(C(=O)CSc2nnc3n2CCCCC3)ccc1[O-]	ZINC000008325199	204325962	/nfs/dbraw/zinc/32/59/62/204325962.db2.gz	ZMFSEGHNDHOBHN-UHFFFAOYSA-N	-1	0	360.439	2.644	50	0		FFAARM
Cc1ccc(C2=Nn3c(nnc3-c3ccncc3)S[C@H]2CC(=O)[O-])cc1	ZINC000008315726	204326025	/nfs/dbraw/zinc/32/60/25/204326025.db2.gz	ARYVHLMOHBTIIN-AWEZNQCLSA-N	-1	0	365.418	2.850	50	0		FFAARM
COc1cc(S(=O)(=O)[N-]c2ccccc2C(C)=O)ccc1NC(C)=O	ZINC000007505230	204299070	/nfs/dbraw/zinc/29/90/70/204299070.db2.gz	NOISJFRKVPNRRR-UHFFFAOYSA-N	-1	0	362.407	2.657	50	0		FFAARM
Cc1cc(S(=O)(=O)Nc2ccc(Cl)cc2)ccc1OCC(=O)[O-]	ZINC000009095686	204354828	/nfs/dbraw/zinc/35/48/28/204354828.db2.gz	DXTLEXPWPDUCLN-UHFFFAOYSA-N	-1	0	355.799	2.913	50	0		FFAARM
Cc1[nH]c(C)c(S(=O)(=O)[N-]c2ccc(F)cc2)c1C(=O)N1CCCC1	ZINC000009684096	204378094	/nfs/dbraw/zinc/37/80/94/204378094.db2.gz	SEXZMCOILIHSMT-UHFFFAOYSA-N	-1	0	365.430	2.807	50	0		FFAARM
Cc1ccc(NC(=O)CSc2nc([O-])cc(=O)n2-c2ccccc2)cc1	ZINC000009907698	204386349	/nfs/dbraw/zinc/38/63/49/204386349.db2.gz	YXSKGSCKRMNSOC-UHFFFAOYSA-N	-1	0	367.430	2.977	50	0		FFAARM
Cc1c2c(cc(=O)n1Cc1ccccn1)[n-]n(-c1ccccc1Cl)c2=O	ZINC000012652747	204483517	/nfs/dbraw/zinc/48/35/17/204483517.db2.gz	DNKYHHFCPXKFIY-UHFFFAOYSA-N	-1	0	366.808	2.886	50	0	in-vivo	FFAARM
COC(=O)c1cc([N-]S(=O)(=O)c2c(F)cccc2F)c(F)cc1F	ZINC000024428256	204819360	/nfs/dbraw/zinc/81/93/60/204819360.db2.gz	GZCBSNKFCFRKOQ-UHFFFAOYSA-N	-1	0	363.288	2.830	50	0		FFAARM
O=C([O-])[C@H]1CCCN(C(=O)Cn2ccc3ccc(Br)cc32)C1	ZINC000040283666	205066041	/nfs/dbraw/zinc/06/60/41/205066041.db2.gz	QOYAPMTXYLIBTE-LBPRGKRZSA-N	-1	0	365.227	2.727	50	0		FFAARM
COc1ccc2oc(C)c(C(=O)N(CCC(=O)[O-])C[C@H]3CCCO3)c2c1	ZINC000299753604	205135595	/nfs/dbraw/zinc/13/55/95/205135595.db2.gz	YTUWUOXANJAKCO-CQSZACIVSA-N	-1	0	361.394	2.846	50	0		FFAARM
O=C([O-])[C@@H]1COCCN1C(=O)c1cn(Cc2ccccc2)c2ccccc12	ZINC000299753574	205135758	/nfs/dbraw/zinc/13/57/58/205135758.db2.gz	YRRSHQGPZDBKAN-IBGZPJMESA-N	-1	0	364.401	2.615	50	0		FFAARM
O=C(NCCCS(=O)(=O)Cc1ccccc1)c1ccc([O-])c(Cl)c1	ZINC000052824383	205188019	/nfs/dbraw/zinc/18/80/19/205188019.db2.gz	AJXQUEUHSHEBIG-UHFFFAOYSA-N	-1	0	367.854	2.781	50	0		FFAARM
Cc1c(F)cc(C(N)=O)cc1[N-]S(=O)(=O)c1cccc(Cl)c1F	ZINC000055614890	205222342	/nfs/dbraw/zinc/22/23/42/205222342.db2.gz	LBPKNTXQTCXSFL-UHFFFAOYSA-N	-1	0	360.769	2.826	50	0		FFAARM
O=C(COc1ccc2c(c1)CCC2)Nc1cccc(-c2nc(=O)o[n-]2)c1	ZINC000057754022	205244056	/nfs/dbraw/zinc/24/40/56/205244056.db2.gz	FMEHIMYWIULVJE-UHFFFAOYSA-N	-1	0	351.362	2.948	50	0		FFAARM
CC(C)CN1CCn2cc(S(=O)(=O)[N-]c3cccc(F)c3)cc2C1=O	ZINC000065254824	205329734	/nfs/dbraw/zinc/32/97/34/205329734.db2.gz	WQEBOFJFZKUVQK-UHFFFAOYSA-N	-1	0	365.430	2.540	50	0		FFAARM
CC(C)(C)C(=O)Nc1ncc(F)c(C(=O)[O-])c1I	ZINC000066054372	205362706	/nfs/dbraw/zinc/36/27/06/205362706.db2.gz	QGVJWXDJUNTHLP-UHFFFAOYSA-N	-1	0	366.130	2.508	50	0		FFAARM
O=C(CSc1nc2[nH]c(=O)cc([O-])c2s1)Nc1cc(F)ccc1F	ZINC000065363143	205338822	/nfs/dbraw/zinc/33/88/22/205338822.db2.gz	VDZQZJWXUQOHFB-UHFFFAOYSA-N	-1	0	369.374	2.699	50	0		FFAARM
COc1ccc([C@H]2CC(=O)NCc3nc4cc(C)ccn4c32)cc1C(=O)[O-]	ZINC000065373397	205340636	/nfs/dbraw/zinc/34/06/36/205340636.db2.gz	DOGMXEOOEVLMKW-CYBMUJFWSA-N	-1	0	365.389	2.501	50	0		FFAARM
O=C([O-])c1cccnc1CN1CCN(c2nsc3ccccc32)CC1	ZINC000065376397	205341214	/nfs/dbraw/zinc/34/12/14/205341214.db2.gz	QAIOIYOPPVAJQC-UHFFFAOYSA-N	-1	0	354.435	2.712	50	0		FFAARM
O=C([O-])C1(n2cccn2)CCN(C(=O)c2cc3c(s2)CCCC3)CC1	ZINC000072421696	205537693	/nfs/dbraw/zinc/53/76/93/205537693.db2.gz	QISIDDWRFDDFEF-UHFFFAOYSA-N	-1	0	359.451	2.540	50	0		FFAARM
Cc1ccc(OC2(C(=O)[O-])CCN(C(=O)[C@H]3CC=CCC3)CC2)c(C)n1	ZINC000072475533	205559579	/nfs/dbraw/zinc/55/95/79/205559579.db2.gz	APIJGMVRIVPGRQ-INIZCTEOSA-N	-1	0	358.438	2.879	50	0		FFAARM
Cc1nc(C)c(C(=O)N2CCC(C(=O)[O-])(n3ccc(C(C)(C)C)n3)CC2)o1	ZINC000072480084	205564451	/nfs/dbraw/zinc/56/44/51/205564451.db2.gz	YSPIEMDZUZBGSM-UHFFFAOYSA-N	-1	0	374.441	2.502	50	0		FFAARM
Cc1ccc(C2(C(=O)N3C[C@@H](c4cccnc4)[C@H](C(=O)[O-])C3)CC2)cc1	ZINC000091943229	205704825	/nfs/dbraw/zinc/70/48/25/205704825.db2.gz	LEZVTJZVHALULL-ZWKOTPCHSA-N	-1	0	350.418	2.748	50	0		FFAARM
COc1ccc(CC(=O)N2C[C@@H](c3ccccc3)[C@H](C(=O)[O-])C2)c(OC)c1	ZINC000091745429	205691140	/nfs/dbraw/zinc/69/11/40/205691140.db2.gz	BJWHYPDZAHGQLP-ZWKOTPCHSA-N	-1	0	369.417	2.573	50	0		FFAARM
O=C([O-])C[C@@H]1c2ccccc2CCN1C(=O)COc1ccc(F)cc1F	ZINC000095526710	205785222	/nfs/dbraw/zinc/78/52/22/205785222.db2.gz	GWDZLIXYNQKJEZ-MRXNPFEDSA-N	-1	0	361.344	2.944	50	0		FFAARM
O=C([O-])[C@@]12CN(C(=O)c3ccc4cccnc4c3)C[C@@H]1c1ccccc1OC2	ZINC000096163003	205842628	/nfs/dbraw/zinc/84/26/28/205842628.db2.gz	GHSNEOMQAXUGSB-VGOFRKELSA-N	-1	0	374.396	2.938	50	0		FFAARM
CCc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccc(OC)cc4)c=3c2=O)cc1	ZINC000101418392	205961461	/nfs/dbraw/zinc/96/14/61/205961461.db2.gz	JUQCWCDCPQFJKA-ROUUACIJSA-N	-1	0	364.405	2.751	50	0		FFAARM
COc1ccc(NS(=O)(=O)c2ccc(OC)c(C(=O)[O-])c2)cc1Cl	ZINC000047949057	206080697	/nfs/dbraw/zinc/08/06/97/206080697.db2.gz	LDOAFAXBMSCAOJ-UHFFFAOYSA-N	-1	0	371.798	2.856	50	0		FFAARM
C[C@H](Oc1ccccc1Br)C(=O)N1CC[C@](C)(C(=O)[O-])C1	ZINC000237676657	206106876	/nfs/dbraw/zinc/10/68/76/206106876.db2.gz	VYEQTOFVQRVMEL-BONVTDFDSA-N	-1	0	356.216	2.540	50	0		FFAARM
O=C([O-])CCN(C[C@@H]1CCCO1)C(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1F	ZINC000238089289	206113251	/nfs/dbraw/zinc/11/32/51/206113251.db2.gz	XZGWVBRMUXGQIH-NWANDNLSSA-N	-1	0	353.365	2.551	50	0		FFAARM
Cc1nn(Cc2cccc(Cl)c2)cc1C(=O)N1CCC[C@@H](C(=O)[O-])C1	ZINC000128510890	206122851	/nfs/dbraw/zinc/12/28/51/206122851.db2.gz	KAPFZQFGXWMJLW-CQSZACIVSA-N	-1	0	361.829	2.830	50	0		FFAARM
CCOc1ccc(/C=C2\C(=O)[N-]N(c3cccc(F)c3)C2=O)cc1OC	ZINC000000623589	206127252	/nfs/dbraw/zinc/12/72/52/206127252.db2.gz	BUCGNDUGZZYVHL-OQLLNIDSSA-N	-1	0	356.353	2.694	50	0		FFAARM
Cc1nc(COc2cccc(C(=O)N3CC[C@](C)(C(=O)[O-])C3)c2)cs1	ZINC000237762710	206109516	/nfs/dbraw/zinc/10/95/16/206109516.db2.gz	RCKQNWZWRVSVHX-SFHVURJKSA-N	-1	0	360.435	2.967	50	0		FFAARM
Cc1nn(Cc2ccc(C)cc2)c(C)c1CCC(=O)N1CC[C@@H](C(=O)[O-])C1	ZINC000237851709	206110242	/nfs/dbraw/zinc/11/02/42/206110242.db2.gz	SASKYXWQNVDWJZ-GOSISDBHSA-N	-1	0	369.465	2.722	50	0		FFAARM
O=C([O-])CCN(C(=O)c1cc(Br)ccc1F)C1CCOCC1	ZINC000238073306	206112399	/nfs/dbraw/zinc/11/23/99/206112399.db2.gz	WAGHUHINDKNYRF-UHFFFAOYSA-N	-1	0	374.206	2.684	50	0		FFAARM
C[C@@H]1CCc2c(sc3nnn(Cc4ccc(C(=O)[O-])cc4)c(=O)c32)C1	ZINC000000958794	206143719	/nfs/dbraw/zinc/14/37/19/206143719.db2.gz	LJKCOHIXHKGEGB-SNVBAGLBSA-N	-1	0	355.419	2.724	50	0		FFAARM
C[C@@H]1CN([C@@H](c2cccs2)c2sc3ncnn3c2[O-])C[C@@H](C)O1	ZINC000004292190	206174223	/nfs/dbraw/zinc/17/42/23/206174223.db2.gz	QTDKDDVKZDKMQU-FOGDFJRCSA-N	-1	0	350.469	2.757	50	0		FFAARM
CCOc1ccccc1[N-]S(=O)(=O)c1cc2c3c(c1)CCC(=O)N3CC2	ZINC000005153590	206189489	/nfs/dbraw/zinc/18/94/89/206189489.db2.gz	SOHNNHQQXRVSHT-UHFFFAOYSA-N	-1	0	372.446	2.721	50	0		FFAARM
CC(C)(C)C(=O)Nc1ccc(F)c(C(=O)N2CCC[C@@H](C(=O)[O-])C2)c1	ZINC000165563310	206243302	/nfs/dbraw/zinc/24/33/02/206243302.db2.gz	ITJPNBDIPYNEQY-LLVKDONJSA-N	-1	0	350.390	2.747	50	0		FFAARM
COc1ccc(-c2cncc(C(=O)[N-]S(=O)(=O)CC3CCC3)c2)cc1	ZINC000165034439	206240486	/nfs/dbraw/zinc/24/04/86/206240486.db2.gz	AKPLWTZBFGPMKI-UHFFFAOYSA-N	-1	0	360.435	2.617	50	0		FFAARM
O=C([O-])c1ccc(NS(=O)(=O)c2cccc(Br)c2)cc1	ZINC000006316015	206242219	/nfs/dbraw/zinc/24/22/19/206242219.db2.gz	AAUBVDIYGYVWIM-UHFFFAOYSA-N	-1	0	356.197	2.948	50	0		FFAARM
CC(C)(C)C(=O)Nc1ccc(F)c(C(=O)N2CCC[C@H](C(=O)[O-])C2)c1	ZINC000165563187	206242695	/nfs/dbraw/zinc/24/26/95/206242695.db2.gz	ITJPNBDIPYNEQY-NSHDSACASA-N	-1	0	350.390	2.747	50	0		FFAARM
CNC(=O)Cc1ccc(NS(=O)(=O)c2ccc(F)c(Cl)c2)cc1	ZINC000013850527	206305827	/nfs/dbraw/zinc/30/58/27/206305827.db2.gz	AIGZSDXMLXIKNL-UHFFFAOYSA-N	-1	0	356.806	2.568	50	0		FFAARM
CCN1CCN([C@@H](c2sc3nc(C)nn3c2[O-])c2ccccc2)CC1	ZINC000022458755	206378070	/nfs/dbraw/zinc/37/80/70/206378070.db2.gz	NDIDXLQYNPLUHV-OAHLLOKOSA-N	-1	0	357.483	2.532	50	0		FFAARM
CC1(C)c2sc(=O)[nH]c2S[C@@H](C(=O)[O-])[C@@H]1C(=O)c1ccc(F)cc1	ZINC000032594636	206512127	/nfs/dbraw/zinc/51/21/27/206512127.db2.gz	UWUHFWYLCGSROY-GXSJLCMTSA-N	-1	0	367.423	2.911	50	0		FFAARM
CC(NCc1cccc(C)c1)=C1C(=O)[N-]C(=O)N(c2ccccc2F)C1=O	ZINC000001407326	533417586	/nfs/dbraw/zinc/41/75/86/533417586.db2.gz	WAXWFUXKNPORKF-GHRIWEEISA-N	-1	0	367.380	2.781	50	0		FFAARM
O=c1oc2ccccc2c([O-])c1CN1CCN(c2ccccc2F)CC1	ZINC000039396276	132301131	/nfs/dbraw/zinc/30/11/31/132301131.db2.gz	KQQNLBMKMDPDJJ-UHFFFAOYSA-N	-1	0	354.381	2.960	50	0		FFAARM
CCn1c(=O)c2ccc(C(=O)NCc3cccc(C)c3)cc2[n-]c1=S	ZINC000102984954	222316484	/nfs/dbraw/zinc/31/64/84/222316484.db2.gz	ZWWAHELHIPKMNS-UHFFFAOYSA-N	-1	0	353.447	2.944	50	0		FFAARM
COC(=O)c1cc(S(=O)(=O)[N-]c2cccc(-c3cnco3)c2)oc1C	ZINC000001028461	263142199	/nfs/dbraw/zinc/14/21/99/263142199.db2.gz	YMTPXZMGOFDKES-UHFFFAOYSA-N	-1	0	362.363	2.830	50	0		FFAARM
COc1cc(OC)cc(C(=O)NC(=S)Nc2cccc(C(=O)[O-])c2C)c1	ZINC000001159493	263143385	/nfs/dbraw/zinc/14/33/85/263143385.db2.gz	WVYLLWLPCUDRDF-UHFFFAOYSA-N	-1	0	374.418	2.837	50	0		FFAARM
Cn1nnc2cc(C(=O)N3CCC(c4ccccc4C(=O)[O-])CC3)ccc21	ZINC000368927006	512140614	/nfs/dbraw/zinc/14/06/14/512140614.db2.gz	ZZHBLPQTYLHVDF-UHFFFAOYSA-N	-1	0	364.405	2.686	50	0		FFAARM
COc1cccc([C@@H]2N[C@H](C(=O)[O-])Cc3c4ccccc4[nH]c32)c1OC	ZINC000000771865	506231040	/nfs/dbraw/zinc/23/10/40/506231040.db2.gz	ZKLBZOHWBKUYBF-RDJZCZTQSA-N	-1	0	352.390	2.873	50	0	biogenic	FFAARM
O=C([O-])CN(c1cccc(C(F)(F)F)c1)S(=O)(=O)c1ccccc1	ZINC000000816923	506233953	/nfs/dbraw/zinc/23/39/53/506233953.db2.gz	NRZLNHKNFJGXHG-UHFFFAOYSA-N	-1	0	359.325	2.985	50	0		FFAARM
O=C([O-])[C@@H]1CC=CC[C@@H]1C(=O)Nc1ccccc1C(=O)NCc1ccco1	ZINC000001019554	506243471	/nfs/dbraw/zinc/24/34/71/506243471.db2.gz	STQFQNBZRUSIST-LSDHHAIUSA-N	-1	0	368.389	2.815	50	0		FFAARM
CC(C)CN1C(=O)c2ccc(C(=O)c3ccc(C(=O)[O-])cc3)cc2C1=O	ZINC000001062831	506245957	/nfs/dbraw/zinc/24/59/57/506245957.db2.gz	DCUYHWMCTBUCSN-UHFFFAOYSA-N	-1	0	351.358	2.868	50	0		FFAARM
CCc1ccc(N2C[C@@H](C(=O)Nc3cccc(C(=O)[O-])c3)CC2=O)cc1	ZINC000001072452	506248041	/nfs/dbraw/zinc/24/80/41/506248041.db2.gz	HCLNTRIGSCOPFN-HNNXBMFYSA-N	-1	0	352.390	2.939	50	0		FFAARM
CN(Cc1nc(=O)c2sccc2[n-]1)C(=O)NCCSc1ccccc1	ZINC000032794898	506295529	/nfs/dbraw/zinc/29/55/29/506295529.db2.gz	GITQITPOSRXTHJ-UHFFFAOYSA-N	-1	0	374.491	2.918	50	0		FFAARM
CCONC(=O)c1ccc2c(c1)[n-]c(=S)n(CCc1ccccc1)c2=O	ZINC000032902770	506308341	/nfs/dbraw/zinc/30/83/41/506308341.db2.gz	UCLLNTRIWWDLCZ-UHFFFAOYSA-N	-1	0	369.446	2.609	50	0		FFAARM
COc1ccccc1N1CCN(c2ccc(NC(C)=O)cc2C(=O)[O-])CC1	ZINC000033078542	506331736	/nfs/dbraw/zinc/33/17/36/506331736.db2.gz	GAQULCGPKVRTCB-UHFFFAOYSA-N	-1	0	369.421	2.678	50	0	biogenic	FFAARM
CC(=O)Nc1ccc(N2CCN(c3ccc(F)cc3)CC2)c(C(=O)[O-])c1	ZINC000033078633	506332356	/nfs/dbraw/zinc/33/23/56/506332356.db2.gz	BEKIKMSJBGUKNJ-UHFFFAOYSA-N	-1	0	357.385	2.809	50	0		FFAARM
O=C(CCc1nnc(-c2ccc(F)c(F)c2)[n-]c1=O)NCc1ccccc1	ZINC000034768340	506370139	/nfs/dbraw/zinc/37/01/39/506370139.db2.gz	UMPHLTIKLUEOMM-UHFFFAOYSA-N	-1	0	370.359	2.771	50	0		FFAARM
CNC(=O)c1ccccc1[N-]S(=O)(=O)c1cccc(OC(F)(F)F)c1	ZINC000012735372	506894363	/nfs/dbraw/zinc/89/43/63/506894363.db2.gz	QVFYXUPRPHNXCS-UHFFFAOYSA-N	-1	0	374.340	2.746	50	0		FFAARM
C[C@@H]1Oc2ccccc2N(CCC(=O)Nc2ccccc2C(=O)[O-])C1=O	ZINC000012990839	506921340	/nfs/dbraw/zinc/92/13/40/506921340.db2.gz	CVZUMJBFUCZPCJ-LBPRGKRZSA-N	-1	0	354.362	2.528	50	0		FFAARM
COc1ccc(CC(=O)N[C@H](CC(=O)[O-])c2ccc(F)cc2)cc1OC	ZINC000013176212	506930122	/nfs/dbraw/zinc/93/01/22/506930122.db2.gz	VNBOMOSOFVGQSM-OAHLLOKOSA-N	-1	0	361.369	2.718	50	0		FFAARM
COc1ccc(C)cc1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)[O-]	ZINC000013260062	506934275	/nfs/dbraw/zinc/93/42/75/506934275.db2.gz	MTXIKHSEDPLTOJ-KRWDZBQOSA-N	-1	0	352.390	2.911	50	0		FFAARM
Cc1cc(-c2ccc(S(=O)(=O)NCC(=O)[O-])cc2)nc2ccccc12	ZINC000013317113	506937836	/nfs/dbraw/zinc/93/78/36/506937836.db2.gz	QYHVFAJINAJQMJ-UHFFFAOYSA-N	-1	0	356.403	2.573	50	0		FFAARM
COc1ccc(OC)c([N-]S(=O)(=O)c2ccc(OC)cc2OC)c1	ZINC000014255933	506983790	/nfs/dbraw/zinc/98/37/90/506983790.db2.gz	LWJKFESXPPWNTL-UHFFFAOYSA-N	-1	0	353.396	2.522	50	0		FFAARM
Cc1[nH]c(=S)sc1CC(=O)N(C)Cc1nc(=O)c2sccc2[n-]1	ZINC000014372260	506988383	/nfs/dbraw/zinc/98/83/83/506988383.db2.gz	AGVLPFIEMAJQJR-UHFFFAOYSA-N	-1	0	366.493	2.613	50	0		FFAARM
COc1ccc(N2C(=O)[N-]C(=O)C(=C(C)Nc3cccc(F)c3)C2=O)cc1	ZINC000017249620	507118827	/nfs/dbraw/zinc/11/88/27/507118827.db2.gz	IJOCYPJJQPCOPK-LFIBNONCSA-N	-1	0	369.352	2.803	50	0		FFAARM
O=c1c2sc3ccccc3c2[n-]c(=S)n1CCCN1CCOCC1	ZINC000020640898	507229711	/nfs/dbraw/zinc/22/97/11/507229711.db2.gz	OUXKZMPGPDCKTQ-UHFFFAOYSA-N	-1	0	361.492	2.996	50	0		FFAARM
Cc1ccc([N-]S(=O)(=O)c2ccc(-c3ccc(=O)[nH]n3)s2)cc1C	ZINC000021531496	507257406	/nfs/dbraw/zinc/25/74/06/507257406.db2.gz	HNKVJEFYCCLQMC-UHFFFAOYSA-N	-1	0	361.448	2.916	50	0		FFAARM
CCS(=O)(=O)c1ccc([N-]S(=O)(=O)c2cc(C)sc2C)cc1	ZINC000021868883	507270005	/nfs/dbraw/zinc/27/00/05/507270005.db2.gz	YFWWMHHQXWBUDH-UHFFFAOYSA-N	-1	0	359.494	2.959	50	0		FFAARM
CCc1ccc(OC)c(S(=O)(=O)[N-]c2ccc3c(c2)CC(=O)N3CC)c1	ZINC000022714997	507304879	/nfs/dbraw/zinc/30/48/79/507304879.db2.gz	LPBMIWAUOWUEKQ-UHFFFAOYSA-N	-1	0	374.462	2.967	50	0		FFAARM
Cc1ccc(S(=O)(=O)[N-]c2ccc(S(=O)(=O)NC(C)C)cc2)s1	ZINC000024070927	507390016	/nfs/dbraw/zinc/39/00/16/507390016.db2.gz	WNAVTMDPQCUTKX-UHFFFAOYSA-N	-1	0	374.509	2.544	50	0		FFAARM
Cc1cc(S(=O)(=O)Nc2ccc(F)cc2F)ccc1OCC(=O)[O-]	ZINC000058368596	507409533	/nfs/dbraw/zinc/40/95/33/507409533.db2.gz	JCBDNEXMHMNZTH-UHFFFAOYSA-N	-1	0	357.334	2.537	50	0		FFAARM
COc1ccc(NC(=O)C2CC2)cc1NC(=O)Cc1ccccc1C(=O)[O-]	ZINC000071284603	507700959	/nfs/dbraw/zinc/70/09/59/507700959.db2.gz	NWHNXPZPSCWLRG-UHFFFAOYSA-N	-1	0	368.389	2.923	50	0		FFAARM
COc1cccc(-c2cc(C(=O)[O-])cc(S(=O)(=O)N3CCCC3)c2)c1	ZINC000071708079	507708856	/nfs/dbraw/zinc/70/88/56/507708856.db2.gz	LDDZRQJWIFSFRC-UHFFFAOYSA-N	-1	0	361.419	2.845	50	0		FFAARM
Cc1cc2nc(CN3CCO[C@@H](c4ccc(Cl)cc4)C3)cc(=O)n2[n-]1	ZINC000071754117	507711637	/nfs/dbraw/zinc/71/16/37/507711637.db2.gz	QUWOKKUKZDXCPE-MRXNPFEDSA-N	-1	0	358.829	2.558	50	0		FFAARM
CCn1c(C)ccc(C(=O)N2CC[C@@H](Cc3cccc(C(=O)[O-])c3)C2)c1=O	ZINC000072157278	507763436	/nfs/dbraw/zinc/76/34/36/507763436.db2.gz	DFDCYRGHFGVGCC-INIZCTEOSA-N	-1	0	368.433	2.580	50	0		FFAARM
CC(C)Oc1ccc(-c2cc(NC(=O)c3nccnc3C(=O)[O-])n[nH]2)cc1	ZINC000072401681	507782864	/nfs/dbraw/zinc/78/28/64/507782864.db2.gz	ZGEAIUZNLXTHGL-UHFFFAOYSA-N	-1	0	367.365	2.604	50	0		FFAARM
CCOc1ccc(-c2ccnc(NCCn3cccn3)n2)cc1C(=O)[O-]	ZINC000072408876	507784758	/nfs/dbraw/zinc/78/47/58/507784758.db2.gz	JNHFGGQDNTYGPG-UHFFFAOYSA-N	-1	0	353.382	2.549	50	0		FFAARM
O=C([O-])CCc1cc2n(n1)CCCN(Cc1c[nH]nc1-c1ccccc1)C2	ZINC000072479041	507796639	/nfs/dbraw/zinc/79/66/39/507796639.db2.gz	UIXAFWZSTJHJAV-UHFFFAOYSA-N	-1	0	365.437	2.696	50	0		FFAARM
CCN(Cc1nc(=O)c2sccc2[n-]1)C[C@H]1COc2ccccc2O1	ZINC000031173672	507817831	/nfs/dbraw/zinc/81/78/31/507817831.db2.gz	KUUZZCSOYSYQEB-LBPRGKRZSA-N	-1	0	357.435	2.647	50	0		FFAARM
C#Cc1cccc(N(C)S(=O)(=O)c2cc(C(=O)[O-])c(F)cc2Cl)c1	ZINC000078747853	507904437	/nfs/dbraw/zinc/90/44/37/507904437.db2.gz	DPFVBVSTAUMRKN-UHFFFAOYSA-N	-1	0	367.785	2.984	50	0		FFAARM
CC[C@]1(C(=O)[O-])CCCN(C(=O)Cc2cc3c(cc2Cl)OCCO3)C1	ZINC000091412239	507983552	/nfs/dbraw/zinc/98/35/52/507983552.db2.gz	NYWAIXWXYBNQTC-SFHVURJKSA-N	-1	0	367.829	2.757	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)c2ccccc2N2CCCC2)C[C@H]1c1cccnc1	ZINC000091460523	507987652	/nfs/dbraw/zinc/98/76/52/507987652.db2.gz	XNGQHHZTGFTLLD-ZWKOTPCHSA-N	-1	0	365.433	2.622	50	0		FFAARM
Cc1nnc(-c2c(C)[nH]c(C)c2S(=O)(=O)[N-]c2ccc(F)cc2)o1	ZINC000075504885	508112252	/nfs/dbraw/zinc/11/22/52/508112252.db2.gz	WSXFFMPQYFZKTH-UHFFFAOYSA-N	-1	0	350.375	2.930	50	0		FFAARM
CCCc1nnc(N2C[C@H]3COc4ccccc4C[C@@]3(C(=O)[O-])C2)s1	ZINC000095359662	508176257	/nfs/dbraw/zinc/17/62/57/508176257.db2.gz	NMHYHIOICHIPGJ-SCLBCKFNSA-N	-1	0	359.451	2.633	50	0		FFAARM
Cc1cc(C)n(CCC(=O)N2CCC[C@@H](c3cccc(C(=O)[O-])c3)C2)n1	ZINC000095366013	508177643	/nfs/dbraw/zinc/17/76/43/508177643.db2.gz	UPGSUKMUOVLCDV-GOSISDBHSA-N	-1	0	355.438	2.994	50	0		FFAARM
Cc1[nH]nc(C(F)F)c1[N-]S(=O)(=O)c1cnn(Cc2ccccc2)c1	ZINC000095457214	508186695	/nfs/dbraw/zinc/18/66/95/508186695.db2.gz	SUIVNZJCLZOWDQ-UHFFFAOYSA-N	-1	0	367.381	2.701	50	0		FFAARM
O=c1c2[n-][nH]n(Cc3ccc(F)cc3)c=2c(=O)n1-c1ccc(F)c(F)c1	ZINC000095481464	508188948	/nfs/dbraw/zinc/18/89/48/508188948.db2.gz	XVHSDCKQGRBAFF-GJZGRUSLSA-N	-1	0	360.295	2.597	50	0		FFAARM
Cc1oc(-c2cccc(C)c2)nc1CN1Cc2nc[nH]c2C[C@H]1C(=O)[O-]	ZINC000095509936	508192854	/nfs/dbraw/zinc/19/28/54/508192854.db2.gz	HOJZRZOIBKINQS-KRWDZBQOSA-N	-1	0	352.394	2.693	50	0		FFAARM
CCC(CC)NC(=O)[C@@H](C)S(=O)(=O)c1ccc(Cl)c(C(=O)[O-])c1	ZINC000095949092	508198365	/nfs/dbraw/zinc/19/83/65/508198365.db2.gz	CQANWCDBPRISQY-SECBINFHSA-N	-1	0	361.847	2.505	50	0		FFAARM
COC(=O)C[C@@H](c1ccccc1)c1c([O-])nc2ccc(Cl)cn2c1=O	ZINC000096117157	508206978	/nfs/dbraw/zinc/20/69/78/508206978.db2.gz	RWXOJZSRVGFOAQ-ZDUSSCGKSA-N	-1	0	358.781	2.749	50	0		FFAARM
COc1cc(/C=C2/CCn3c2nc2cc(C(=O)[O-])ccc2c3=O)ccc1O	ZINC000096792795	508215765	/nfs/dbraw/zinc/21/57/65/508215765.db2.gz	JJLLVJPEHGMSKH-WQLSENKSSA-N	-1	0	364.357	2.753	50	0		FFAARM
CSc1nn2c([n-]1)nc(C)c(Cc1ccc(Br)cc1)c2=O	ZINC000100133380	508238473	/nfs/dbraw/zinc/23/84/73/508238473.db2.gz	YJSXCIJMCKREHG-UHFFFAOYSA-N	-1	0	365.256	2.801	50	0		FFAARM
CCOC(=O)c1c([O-])c2cnc(-c3ccccc3)nc2n(C(C)C)c1=O	ZINC000100227198	508239119	/nfs/dbraw/zinc/23/91/19/508239119.db2.gz	IAMQQDSOLURRFM-UHFFFAOYSA-N	-1	0	353.378	2.922	50	0		FFAARM
CS(=O)(=O)[N-]c1nc2n(n1)[C@H](c1ccccc1)CC(c1ccccc1)=N2	ZINC000100636518	508239874	/nfs/dbraw/zinc/23/98/74/508239874.db2.gz	WJJPBZZNOSQQEI-INIZCTEOSA-N	-1	0	367.434	2.706	50	0		FFAARM
CCOc1ccc(Cn2[nH][n-]c3c(=O)n(-c4ccc(F)cc4)c(=O)c2=3)cc1	ZINC000101167798	508240875	/nfs/dbraw/zinc/24/08/75/508240875.db2.gz	HNBNATATXINMOD-IAGOWNOFSA-N	-1	0	368.368	2.718	50	0		FFAARM
COc1cccc(-n2c(=O)c3[n-][nH]n(-c4ccc(F)c(Cl)c4)c=3c2=O)c1	ZINC000101260701	508241129	/nfs/dbraw/zinc/24/11/29/508241129.db2.gz	UTHWXDAQUBYHEW-GJZGRUSLSA-N	-1	0	374.759	2.986	50	0		FFAARM
COc1cc(C)c(S(=O)(=O)[N-]c2cc(C(F)(F)F)[nH]n2)cc1OC	ZINC000084077446	508264830	/nfs/dbraw/zinc/26/48/30/508264830.db2.gz	IQGVCGSRHOPBNN-UHFFFAOYSA-N	-1	0	365.333	2.555	50	0		FFAARM
Cc1cccn2c(CNc3nccc(-c4cc(C(=O)[O-])ccn4)n3)cnc12	ZINC000077391636	508310481	/nfs/dbraw/zinc/31/04/81/508310481.db2.gz	VIYDQVKANSWQFV-UHFFFAOYSA-N	-1	0	360.377	2.805	50	0		FFAARM
CCCC[C@H]1C(=O)N(C)CCN1Cc1cc(Cl)ccc1OCC(=O)[O-]	ZINC000077471948	508320552	/nfs/dbraw/zinc/32/05/52/508320552.db2.gz	BLTQUPJCMKOEGN-HNNXBMFYSA-N	-1	0	368.861	2.636	50	0		FFAARM
Cc1ccc(C(=O)Nc2ccc(C(=O)N3CCC(C(=O)[O-])CC3)cc2)n1C	ZINC000124775249	508882996	/nfs/dbraw/zinc/88/29/96/508882996.db2.gz	QUAHGURAYIMARI-UHFFFAOYSA-N	-1	0	369.421	2.523	50	0		FFAARM
CCc1ccc(C(=O)[O-])cc1S(=O)(=O)[N-]c1c(C)noc1C1CC1	ZINC000126791525	509129209	/nfs/dbraw/zinc/12/92/09/509129209.db2.gz	WZCJZTDVSFQUMS-UHFFFAOYSA-N	-1	0	350.396	2.922	50	0		FFAARM
CCCC[NH+]1CCC(NS(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)CC1	ZINC000236761334	509497980	/nfs/dbraw/zinc/49/79/80/509497980.db2.gz	MNDXGKJHVSHENY-UHFFFAOYSA-N	-1	0	374.890	2.581	50	0		FFAARM
Cc1nc(C)n(-c2ccc(C(=O)N3CCC[C@@H](CCC(=O)[O-])C3)cc2)n1	ZINC000237696766	509713175	/nfs/dbraw/zinc/71/31/75/509713175.db2.gz	HKOJCRUVHUEHEV-HNNXBMFYSA-N	-1	0	356.426	2.601	50	0		FFAARM
Cc1noc(C)c1COc1ccc(CC(=O)N2CCCC[C@@H]2C(=O)[O-])cc1	ZINC000180166770	509789244	/nfs/dbraw/zinc/78/92/44/509789244.db2.gz	ZVDUNQPSUOUPEG-GOSISDBHSA-N	-1	0	372.421	2.879	50	0		FFAARM
O=C([O-])CC[C@H]1CCCN(C(=O)c2cn(-c3ccccc3Cl)nn2)C1	ZINC000238021726	509802072	/nfs/dbraw/zinc/80/20/72/509802072.db2.gz	HVNLDDNQGQBZAO-GFCCVEGCSA-N	-1	0	362.817	2.638	50	0		FFAARM
O=C([O-])C1CCN(C(=O)CCCOc2ccccc2Br)CC1	ZINC000238101148	509822211	/nfs/dbraw/zinc/82/22/11/509822211.db2.gz	FLIBQGVREXBOFI-UHFFFAOYSA-N	-1	0	370.243	2.931	50	0		FFAARM
Cc1nn(-c2ccccc2)c(Cl)c1/C=C\C(=O)N1CC[C@@H](C(=O)[O-])C1	ZINC000255132031	509920872	/nfs/dbraw/zinc/92/08/72/509920872.db2.gz	DLNIBFNUYGHJBE-MEJMFZKBSA-N	-1	0	359.813	2.780	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)c2cc(Cl)ccc2OC2CCCC2)CCO1	ZINC000262040941	510157935	/nfs/dbraw/zinc/15/79/35/510157935.db2.gz	CTHCGOVONXWRLL-HNNXBMFYSA-N	-1	0	353.802	2.587	50	0		FFAARM
C[C@H]1CC[C@H](C(=O)[O-])CN1C(=O)Cc1csc(Cc2ccccc2)n1	ZINC000263160055	510591594	/nfs/dbraw/zinc/59/15/94/510591594.db2.gz	IGYMDATVIWUFKE-ZFWWWQNUSA-N	-1	0	358.463	2.988	50	0		FFAARM
Cc1cc(OCC(=O)N(CCC(=O)[O-])C2CCOCC2)ccc1C(C)C	ZINC000408513237	513082986	/nfs/dbraw/zinc/08/29/86/513082986.db2.gz	CWUHHJJOJAHYKO-UHFFFAOYSA-N	-1	0	363.454	2.980	50	0		FFAARM
CC[C@H](C)[C@H](NC(=O)N1CCN(C/C=C/c2ccccc2)CC1)C(=O)[O-]	ZINC000426537834	513973580	/nfs/dbraw/zinc/97/35/80/513973580.db2.gz	ZAROSYHIWRGMMJ-IGHXGINGSA-N	-1	0	359.470	2.526	50	0		FFAARM
C[C@@]1(c2ccccc2)CN(C(=O)c2cccc(OCC(=O)[O-])c2)CCO1	ZINC000537369693	517157748	/nfs/dbraw/zinc/15/77/48/517157748.db2.gz	VTSOIDCOQOLYQX-FQEVSTJZSA-N	-1	0	355.390	2.538	50	0		FFAARM
O=C([O-])[C@H](CNC(=O)c1cc(-c2ccc(F)cc2)n[nH]1)Cc1ccccc1	ZINC000328594865	534527994	/nfs/dbraw/zinc/52/79/94/534527994.db2.gz	DZAFFTVYKQFKIK-HNNXBMFYSA-N	-1	0	367.380	2.889	50	0		FFAARM
CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@H]1CC[C@H](C(=O)[O-])CC1	ZINC000252694463	521967484	/nfs/dbraw/zinc/96/74/84/521967484.db2.gz	LDQPXWIVKJVLCZ-AJNGGQMLSA-N	-1	0	370.490	2.933	50	0	biogenic	FFAARM
COc1ccc(CCC2CCN(C(=O)c3cc(C(=O)[O-])nn3C)CC2)cc1	ZINC000630105578	522621855	/nfs/dbraw/zinc/62/18/55/522621855.db2.gz	ZQVVCNUNAPAEFM-UHFFFAOYSA-N	-1	0	371.437	2.612	50	0		FFAARM
Cc1cc(=O)n2nc(CN(C(=O)c3cccs3)c3ccccc3)[n-]c2n1	ZINC000086066670	526144295	/nfs/dbraw/zinc/14/42/95/526144295.db2.gz	TUMAGJIMFZXTQR-UHFFFAOYSA-N	-1	0	365.418	2.635	50	0		FFAARM
O=C([O-])[C@@H]1Cc2ccccc2CN1C(=O)C[C@H]1OCCc2ccccc21	ZINC000268951230	526292794	/nfs/dbraw/zinc/29/27/94/526292794.db2.gz	QKKHGQNSRYDBHG-RBUKOAKNSA-N	-1	0	351.402	2.729	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)[C@H]1CC(=O)Nc2cc(F)ccc21)c1ccc(F)cc1	ZINC000238149225	527625786	/nfs/dbraw/zinc/62/57/86/527625786.db2.gz	VYDRSUBYBXGVTK-LSDHHAIUSA-N	-1	0	374.343	2.723	50	0		FFAARM
CN1C(=O)C[C@H](C(=O)[O-])C12CCN(c1ccc3cccc(Cl)c3n1)CC2	ZINC000095360476	536317480	/nfs/dbraw/zinc/31/74/80/536317480.db2.gz	GWGQICTURIMLCQ-CYBMUJFWSA-N	-1	0	373.840	2.790	50	0		FFAARM
Cc1ccc2c(n1)[n-]cc(C(=O)N=c1cc(C3CCOCC3)[nH][nH]1)c2=O	ZINC000608474896	554275680	/nfs/dbraw/zinc/27/56/80/554275680.db2.gz	KCLQYXMVADPRGK-UHFFFAOYSA-N	-1	0	353.382	2.513	50	0		FFAARM
COc1cccc(-n2[nH][n-]c3c(=O)n(-c4ccc5c(c4)CCC5)c(=O)c2=3)c1	ZINC000102818830	570839836	/nfs/dbraw/zinc/83/98/36/570839836.db2.gz	LZCXMLMRZMLRSJ-QZTJIDSGSA-N	-1	0	362.389	2.682	50	0		FFAARM
O=C(Nc1cnn(C[C@@H]2CCCO2)c1)c1ccc(Br)cc1[O-]	ZINC000084340750	571082780	/nfs/dbraw/zinc/08/27/80/571082780.db2.gz	NIMMHIFCAXUCIO-LBPRGKRZSA-N	-1	0	366.215	2.783	50	0		FFAARM
COc1ccc(C(=O)Oc2ccc(/C=C(/C#N)C(=O)[O-])cc2OC)cc1	ZINC000071793185	571203369	/nfs/dbraw/zinc/20/33/69/571203369.db2.gz	RSNHDOZPAKTUOQ-ZROIWOOFSA-N	-1	0	353.330	2.915	50	0		FFAARM
CC[C@H](C)[C@H](NC(=O)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1)C(=O)[O-]	ZINC000237002935	599745395	/nfs/dbraw/zinc/74/53/95/599745395.db2.gz	YCKHWAZAWYDYAM-ZBEGNZNMSA-N	-1	0	359.426	2.674	50	0		FFAARM
CCn1cc([N-]S(=O)(=O)c2ccc3c(c2)CC(Cl)(Cl)C3=O)cn1	ZINC000585086373	845948436	/nfs/dbraw/zinc/94/84/36/845948436.db2.gz	NHPIXGDQWSOHRU-UHFFFAOYSA-N	-1	0	374.249	2.617	50	0		FFAARM
CC[C@@]1(c2ccccc2)C(=O)[N-]C(=O)N(C(=O)c2ccc(Cl)cc2)C1=O	ZINC000005005924	975591340	/nfs/dbraw/zinc/59/13/40/975591340.db2.gz	ISNDNYKIMWBWIB-LJQANCHMSA-N	-1	0	370.792	2.907	50	0		FFAARM
CC[C@@](CNC(=O)c1cccc2c1COCC2)(C(=O)[O-])c1ccccc1	ZINC000952886719	1011014640	/nfs/dbraw/zinc/01/46/40/1011014640.db2.gz	BSKANYCRYHVYPN-NRFANRHFSA-N	-1	0	353.418	2.922	50	0		FFAARM
C[C@H](NC(=O)Nc1cc([C@H]2CCCO2)nn1C)[C@@H]1C[C@H](C(=O)[O-])C1(C)C	ZINC000653544343	1024940107	/nfs/dbraw/zinc/94/01/07/1024940107.db2.gz	URRLZDQHKFVBDN-CIQGVGRVSA-N	-1	0	364.446	2.529	50	0		FFAARM
C[C@@H]1OCCC[C@H]1C(=O)Nc1cccc(C(=O)N2CCCC[C@H]2C(=O)[O-])c1	ZINC000668274523	1027582050	/nfs/dbraw/zinc/58/20/50/1027582050.db2.gz	FQQAYIWKXPVUTG-XKQJLSEDSA-N	-1	0	374.437	2.520	50	0		FFAARM
CC(C)c1noc(CN(C)CC(=O)Nc2ccc(Cl)c(C(=O)[O-])c2)n1	ZINC000244882419	209911883	/nfs/dbraw/zinc/91/18/83/209911883.db2.gz	XRKHSTDDAWRRRX-UHFFFAOYSA-N	-1	0	366.805	2.615	50	0		FFAARM
CCC[C@H](NC(=O)[C@@H](NC(=O)OCc1ccccc1)[C@@H](C)CC)C(=O)[O-]	ZINC000004761923	209500427	/nfs/dbraw/zinc/50/04/27/209500427.db2.gz	PROMKSSJWWAGTP-BPUTZDHNSA-N	-1	0	364.442	2.697	50	0		FFAARM
COCCn1c(=O)c2ccc(C(=O)NCc3ccccc3)cc2[n-]c1=S	ZINC000003043522	209399082	/nfs/dbraw/zinc/39/90/82/209399082.db2.gz	DUYKRRKOLVBISH-UHFFFAOYSA-N	-1	0	369.446	2.635	50	0		FFAARM
O=C(Cn1c(=O)c2ccccc2[n-]c1=S)N1CCc2ccccc2C1	ZINC000003043449	209398455	/nfs/dbraw/zinc/39/84/55/209398455.db2.gz	YHOGIKJKWPQKBZ-UHFFFAOYSA-N	-1	0	351.431	2.644	50	0		FFAARM
COc1cccc(N2C(=O)C(Cl)=C(Nc3ccc(C(=O)[O-])cc3)C2=O)c1	ZINC000000812727	209377392	/nfs/dbraw/zinc/37/73/92/209377392.db2.gz	OWANXVIAQAJXDE-UHFFFAOYSA-N	-1	0	372.764	2.829	50	0		FFAARM
COc1ccc(NC(=O)c2c([O-])c3cccc4c3n(c2=O)CC4)c(C)c1	ZINC000170624801	209376213	/nfs/dbraw/zinc/37/62/13/209376213.db2.gz	FTHXCWVCTLHQMN-UHFFFAOYSA-N	-1	0	350.374	2.833	50	0		FFAARM
C[C@@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)N1CCCC[C@@H]1C(=O)[O-]	ZINC000136520281	209374083	/nfs/dbraw/zinc/37/40/83/209374083.db2.gz	MHSZUFBELCOXRZ-BXKDBHETSA-N	-1	0	373.236	2.577	50	0		FFAARM
O=C([O-])CN(Cc1ccc(C(F)(F)F)cc1)C(=O)CC1CCOCC1	ZINC000238125899	209360573	/nfs/dbraw/zinc/36/05/73/209360573.db2.gz	JHLCKOBCOCIXHZ-UHFFFAOYSA-N	-1	0	359.344	2.935	50	0		FFAARM
O=C([O-])c1ccc(CNC(=O)[C@@H]2CCCN2Cc2ccc(F)cc2)cc1	ZINC000238115059	209360160	/nfs/dbraw/zinc/36/01/60/209360160.db2.gz	LWCNKCFUTBDZSD-SFHVURJKSA-N	-1	0	356.397	2.805	50	0		FFAARM
O=C([O-])C1CCN(C(=O)[C@@H]2C[C@H]2c2cccc(Br)c2)CC1	ZINC000238026934	209357792	/nfs/dbraw/zinc/35/77/92/209357792.db2.gz	GSPSFIRDDMQGAD-UONOGXRCSA-N	-1	0	352.228	2.876	50	0		FFAARM
O=C([O-])c1ccc(C(=O)NCC2(c3ccc(Cl)cc3)CCOCC2)cn1	ZINC000238008846	209357652	/nfs/dbraw/zinc/35/76/52/209357652.db2.gz	SZIHNADYUZIESE-UHFFFAOYSA-N	-1	0	374.824	2.911	50	0		FFAARM
O=C([O-])CCN(C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1F)C1CCOCC1	ZINC000238068812	209357701	/nfs/dbraw/zinc/35/77/01/209357701.db2.gz	PEMYCTQANMGCPC-LSDHHAIUSA-N	-1	0	353.365	2.551	50	0		FFAARM
O=C([O-])CC[C@@H]1CCCCN1C(=O)c1cc(N2CCCC2=O)ccc1F	ZINC000237938092	209357023	/nfs/dbraw/zinc/35/70/23/209357023.db2.gz	ZTVLMXCEHBAUBZ-ZDUSSCGKSA-N	-1	0	362.401	2.812	50	0		FFAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)c2cc(N3CCCC3=O)ccc2F)C1	ZINC000237968152	209356374	/nfs/dbraw/zinc/35/63/74/209356374.db2.gz	FDCWASBMUGRLQI-ZDUSSCGKSA-N	-1	0	362.401	2.670	50	0		FFAARM
Cn1cc(CCC(=O)N(CCC(=O)[O-])C2CCOCC2)c2ccccc21	ZINC000237766315	209354345	/nfs/dbraw/zinc/35/43/45/209354345.db2.gz	WWMXZTQISZGIIX-UHFFFAOYSA-N	-1	0	358.438	2.593	50	0		FFAARM
CCc1[nH]nc(S(=O)(=O)[N-]c2ccc(C(C)C)cc2)c1C(=O)OC	ZINC000048991546	209331958	/nfs/dbraw/zinc/33/19/58/209331958.db2.gz	HFOYZUIMQONCSQ-UHFFFAOYSA-N	-1	0	351.428	2.683	50	0		FFAARM
C[C@@H](CC(=O)N1CCO[C@H](CC(=O)[O-])C1)c1ccc(C(F)(F)F)cc1	ZINC000237335552	209347026	/nfs/dbraw/zinc/34/70/26/209347026.db2.gz	WGVZSJSKMQQKSZ-SMDDNHRTSA-N	-1	0	359.344	2.901	50	0		FFAARM
COc1ccccc1-c1nn(C)cc1C(=O)N1CCC[C@@H](CCC(=O)[O-])C1	ZINC000237327181	209344924	/nfs/dbraw/zinc/34/49/24/209344924.db2.gz	SEWIWGHRLKVLEW-AWEZNQCLSA-N	-1	0	371.437	2.813	50	0		FFAARM
CCn1c(=O)c2ccc(C(=O)NCCc3cccc(C)c3)cc2[n-]c1=S	ZINC000104107830	209258607	/nfs/dbraw/zinc/25/86/07/209258607.db2.gz	GRZDUBRHAURENB-UHFFFAOYSA-N	-1	0	367.474	2.986	50	0		FFAARM
CN(C(=O)c1ccc2c(c1)[n-]c(=S)n(C)c2=O)[C@@H]1CCc2ccccc21	ZINC000102832869	209242186	/nfs/dbraw/zinc/24/21/86/209242186.db2.gz	OYJMGGPRVHSLAY-QGZVFWFLSA-N	-1	0	365.458	2.982	50	0		FFAARM
C[C@@H](CNC(=O)c1ccc2c(c1)[n-]c(=S)n(C)c2=O)c1ccccc1	ZINC000102166594	209233108	/nfs/dbraw/zinc/23/31/08/209233108.db2.gz	KBCBYJXARVNLBQ-LBPRGKRZSA-N	-1	0	353.447	2.756	50	0		FFAARM
CCOc1ccc(-c2nc(CC(=O)N3CCC[C@@H]3C(=O)[O-])cs2)cc1	ZINC000236869246	209232952	/nfs/dbraw/zinc/23/29/52/209232952.db2.gz	LIIVBWVPBKELKX-OAHLLOKOSA-N	-1	0	360.435	2.827	50	0		FFAARM
COc1cccc(NCc2cc(=O)n3nc(-c4cccs4)[n-]c3n2)c1	ZINC000101842098	209231396	/nfs/dbraw/zinc/23/13/96/209231396.db2.gz	HUOUYIONRRSSQK-UHFFFAOYSA-N	-1	0	353.407	2.767	50	0		FFAARM
Cc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccc(F)cc4)c=3c2=O)cc1C	ZINC000101168220	209221720	/nfs/dbraw/zinc/22/17/20/209221720.db2.gz	YCENAKLSGQJLSJ-IRXDYDNUSA-N	-1	0	352.369	2.936	50	0		FFAARM
C/C(=C/C(=O)N1CCO[C@@H](CC(=O)[O-])C1)c1cccc(C(F)(F)F)c1	ZINC000236628042	209191642	/nfs/dbraw/zinc/19/16/42/209191642.db2.gz	UNIBESDVWNKIGB-JOHMGYAOSA-N	-1	0	357.328	2.811	50	0		FFAARM
CC[C@@H](c1nc(-c2ccco2)nn1CC(=O)[O-])N1Cc2ccccc2C1=O	ZINC000097495275	209182639	/nfs/dbraw/zinc/18/26/39/209182639.db2.gz	UXSOHPRIPHONRD-AWEZNQCLSA-N	-1	0	366.377	2.730	50	0		FFAARM
CCn1ncc(S(=O)(=O)[N-]c2cnn(Cc3cccc(C)c3)c2)c1C	ZINC000002804659	206936656	/nfs/dbraw/zinc/93/66/56/206936656.db2.gz	YMPQXCQWTHIYRF-UHFFFAOYSA-N	-1	0	359.455	2.565	50	0		FFAARM
COc1ccc(Cc2nnc(Nc3cc(OC)ccc3OC)[n-]c2=O)cc1	ZINC000005154465	207085385	/nfs/dbraw/zinc/08/53/85/207085385.db2.gz	JJIYWQUHTCSRDI-UHFFFAOYSA-N	-1	0	368.393	2.525	50	0		FFAARM
CCc1ccc(NC(=O)[C@H](Cc2ccc(OC)cc2)c2nnn[n-]2)cc1	ZINC000005444925	207101124	/nfs/dbraw/zinc/10/11/24/207101124.db2.gz	RZDDTKUGCPKJLX-QGZVFWFLSA-N	-1	0	351.410	2.736	50	0		FFAARM
O=C([O-])[C@H]1C2CCC(CC2)[C@H]1C(=O)N1CCN(CCc2ccccc2)CC1	ZINC000006742626	207160351	/nfs/dbraw/zinc/16/03/51/207160351.db2.gz	XIVKBHMAJIFYJK-TUNPWDSISA-N	-1	0	370.493	2.510	50	0		FFAARM
O=C([O-])[C@@H]1CCCN(C(=O)c2cnn(-c3ccccc3)c2-n2cccc2)C1	ZINC000006751422	207160831	/nfs/dbraw/zinc/16/08/31/207160831.db2.gz	DDEIXYOKEYRRAB-OAHLLOKOSA-N	-1	0	364.405	2.600	50	0		FFAARM
Cc1nn([C@H](C)C(=O)[O-])c(=O)n1-c1ccc(OCc2ccccc2)cc1	ZINC000006925413	207178569	/nfs/dbraw/zinc/17/85/69/207178569.db2.gz	IUPSRCJRVQLHCV-CYBMUJFWSA-N	-1	0	353.378	2.567	50	0		FFAARM
O=C([O-])Cc1ccc(N[C@H]2CC(=O)N(Cc3ccc(Cl)cc3)C2=O)cc1	ZINC000006831090	207169849	/nfs/dbraw/zinc/16/98/49/207169849.db2.gz	DQDOTRUBXUCWCL-INIZCTEOSA-N	-1	0	372.808	2.707	50	0		FFAARM
Cc1ccc([N-]S(=O)(=O)c2c(C)nc3sccn3c2=O)c(Cl)c1	ZINC000006822897	207170322	/nfs/dbraw/zinc/17/03/22/207170322.db2.gz	KWNLERBANPHIBX-UHFFFAOYSA-N	-1	0	369.855	2.827	50	0		FFAARM
CC(=O)Nc1cc(C(=O)COC(=O)C2=Cc3ccccc3OC2)ccc1[O-]	ZINC000008727805	207244676	/nfs/dbraw/zinc/24/46/76/207244676.db2.gz	XAYQNBKNHFEURF-UHFFFAOYSA-N	-1	0	367.357	2.553	50	0		FFAARM
CONC(=O)c1ccccc1[N-]S(=O)(=O)c1cccc(C(F)(F)F)c1	ZINC000012778690	207420182	/nfs/dbraw/zinc/42/01/82/207420182.db2.gz	BPXCUWQSERSUBA-UHFFFAOYSA-N	-1	0	374.340	2.797	50	0		FFAARM
CN(c1ccccc1)S(=O)(=O)c1cc(C(=O)[O-])ccc1Br	ZINC000013264816	207454330	/nfs/dbraw/zinc/45/43/30/207454330.db2.gz	MDJTWFKHYMOLDR-UHFFFAOYSA-N	-1	0	370.224	2.972	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)c1cccc(CN2CCCC2=O)c1)c1ccccc1	ZINC000013427921	207459444	/nfs/dbraw/zinc/45/94/44/207459444.db2.gz	OIBJWFUUKBFGTG-SFHVURJKSA-N	-1	0	366.417	2.755	50	0		FFAARM
O=C(OC[C@H]1CCCO1)c1ccccc1[N-]S(=O)(=O)c1cccs1	ZINC000032666456	208036383	/nfs/dbraw/zinc/03/63/83/208036383.db2.gz	QBKMBZYUGDRZKA-GFCCVEGCSA-N	-1	0	367.448	2.885	50	0		FFAARM
COc1ccc(-c2c(C(F)(F)F)nn(C)c2NC(=O)/C=C/C(=O)[O-])cc1	ZINC000035324956	208120578	/nfs/dbraw/zinc/12/05/78/208120578.db2.gz	QUKQQIGKTLCMGW-BQYQJAHWSA-N	-1	0	369.299	2.694	50	0		FFAARM
NC1=NC(=O)C(CCC[C@@H](C(=O)[O-])c2cccc3ccccc32)C(=O)N1	ZINC000039438677	208211781	/nfs/dbraw/zinc/21/17/81/208211781.db2.gz	OAAWMZINEDCHGN-CQSZACIVSA-N	-1	0	353.378	2.814	50	0		FFAARM
CC[C@H](C)N(C(=O)CS(=O)(=O)c1nc2ccccc2[n-]1)[C@@H](C)CC	ZINC000040152114	208235606	/nfs/dbraw/zinc/23/56/06/208235606.db2.gz	AQDJYRVBSYEDHY-STQMWFEESA-N	-1	0	351.472	2.762	50	0		FFAARM
C[C@]1(C(=O)[O-])CCN(C(=O)[C@@H]2C[C@H]2c2cccc(Br)c2)C1	ZINC000299745548	208342690	/nfs/dbraw/zinc/34/26/90/208342690.db2.gz	QZYCNZYTEKGAQQ-ZENOOKHLSA-N	-1	0	352.228	2.876	50	0		FFAARM
O=C([O-])C[C@@H]1CN(C(=O)c2ccc(Oc3cccc(F)c3)cc2)CCO1	ZINC000299749892	208356542	/nfs/dbraw/zinc/35/65/42/208356542.db2.gz	LZCWVFCMQUHCSN-QGZVFWFLSA-N	-1	0	359.353	2.934	50	0		FFAARM
O=C([C@H](c1ccccc1)S(=O)(=O)c1nc2ccccc2[n-]1)N1CCCC1	ZINC000047939816	208384431	/nfs/dbraw/zinc/38/44/31/208384431.db2.gz	QLQIUZMPLGHZMW-KRWDZBQOSA-N	-1	0	369.446	2.700	50	0		FFAARM
O=C(NC1(c2ccccc2)CCC1)c1cccc(-n2[n-]c(=O)ccc2=O)c1	ZINC000061412326	208597915	/nfs/dbraw/zinc/59/79/15/208597915.db2.gz	QEAQLTRAFFZDQS-UHFFFAOYSA-N	-1	0	361.401	2.747	50	0		FFAARM
COc1cccc(C[C@]2(C(=O)[O-])CCCN(c3nc(CO)cs3)C2)c1	ZINC000071757086	208775161	/nfs/dbraw/zinc/77/51/61/208775161.db2.gz	BSCYOZFTKLZVMP-GOSISDBHSA-N	-1	0	362.451	2.558	50	0		FFAARM
CCc1cccc(NC(=O)N2CCC3(CCC(=O)N(CC(=O)[O-])C3)CC2)c1	ZINC000091595529	208982766	/nfs/dbraw/zinc/98/27/66/208982766.db2.gz	FCRWLGFJRIGJSR-UHFFFAOYSA-N	-1	0	373.453	2.570	50	0		FFAARM
Cc1cccc2nc(C(=O)N3C[C@@H](c4ccccc4)[C@H](C(=O)[O-])C3)c(F)n21	ZINC000091871953	209002908	/nfs/dbraw/zinc/00/29/08/209002908.db2.gz	NKDLTTJGHLNYCF-LSDHHAIUSA-N	-1	0	367.380	2.722	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)c2ccc3nccnc3c2)C[C@H]1c1cccc(F)c1	ZINC000091943573	209005857	/nfs/dbraw/zinc/00/58/57/209005857.db2.gz	BVZRKWYBEDDGQN-JKSUJKDBSA-N	-1	0	365.364	2.709	50	0		FFAARM
Cc1nc(C)c(C(=O)N2C[C@H]3COc4ccccc4C[C@@]3(C(=O)[O-])C2)s1	ZINC000095353253	209022775	/nfs/dbraw/zinc/02/27/75/209022775.db2.gz	VTCVNTUHBIYQQK-IFXJQAMLSA-N	-1	0	372.446	2.538	50	0		FFAARM
CCOc1cc(F)cc([C@@H](C(=O)[O-])N2CCN(Cc3cccnc3)CC2)c1	ZINC000095372312	209034546	/nfs/dbraw/zinc/03/45/46/209034546.db2.gz	MIMCGLCLXABNHL-IBGZPJMESA-N	-1	0	373.428	2.563	50	0		FFAARM
Cc1nn(C)c(C)c1[C@H](C)C(=O)NC[C@H](Cc1ccc(C)cc1)C(=O)[O-]	ZINC000095425425	209049280	/nfs/dbraw/zinc/04/92/80/209049280.db2.gz	HUTOUQWHIMVNBW-GUYCJALGSA-N	-1	0	357.454	2.509	50	0		FFAARM
COc1ccc(C(=O)N(C)CCc2ccc(F)cc2)cc1OCC(=O)[O-]	ZINC000095424322	209049312	/nfs/dbraw/zinc/04/93/12/209049312.db2.gz	VBICDVFLZKMJHO-UHFFFAOYSA-N	-1	0	361.369	2.612	50	0		FFAARM
Cc1ccc(N2C[C@@H](C)N(Cc3ccc(OCC(=O)[O-])cc3)CC2=O)cc1	ZINC000091819862	132203999	/nfs/dbraw/zinc/20/39/99/132203999.db2.gz	AXPGLCCPNOQLPK-MRXNPFEDSA-N	-1	0	368.433	2.696	50	0		FFAARM
Cc1cccc(N2CCN(S(=O)(=O)c3cccc(C(=O)[O-])c3)CC2)c1C	ZINC000006710166	132258847	/nfs/dbraw/zinc/25/88/47/132258847.db2.gz	FBKFUQDXYDTTNT-UHFFFAOYSA-N	-1	0	374.462	2.513	50	0		FFAARM
C[C@H](CC(=O)[O-])CC(=O)N1CCN(c2cccc(C(F)(F)F)c2)CC1	ZINC000017073914	132373813	/nfs/dbraw/zinc/37/38/13/132373813.db2.gz	KHTXRVHWAGYJEW-LBPRGKRZSA-N	-1	0	358.360	2.855	50	0		FFAARM
COc1ccccc1N1CCN(c2ccc(NC(C)=O)c(C(=O)[O-])c2)CC1	ZINC000064590006	136133483	/nfs/dbraw/zinc/13/34/83/136133483.db2.gz	MUBSNFJKGFKIHR-UHFFFAOYSA-N	-1	0	369.421	2.678	50	0	biogenic	FFAARM
O=C([O-])[C@@H]1CN(C(=O)CC23CC4CC(CC(C4)C2)C3)C[C@H]1c1ncc[nH]1	ZINC000095521578	209074510	/nfs/dbraw/zinc/07/45/10/209074510.db2.gz	HUYGCLASCPVALY-GSTHLXFWSA-N	-1	0	357.454	2.643	50	0		FFAARM
COc1ccc(OC)c([C@H]2N[C@H](C(=O)[O-])Cc3c4ccccc4[nH]c32)c1	ZINC000000754301	506230251	/nfs/dbraw/zinc/23/02/51/506230251.db2.gz	IQTPIYGSTAUKJL-QFBILLFUSA-N	-1	0	352.390	2.873	50	0	biogenic	FFAARM
CCOC(=O)c1cc(S(=O)(=O)[N-]c2cc(C)ccc2OC)c(C)n1C	ZINC000064923347	506242136	/nfs/dbraw/zinc/24/21/36/506242136.db2.gz	MPDQCSUYKGATEL-UHFFFAOYSA-N	-1	0	366.439	2.628	50	0		FFAARM
CSc1nc([N-]S(=O)(=O)c2cc(Cl)sc2Cl)nn1C	ZINC000001023943	506244466	/nfs/dbraw/zinc/24/44/66/506244466.db2.gz	UDIMNUCBVLPEDD-UHFFFAOYSA-N	-1	0	359.285	2.706	50	0		FFAARM
O=C([O-])CCNC(=O)/C(=C\C=C\c1ccccc1)NC(=O)c1ccccc1	ZINC000002083255	506270583	/nfs/dbraw/zinc/27/05/83/506270583.db2.gz	LCHWSKYUXRJEFA-CVUDBVLYSA-N	-1	0	364.401	2.605	50	0		FFAARM
CC(=O)Nc1ccc(S(=O)(=O)Nc2cc(Cl)ccc2C(=O)[O-])cc1	ZINC000002647540	506286918	/nfs/dbraw/zinc/28/69/18/506286918.db2.gz	LZPIPKUJAHFIGJ-UHFFFAOYSA-N	-1	0	368.798	2.797	50	0		FFAARM
Cn1c(SCC(=O)Nc2cccc(C(=O)[O-])c2)nnc1-c1ccccc1	ZINC000002860631	506298144	/nfs/dbraw/zinc/29/81/44/506298144.db2.gz	PEDKOOIUVHYYDD-UHFFFAOYSA-N	-1	0	368.418	2.911	50	0		FFAARM
Cc1ccc(OCC(=O)NC(=S)Nc2cc(C(=O)[O-])ccc2C)cc1	ZINC000002998955	506305151	/nfs/dbraw/zinc/30/51/51/506305151.db2.gz	OYFBAGUHMQXOJV-UHFFFAOYSA-N	-1	0	358.419	2.894	50	0		FFAARM
CCOc1ccc([C@@H](CC(=O)[O-])NC(=O)COc2ccccc2OC)cc1	ZINC000003624787	506347620	/nfs/dbraw/zinc/34/76/20/506347620.db2.gz	ZFULXTAMGYPNRP-MRXNPFEDSA-N	-1	0	373.405	2.805	50	0		FFAARM
O=C([O-])[C@@H](Cc1ccccc1)NS(=O)(=O)c1c(Cl)cccc1Cl	ZINC000003887425	506351473	/nfs/dbraw/zinc/35/14/73/506351473.db2.gz	QNWDZDYRTQIGQP-CYBMUJFWSA-N	-1	0	374.245	2.968	50	0		FFAARM
COc1cccc(CCNC(=O)c2ccc3c(c2)[n-]c(=S)[nH]c3=O)c1	ZINC000053467923	506388303	/nfs/dbraw/zinc/38/83/03/506388303.db2.gz	CXBRMXFWQULESC-UHFFFAOYSA-N	-1	0	355.419	2.979	50	0		FFAARM
O=C([O-])CCc1ccc(S(=O)(=O)NCCc2ccc(Cl)cc2)cc1	ZINC000005134933	506424718	/nfs/dbraw/zinc/42/47/18/506424718.db2.gz	FNIJGENKOKEYHY-UHFFFAOYSA-N	-1	0	367.854	2.878	50	0		FFAARM
O=C1CCCN1c1cccc([N-]S(=O)(=O)c2ccc(F)cc2F)c1	ZINC000005329488	506435912	/nfs/dbraw/zinc/43/59/12/506435912.db2.gz	ROPAFVRDHAKGQO-UHFFFAOYSA-N	-1	0	352.362	2.892	50	0		FFAARM
O=C(NCCS(=O)(=O)c1ccc(Cl)cc1)c1ccc([O-])c(Cl)c1	ZINC000054230785	506519952	/nfs/dbraw/zinc/51/99/52/506519952.db2.gz	JYDZFQKWSAOSOJ-UHFFFAOYSA-N	-1	0	374.245	2.903	50	0		FFAARM
CCC(CC)n1c(=O)n(Cc2noc(C(C)C)n2)c2cc(C(=O)[O-])cnc21	ZINC000055195867	506695181	/nfs/dbraw/zinc/69/51/81/506695181.db2.gz	JFAWUHJLTBMYEE-UHFFFAOYSA-N	-1	0	373.413	2.812	50	0		FFAARM
Cc1ccc(-c2csc3ncn([N-]C(=O)c4cnccn4)c(=O)c23)cc1	ZINC000009749351	506711171	/nfs/dbraw/zinc/71/11/71/506711171.db2.gz	VFBIQWPJBDPMFG-UHFFFAOYSA-N	-1	0	363.402	2.607	50	0		FFAARM
O=C(Cc1csc([N-]S(=O)(=O)c2ccccc2)n1)NC1CCCC1	ZINC000009828682	506712271	/nfs/dbraw/zinc/71/22/71/506712271.db2.gz	VMMKIGJROYHKPF-UHFFFAOYSA-N	-1	0	365.480	2.545	50	0		FFAARM
CCOc1ccc(C)cc1S(=O)(=O)[N-]c1ccc2c(c1)CC(=O)N2C	ZINC000010063770	506725374	/nfs/dbraw/zinc/72/53/74/506725374.db2.gz	XHKYFHVCCZQJGV-UHFFFAOYSA-N	-1	0	360.435	2.713	50	0		FFAARM
CCn1c2ccc(NC(=O)c3ccccc3F)cc2nc1[P@@](C)(=O)[O-]	ZINC000012508989	506870012	/nfs/dbraw/zinc/87/00/12/506870012.db2.gz	KBLJRRCAKCFOEC-UHFFFAOYSA-N	-1	0	361.313	2.973	50	0		FFAARM
Cc1ccc(C(=O)[O-])cc1S(=O)(=O)Nc1cccc(N2CCCC2=O)c1	ZINC000012583233	506880427	/nfs/dbraw/zinc/88/04/27/506880427.db2.gz	AENMJLINZZIZBJ-UHFFFAOYSA-N	-1	0	374.418	2.621	50	0		FFAARM
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)[C@@H]1CC=CC[C@H]1C(=O)[O-]	ZINC000012649151	506887247	/nfs/dbraw/zinc/88/72/47/506887247.db2.gz	CEVDAKZMDQZIES-IAGOWNOFSA-N	-1	0	353.422	2.772	50	0		FFAARM
O=C([O-])Cc1csc(NC(=O)[C@@H]2COc3ccc(Cl)cc3C2)n1	ZINC000013407245	506940739	/nfs/dbraw/zinc/94/07/39/506940739.db2.gz	SBUZHPBFRBZIRA-VIFPVBQESA-N	-1	0	352.799	2.613	50	0		FFAARM
CCn1nc(-n2cnnc2)c([N-]S(=O)(=O)c2cc(C)cc(C)c2C)c1C	ZINC000013365696	506940847	/nfs/dbraw/zinc/94/08/47/506940847.db2.gz	KVFARLLQMAVMDR-UHFFFAOYSA-N	-1	0	374.470	2.518	50	0		FFAARM
O=S(=O)([N-]c1ncn(Cc2ccccc2Cl)n1)c1cccs1	ZINC000014250779	506984335	/nfs/dbraw/zinc/98/43/35/506984335.db2.gz	ZYIPWMKUGZTNSK-UHFFFAOYSA-N	-1	0	354.844	2.842	50	0		FFAARM
COc1cc(C)ccc1O[C@H]1C[C@@H](C(=O)[O-])N(C(=O)OC(C)(C)C)C1	ZINC000014632508	506995161	/nfs/dbraw/zinc/99/51/61/506995161.db2.gz	APDSXNZNGSBTGB-STQMWFEESA-N	-1	0	351.399	2.845	50	0		FFAARM
COC(=O)C1=C(C)NC(=O)[C@]1([N-]c1nc2ccccc2s1)C(F)(F)F	ZINC000015202465	507024929	/nfs/dbraw/zinc/02/49/29/507024929.db2.gz	XKVMSAHCFDTUPQ-AWEZNQCLSA-N	-1	0	371.340	2.586	50	0		FFAARM
O=C([O-])CSc1nnc(-c2cn[nH]c2)n1-c1ccccc1C(F)(F)F	ZINC000067855084	507026175	/nfs/dbraw/zinc/02/61/75/507026175.db2.gz	FVAHYSMTEKJIMH-UHFFFAOYSA-N	-1	0	369.328	2.853	50	0		FFAARM
O=C([O-])[C@H]1C2CCC(CC2)[C@@H]1C(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000017073974	507115209	/nfs/dbraw/zinc/11/52/09/507115209.db2.gz	GKGMJZXJBUDAIZ-GNNGFNCTSA-N	-1	0	358.438	2.599	50	0		FFAARM
CCCc1cc(C(N)=O)c(NC(=O)[C@@H]2C3CCC(CC3)[C@@H]2C(=O)[O-])s1	ZINC000017074933	507115282	/nfs/dbraw/zinc/11/52/82/507115282.db2.gz	FXFNZVXJGPCMNV-FEZLSPKCSA-N	-1	0	364.467	2.875	50	0		FFAARM
Cc1cc(Br)ccc1NS(=O)(=O)c1c[nH]c(C(=O)[O-])c1	ZINC000020550047	507224448	/nfs/dbraw/zinc/22/44/48/507224448.db2.gz	LJKRRQICYZXDAE-UHFFFAOYSA-N	-1	0	359.201	2.585	50	0		FFAARM
Cc1ccnn1-c1cccc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2C)c1	ZINC000058366589	507409770	/nfs/dbraw/zinc/40/97/70/507409770.db2.gz	OAHPSVOGFGIYHD-UHFFFAOYSA-N	-1	0	371.418	2.988	50	0		FFAARM
Cc1cc(S(=O)(=O)Nc2cc(F)cc(F)c2)ccc1OCC(=O)[O-]	ZINC000058377389	507410549	/nfs/dbraw/zinc/41/05/49/507410549.db2.gz	RNHURYFSUYBJIL-UHFFFAOYSA-N	-1	0	357.334	2.537	50	0		FFAARM
CCN(c1cccc(F)c1)S(=O)(=O)c1cc(C)cc(C(=O)[O-])c1O	ZINC000058391745	507411574	/nfs/dbraw/zinc/41/15/74/507411574.db2.gz	UTOXTGMUDYYUSI-UHFFFAOYSA-N	-1	0	353.371	2.753	50	0		FFAARM
CC(=O)c1cccc(S(=O)(=O)N2CCCc3cc(C(=O)[O-])ccc32)c1	ZINC000058772851	507462844	/nfs/dbraw/zinc/46/28/44/507462844.db2.gz	JMDVWLQYJAUJEJ-UHFFFAOYSA-N	-1	0	359.403	2.729	50	0		FFAARM
CCOC(=O)c1[nH]c2ccc(OC)cc2c1NC(=O)[C@@H]1[C@@H](C(=O)[O-])C1(C)C	ZINC000071279453	507698522	/nfs/dbraw/zinc/69/85/22/507698522.db2.gz	UQYQULXLCVFVSY-STQMWFEESA-N	-1	0	374.393	2.649	50	0		FFAARM
O=C([O-])C1(NC(=O)[C@H]2CC(=O)N(c3ccc(Cl)cc3)C2)CCCCC1	ZINC000071817366	507717640	/nfs/dbraw/zinc/71/76/40/507717640.db2.gz	HMXDHKCYDYBFQV-LBPRGKRZSA-N	-1	0	364.829	2.597	50	0		FFAARM
Cn1ccc(NC(=O)c2ccccc2[N-]S(=O)(=O)c2cccs2)n1	ZINC000028497254	507727214	/nfs/dbraw/zinc/72/72/14/507727214.db2.gz	FVFLOJKFDOFTBM-UHFFFAOYSA-N	-1	0	362.436	2.535	50	0		FFAARM
O=C([O-])[C@@H]1CC=CC[C@H]1C(=O)Nc1cccc(CN2CCCCC2=O)c1	ZINC000051186056	507748784	/nfs/dbraw/zinc/74/87/84/507748784.db2.gz	VNUPHNBKQPRWKO-IAGOWNOFSA-N	-1	0	356.422	2.805	50	0		FFAARM
O=C([O-])c1ccc(C[C@H]2CCCN(C(=O)CCCc3cn[nH]c3)C2)cc1	ZINC000072158816	507764661	/nfs/dbraw/zinc/76/46/61/507764661.db2.gz	KDFIFFCDWCNLEC-MRXNPFEDSA-N	-1	0	355.438	2.912	50	0		FFAARM
COc1ccccc1Oc1ccc(NC(=O)c2nccnc2C(=O)[O-])cn1	ZINC000072401623	507783154	/nfs/dbraw/zinc/78/31/54/507783154.db2.gz	RMWBJAWTXTXLCO-UHFFFAOYSA-N	-1	0	366.333	2.623	50	0		FFAARM
O=C([O-])CCc1cc2n(n1)CCCN(Cc1ccc(-c3cc[nH]n3)s1)C2	ZINC000072475895	507796473	/nfs/dbraw/zinc/79/64/73/507796473.db2.gz	XWWHPBAWYSLEPW-UHFFFAOYSA-N	-1	0	371.466	2.758	50	0		FFAARM
O=C([O-])CCc1cc2n(n1)CCCN(C(=O)c1csc3c1CCCC3)C2	ZINC000072479096	507797175	/nfs/dbraw/zinc/79/71/75/507797175.db2.gz	QRCMGGPGZAOLLY-UHFFFAOYSA-N	-1	0	373.478	2.887	50	0		FFAARM
COc1ccccc1OC1(C(=O)[O-])CCN(C(=O)[C@H]2CC=CCC2)CC1	ZINC000072481414	507797663	/nfs/dbraw/zinc/79/76/63/507797663.db2.gz	QRNBRPMAPUWRGC-HNNXBMFYSA-N	-1	0	359.422	2.876	50	0		FFAARM
O=C([O-])[C@H](NC(=O)c1nc(C2CC2)n(-c2ccccc2)n1)c1ccccc1	ZINC000089825891	507871531	/nfs/dbraw/zinc/87/15/31/507871531.db2.gz	ARIWZPMPSQRXNG-MRXNPFEDSA-N	-1	0	362.389	2.700	50	0		FFAARM
COC(=O)C[C@H](c1ccccc1)c1c([O-])nc2ccc(Cl)cn2c1=O	ZINC000096117158	508206762	/nfs/dbraw/zinc/20/67/62/508206762.db2.gz	RWXOJZSRVGFOAQ-CYBMUJFWSA-N	-1	0	358.781	2.749	50	0		FFAARM
CCN1C[C@@]2(CCCN(C(=O)c3ccc([O-])c(Cl)c3)C2)CCC1=O	ZINC000082160777	508227319	/nfs/dbraw/zinc/22/73/19/508227319.db2.gz	JAWBSHQLGNCJKC-GOSISDBHSA-N	-1	0	350.846	2.910	50	0		FFAARM
C[C@@H](CN(C)C(=O)c1cc2ccccc2cc1OC(F)F)c1nnn[n-]1	ZINC000124162281	508790672	/nfs/dbraw/zinc/79/06/72/508790672.db2.gz	JFQQITDHXZBMFI-JTQLQIEISA-N	-1	0	361.352	2.830	50	0		FFAARM
O=S(=O)(C[C@@H]1CCCCO1)[N-]c1ccccc1-c1n[nH]c(C2CC2)n1	ZINC000150840941	508905272	/nfs/dbraw/zinc/90/52/72/508905272.db2.gz	PTYQCNQQNIHQFR-ZDUSSCGKSA-N	-1	0	362.455	2.660	50	0		FFAARM
O=C(c1ccc2[n-]c(=S)oc2c1)N1CCOC[C@@H]1[C@H]1CCCCC1=O	ZINC000160522583	508997901	/nfs/dbraw/zinc/99/79/01/508997901.db2.gz	CMYIKAVMSGHPPK-TZMCWYRMSA-N	-1	0	360.435	2.717	50	0		FFAARM
O=C([O-])CCC(=O)N1N=C(c2ccc[nH]2)C[C@@H]1c1cnc2ccccc2n1	ZINC000225504417	509373878	/nfs/dbraw/zinc/37/38/78/509373878.db2.gz	LRLORWYUUNUHQA-QGZVFWFLSA-N	-1	0	363.377	2.500	50	0		FFAARM
CC(=O)N1CCc2cc(C(=O)N[C@H](CC(=O)[O-])c3ccccc3C)ccc21	ZINC000236591833	509460930	/nfs/dbraw/zinc/46/09/30/509460930.db2.gz	CTVSXCSSAYEFFY-GOSISDBHSA-N	-1	0	366.417	2.850	50	0		FFAARM
Cc1c(C(=O)N(CCC(=O)[O-])C2CCOCC2)cnn1-c1ccccc1C	ZINC000237735915	509721895	/nfs/dbraw/zinc/72/18/95/509721895.db2.gz	JXUKABJLCCUDQG-UHFFFAOYSA-N	-1	0	371.437	2.585	50	0		FFAARM
COc1cccc2cc(C(N)=O)c(=Nc3cccc(/C=C\C(=O)[O-])c3)oc21	ZINC000252640201	509855723	/nfs/dbraw/zinc/85/57/23/509855723.db2.gz	YREGUCCVYVBXOV-JYPWNVOHSA-N	-1	0	364.357	2.871	50	0		FFAARM
Cc1nc(NC(=O)CN(C)Cc2cnc3ccccc3c2)sc1C(=O)[O-]	ZINC000244724682	509867509	/nfs/dbraw/zinc/86/75/09/509867509.db2.gz	MYNSZJAYLCYWAJ-UHFFFAOYSA-N	-1	0	370.434	2.768	50	0		FFAARM
Cc1c([N-]S(=O)(=O)c2ccc3c(c2)OCCO3)cnn1C1CCCC1	ZINC000194226390	510269006	/nfs/dbraw/zinc/26/90/06/510269006.db2.gz	CJMIOQCPJTUKOM-UHFFFAOYSA-N	-1	0	363.439	2.879	50	0		FFAARM
O=C([O-])CCN(Cc1cccc(F)c1F)C(=O)Cc1c[nH]c2ncccc12	ZINC000190832988	510365372	/nfs/dbraw/zinc/36/53/72/510365372.db2.gz	CFPXQTVVVYRWDE-UHFFFAOYSA-N	-1	0	373.359	2.887	50	0		FFAARM
CC[C@@](NC(=O)c1cccc(C(=O)N(C)C)c1)(C(=O)[O-])c1ccccc1	ZINC000262834668	510432807	/nfs/dbraw/zinc/43/28/07/510432807.db2.gz	YJGHWYOMUKLKGT-FQEVSTJZSA-N	-1	0	354.406	2.508	50	0		FFAARM
CCO[C@H]1C[C@@](NC(=O)c2ccc(-n3ccc(C)n3)cc2)(C(=O)[O-])C1(C)C	ZINC000262837736	510434201	/nfs/dbraw/zinc/43/42/01/510434201.db2.gz	SVOFYEKXNSZSPW-OXJNMPFZSA-N	-1	0	371.437	2.569	50	0		FFAARM
O=C([O-])COc1cccc(C(=O)N[C@H]2CCO[C@@H](c3ccccc3)C2)c1	ZINC000262850791	510439839	/nfs/dbraw/zinc/43/98/39/510439839.db2.gz	WWLUVJMSSZXYFW-FUHWJXTLSA-N	-1	0	355.390	2.800	50	0		FFAARM
CC[C@](NC(=O)c1ccc2c(c1)CCC(=O)N2C)(C(=O)[O-])c1ccccc1	ZINC000263253288	510632160	/nfs/dbraw/zinc/63/21/60/510632160.db2.gz	KDOSIJFVXMQLRK-OAQYLSRUSA-N	-1	0	366.417	2.716	50	0		FFAARM
C[C@@H](Cc1cncc2ccccc21)C(=O)NCCc1nc(C(=O)[O-])cs1	ZINC000585139517	518545383	/nfs/dbraw/zinc/54/53/83/518545383.db2.gz	KHCNTNLIAWSESB-LBPRGKRZSA-N	-1	0	369.446	2.927	50	0		FFAARM
Cc1ccc2c(c1)CN([C@H](C)C(=O)NCc1ccc(C(=O)[O-])cc1)CCO2	ZINC000580964018	519452422	/nfs/dbraw/zinc/45/24/22/519452422.db2.gz	KQFVQTRWDMYLOI-OAHLLOKOSA-N	-1	0	368.433	2.593	50	0		FFAARM
COc1cc(C2NC(=O)N=C2c2c([O-])c3ccccc3oc2=O)ccc1O	ZINC000604405355	520553038	/nfs/dbraw/zinc/55/30/38/520553038.db2.gz	ZQJFQWFZNSFOME-UHFFFAOYSA-N	-1	0	366.329	2.976	50	0	biogenic	FFAARM
COc1cc(-c2ccccc2)sc1C(=O)N1CCO[C@@H](CC(=O)[O-])C1	ZINC000269054386	521899070	/nfs/dbraw/zinc/89/90/70/521899070.db2.gz	WVYHGCOQZUIJKM-ZDUSSCGKSA-N	-1	0	361.419	2.739	50	0		FFAARM
Cc1nc([C@@H]2CCOC2)sc1C(=O)NCCc1ccc(C(=O)[O-])cc1	ZINC000630098459	522618020	/nfs/dbraw/zinc/61/80/20/522618020.db2.gz	SYHTWXSINDTCPT-CQSZACIVSA-N	-1	0	360.435	2.626	50	0		FFAARM
Cc1cc(C(=O)N2CCOC[C@H]2C(=O)[O-])c(C)n1[C@@H](C)c1ccccc1	ZINC000262560622	526255528	/nfs/dbraw/zinc/25/55/28/526255528.db2.gz	YHYBMNGDIOMSJZ-KSSFIOAISA-N	-1	0	356.422	2.640	50	0		FFAARM
Cc1nn(CCO)cc1-c1c(-c2ccccc2)ncn1[C@@H](C)CC(=O)[O-]	ZINC000091616667	526281761	/nfs/dbraw/zinc/28/17/61/526281761.db2.gz	CRFPSXQVVZTDRZ-ZDUSSCGKSA-N	-1	0	354.410	2.750	50	0		FFAARM
O=C([O-])[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1cc(=O)[nH]c2cc(F)ccc21	ZINC000262342566	526292529	/nfs/dbraw/zinc/29/25/29/526292529.db2.gz	GHMIKGPMGGVJMS-GTTSAUCSSA-N	-1	0	358.369	2.937	50	0		FFAARM
O=C([O-])[C@H]1CCN(C(=O)CCc2cc(Cl)ccc2Br)C1	ZINC000178264824	526325968	/nfs/dbraw/zinc/32/59/68/526325968.db2.gz	KAEAQLSUBAIYLU-JTQLQIEISA-N	-1	0	360.635	2.968	50	0		FFAARM
O=C([O-])COc1cccc(CNC(=O)[C@H]2SCCc3sccc32)c1	ZINC000268901587	527618480	/nfs/dbraw/zinc/61/84/80/527618480.db2.gz	FXBBGOVTJDZLEV-INIZCTEOSA-N	-1	0	363.460	2.858	50	0		FFAARM
O=C([O-])[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]1OCCc2ccccc21	ZINC000299743740	527648032	/nfs/dbraw/zinc/64/80/32/527648032.db2.gz	LZMGZBQTOBXXPZ-MOPGFXCFSA-N	-1	0	364.401	2.594	50	0		FFAARM
Cc1ccc(N(Cc2nn3c([n-]2)nc(C)cc3=O)C(=O)C(C)(C)C)cc1	ZINC000101581845	570860009	/nfs/dbraw/zinc/86/00/09/570860009.db2.gz	VTOOHACNBJSPFI-UHFFFAOYSA-N	-1	0	353.426	2.614	50	0		FFAARM
O=C([O-])CCN(Cc1cccc(F)c1F)C(=O)c1ccnc(C2CC2)n1	ZINC000170044843	571260955	/nfs/dbraw/zinc/26/09/55/571260955.db2.gz	TYEJOUFKIZLMJB-UHFFFAOYSA-N	-1	0	361.348	2.749	50	0		FFAARM
COc1ccccc1CN(Cc1cccnc1)C(=O)N[C@@H](C(=O)[O-])C(C)C	ZINC000670433913	571346069	/nfs/dbraw/zinc/34/60/69/571346069.db2.gz	BBZRCYBDZWVBRL-GOSISDBHSA-N	-1	0	371.437	2.911	50	0		FFAARM
CC(C)Cc1cc(C(=O)N[C@H]2CCC[N@H+](Cc3cccs3)C2)[nH]c(=O)n1	ZINC000670444632	571349901	/nfs/dbraw/zinc/34/99/01/571349901.db2.gz	OKSFSRDTCHKVTE-AWEZNQCLSA-N	-1	0	374.510	2.837	50	0		FFAARM
Cc1coc(-c2ccc(C)c(S(=O)(=O)N3CCCC[C@H]3C(=O)[O-])c2)n1	ZINC000656512829	731586680	/nfs/dbraw/zinc/58/66/80/731586680.db2.gz	SFDMGPKEFSVOCP-AWEZNQCLSA-N	-1	0	364.423	2.586	50	0		FFAARM
CN(C)C(=O)c1ccnc([N-]S(=O)(=O)c2ccc(C(F)F)cc2)c1	ZINC000585083535	845948224	/nfs/dbraw/zinc/94/82/24/845948224.db2.gz	XOLHFTHSWUNFLC-UHFFFAOYSA-N	-1	0	355.366	2.522	50	0		FFAARM
O=C([O-])c1cccc(C(=O)N2CCC(OCCc3ccccc3)CC2)n1	ZINC000262073576	966312601	/nfs/dbraw/zinc/31/26/01/966312601.db2.gz	FWHUSDPKMLXPEB-UHFFFAOYSA-N	-1	0	354.406	2.644	50	0		FFAARM
CN(C)Cc1nc(C(=O)N2CC[C@H](Cc3cccc(C(=O)[O-])c3)C2)cs1	ZINC000072122392	1019816101	/nfs/dbraw/zinc/81/61/01/1019816101.db2.gz	DARMZHVXBATYOS-CQSZACIVSA-N	-1	0	373.478	2.608	50	0		FFAARM
Cc1cc(C(=O)N[C@@H](CC(=O)[O-])c2ccccc2)ccc1N1CCOCC1	ZINC000647598751	1023097018	/nfs/dbraw/zinc/09/70/18/1023097018.db2.gz	WJCAIDSQLLSHSA-SFHVURJKSA-N	-1	0	368.433	2.777	50	0		FFAARM
COc1ccc(S(=O)(=O)N(CC(=O)[O-])Cc2ccccc2)cc1Cl	ZINC000001077781	219365571	/nfs/dbraw/zinc/36/55/71/219365571.db2.gz	BHNCPFOQINWAQM-UHFFFAOYSA-N	-1	0	369.826	2.624	50	0		FFAARM
COc1cc(OC)cc(C(=O)NC(=S)Nc2ccccc2C(=O)[O-])c1	ZINC000001158042	219383050	/nfs/dbraw/zinc/38/30/50/219383050.db2.gz	VQFLBIZXFUWKSE-UHFFFAOYSA-N	-1	0	360.391	2.529	50	0		FFAARM
CC(=O)N1CCSc2ccc(S(=O)(=O)[N-]c3ccc(C)cn3)cc21	ZINC000032943679	539961133	/nfs/dbraw/zinc/96/11/33/539961133.db2.gz	OZSQUGQRNSKWJH-UHFFFAOYSA-N	-1	0	363.464	2.649	50	0		FFAARM
COc1cc(/C=C/C(=O)NC[C@H](CC(=O)[O-])c2ccccc2)ccc1O	ZINC000004090806	209412544	/nfs/dbraw/zinc/41/25/44/209412544.db2.gz	INIMXTMRPDDBBA-DZZUKKPASA-N	-1	0	355.390	2.789	50	0	biogenic	FFAARM
C[C@@H]1Cc2cccc3c2n1c(=O)c(C(=O)NCc1ccccc1F)c3[O-]	ZINC000170624676	209375937	/nfs/dbraw/zinc/37/59/37/209375937.db2.gz	LWDUTMHYBNBYRD-LLVKDONJSA-N	-1	0	352.365	2.893	50	0		FFAARM
CC(C)(NC(=O)c1ccc2[n-]c(=S)oc2c1)C(=O)NCC1CCCC1	ZINC000126983723	209363863	/nfs/dbraw/zinc/36/38/63/209363863.db2.gz	DJZLEQSRLMIXKN-UHFFFAOYSA-N	-1	0	361.467	2.931	50	0		FFAARM
O=C([O-])CN(C(=O)[C@@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1)C1CCOCC1	ZINC000238102887	209360696	/nfs/dbraw/zinc/36/06/96/209360696.db2.gz	PDKVPQKQEAJEKL-HUUCEWRRSA-N	-1	0	371.355	2.901	50	0		FFAARM
O=C([O-])[C@H]1Cc2ccccc2CN1C(=O)c1cnn(Cc2ccccc2)c1	ZINC000238047082	209358898	/nfs/dbraw/zinc/35/88/98/209358898.db2.gz	CQIBXOUGERWXMQ-LJQANCHMSA-N	-1	0	361.401	2.583	50	0		FFAARM
O=C([O-])c1ccc(C(=O)N[C@@H]2CCN(c3ccccc3Cl)C2=O)s1	ZINC000238034177	209358561	/nfs/dbraw/zinc/35/85/61/209358561.db2.gz	GYHQONGKSNTFOY-SNVBAGLBSA-N	-1	0	364.810	2.635	50	0		FFAARM
O=C([O-])c1ccc(CCC(=O)N2CCC(CN3CCCCC3=O)CC2)cc1	ZINC000238059814	209357989	/nfs/dbraw/zinc/35/79/89/209357989.db2.gz	NOLXLVFAOPGCCN-UHFFFAOYSA-N	-1	0	372.465	2.569	50	0		FFAARM
Cc1nn(Cc2ccc(C)cc2)c(C)c1CCC(=O)N1CCC[C@H]1C(=O)[O-]	ZINC000237851428	209356785	/nfs/dbraw/zinc/35/67/85/209356785.db2.gz	YNCHOPWHJVXCJE-IBGZPJMESA-N	-1	0	369.465	2.865	50	0		FFAARM
Cc1c(C(=O)N2CCC[C@@H](CCC(=O)[O-])C2)cnn1Cc1ccccc1	ZINC000237746515	209354257	/nfs/dbraw/zinc/35/42/57/209354257.db2.gz	QCJYBBVNZKBWPB-KRWDZBQOSA-N	-1	0	355.438	2.957	50	0		FFAARM
Cc1nc(CCC(=O)N(CC(=O)[O-])C2CCOCC2)oc1-c1ccccc1	ZINC000237622924	209352368	/nfs/dbraw/zinc/35/23/68/209352368.db2.gz	XUGMKGUIRHAEJO-UHFFFAOYSA-N	-1	0	372.421	2.675	50	0		FFAARM
C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)N1CCO[C@H](CC(=O)[O-])C1	ZINC000237540874	209350616	/nfs/dbraw/zinc/35/06/16/209350616.db2.gz	VVLWDJPRKOTYLH-BXUZGUMPSA-N	-1	0	359.344	2.586	50	0		FFAARM
Cc1ccc(-n2[nH][n-]c3c(=O)n(-c4ccc(F)c(F)c4)c(=O)c2=3)cc1F	ZINC000102819268	209242790	/nfs/dbraw/zinc/24/27/90/209242790.db2.gz	QYTDNLBQOBEJTR-LSDHHAIUSA-N	-1	0	360.295	2.910	50	0		FFAARM
CCn1c2ccccc2c2cc([C@H]3CC(C(=O)[O-])=Nc4nnnn43)ccc21	ZINC000101675296	209229324	/nfs/dbraw/zinc/22/93/24/209229324.db2.gz	YVVXSENCXDNFDG-QGZVFWFLSA-N	-1	0	360.377	2.784	50	0		FFAARM
O=c1c2[n-][nH]n(Cc3cccc(F)c3)c=2c(=O)n1-c1ccc(F)c(F)c1	ZINC000101418122	209224634	/nfs/dbraw/zinc/22/46/34/209224634.db2.gz	NJSMIBPSWNKKPB-GJZGRUSLSA-N	-1	0	360.295	2.597	50	0		FFAARM
O=c1c2[n-][nH]n(Cc3ccccc3F)c=2c(=O)n1-c1ccc(F)c(F)c1	ZINC000101168176	209222070	/nfs/dbraw/zinc/22/20/70/209222070.db2.gz	QXDPHBZEKHPVHZ-LSDHHAIUSA-N	-1	0	360.295	2.597	50	0		FFAARM
CCn1c2ccccc2c([O-])c(C(=O)NCCc2ccc(OC)cc2)c1=O	ZINC000100810092	209217152	/nfs/dbraw/zinc/21/71/52/209217152.db2.gz	FCJAODYAMKCTFE-UHFFFAOYSA-N	-1	0	366.417	2.708	50	0		FFAARM
CS(=O)(=O)[N-]c1nc2n(n1)[C@@H](c1ccccc1)CC(c1ccccc1)=N2	ZINC000100636520	209216451	/nfs/dbraw/zinc/21/64/51/209216451.db2.gz	WJJPBZZNOSQQEI-MRXNPFEDSA-N	-1	0	367.434	2.706	50	0		FFAARM
CC(C)[S@](=O)c1ccc(C(=O)N2Cc3ccccc3C[C@@H]2C(=O)[O-])cc1	ZINC000236705928	209195168	/nfs/dbraw/zinc/19/51/68/209195168.db2.gz	YNYMCDXUNWAQFN-DWXRJYCRSA-N	-1	0	371.458	2.854	50	0		FFAARM
O=C(c1ccc[nH]1)N1CCN(Cc2c(Cl)ccc([O-])c2Cl)CC1	ZINC000097463616	209181333	/nfs/dbraw/zinc/18/13/33/209181333.db2.gz	BTCKBVDFDVFBFV-UHFFFAOYSA-N	-1	0	354.237	2.985	50	0		FFAARM
Cc1noc(C)c1COc1ccc(CC(=O)N2CCC[C@@H](C(=O)[O-])C2)cc1	ZINC000181482468	206684733	/nfs/dbraw/zinc/68/47/33/206684733.db2.gz	QJTLFDXOASCVOR-MRXNPFEDSA-N	-1	0	372.421	2.736	50	0		FFAARM
COc1ccc(N2C(=O)C[C@H](Sc3ccccc3C(=O)[O-])C2=O)cc1	ZINC000000629071	206818460	/nfs/dbraw/zinc/81/84/60/206818460.db2.gz	XANJWJGQROHIQR-HNNXBMFYSA-N	-1	0	357.387	2.818	50	0		FFAARM
Cc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccc(F)cc4)c=3c2=O)cc1C	ZINC000004483778	207021698	/nfs/dbraw/zinc/02/16/98/207021698.db2.gz	YCENAKLSGQJLSJ-IAGOWNOFSA-N	-1	0	352.369	2.936	50	0		FFAARM
CCc1ccc(-n2c(=O)c3[n-][nH]n(Cc4cccc(OC)c4)c=3c2=O)cc1	ZINC000004483717	207020803	/nfs/dbraw/zinc/02/08/03/207020803.db2.gz	FLHXHDCMVVSUNQ-QZTJIDSGSA-N	-1	0	364.405	2.751	50	0		FFAARM
COc1cc2c(cc1OC)[C@H](C(=O)[O-])[C@H](c1ccc(F)cc1)N(C)C2=O	ZINC000004563679	207028586	/nfs/dbraw/zinc/02/85/86/207028586.db2.gz	MIKLYYNEIZMHGU-IRXDYDNUSA-N	-1	0	359.353	2.838	50	0		FFAARM
Cc1c2cc(Cl)c([O-])cc2oc(=O)c1CC(=O)NCc1ccncc1	ZINC000005323044	207092533	/nfs/dbraw/zinc/09/25/33/207092533.db2.gz	HRDPSSGPKOSZAA-UHFFFAOYSA-N	-1	0	358.781	2.714	50	0		FFAARM
COc1cccc(-n2cnnc2SCc2nc(=O)c3sccc3[n-]2)c1	ZINC000006028913	207126117	/nfs/dbraw/zinc/12/61/17/207126117.db2.gz	FAGYLEALHOZPSS-UHFFFAOYSA-N	-1	0	371.447	2.866	50	0		FFAARM
COc1ccc(C(=O)NCc2n[n-]c(=S)n2-c2ccccc2)cc1OC	ZINC000006498219	207142174	/nfs/dbraw/zinc/14/21/74/207142174.db2.gz	UBDYNRJXUXDUAH-UHFFFAOYSA-N	-1	0	370.434	2.877	50	0		FFAARM
Cc1nc2sccn2c(=O)c1S(=O)(=O)[N-]c1ccccc1Cl	ZINC000006859687	207172195	/nfs/dbraw/zinc/17/21/95/207172195.db2.gz	AEEMXLBZVVGFQC-UHFFFAOYSA-N	-1	0	355.828	2.519	50	0		FFAARM
COc1cc(OC)c(NC(=O)Cc2c(C(=O)[O-])c(C)cn2C)cc1Cl	ZINC000008607584	207239061	/nfs/dbraw/zinc/23/90/61/207239061.db2.gz	ODMGFCPBVLIEFD-UHFFFAOYSA-N	-1	0	366.801	2.884	50	0		FFAARM
Cn1c(SCc2nc(=O)c3sccc3[n-]2)nc2ccsc2c1=O	ZINC000009412722	207269839	/nfs/dbraw/zinc/26/98/39/207269839.db2.gz	LTXHCSNYLNPWHB-UHFFFAOYSA-N	-1	0	362.461	2.585	50	0		FFAARM
O=C(CSC1=Nc2ccccc2S(=O)(=O)[N-]1)c1ccc(F)cc1	ZINC000009530222	207275286	/nfs/dbraw/zinc/27/52/86/207275286.db2.gz	FWFULIFVQKTAFZ-UHFFFAOYSA-N	-1	0	350.396	2.912	50	0		FFAARM
CC[C@@H](C)[C@@H](NC(=O)Cc1csc(-c2cccc(OC)c2)n1)C(=O)[O-]	ZINC000036580004	207285554	/nfs/dbraw/zinc/28/55/54/207285554.db2.gz	MXBZDJYAFAKPQJ-BDJLRTHQSA-N	-1	0	362.451	2.977	50	0		FFAARM
O=C(NCc1cccnc1)c1ccc([N-]S(=O)(=O)c2cccs2)cc1	ZINC000010052321	207293793	/nfs/dbraw/zinc/29/37/93/207293793.db2.gz	HUZCFBLJXYEKRS-UHFFFAOYSA-N	-1	0	373.459	2.874	50	0		FFAARM
COC(=O)[C@]([N-]c1nc2ccc(OC)cc2s1)(OC)C(F)(F)F	ZINC000012371495	207365225	/nfs/dbraw/zinc/36/52/25/207365225.db2.gz	ZABXHLJORLQINY-LBPRGKRZSA-N	-1	0	350.318	2.795	50	0		FFAARM
COc1ccc(F)cc1S(=O)(=O)[N-]c1ccccc1C(=O)NC1CC1	ZINC000012371406	207365792	/nfs/dbraw/zinc/36/57/92/207365792.db2.gz	QAXKGAZEDRPNBO-UHFFFAOYSA-N	-1	0	364.398	2.527	50	0		FFAARM
O=C1NCc2cccc([N-]S(=O)(=O)c3cccc(OC(F)(F)F)c3)c21	ZINC000012752842	207414929	/nfs/dbraw/zinc/41/49/29/207414929.db2.gz	SRAJOTQXWQJWGB-UHFFFAOYSA-N	-1	0	372.324	2.629	50	0		FFAARM
Cn1cc(/C=C/c2nc3ccccc3c(=O)n2-c2ccc(C(=O)[O-])cc2)cn1	ZINC000012938081	207439578	/nfs/dbraw/zinc/43/95/78/207439578.db2.gz	QGAVIVBVVODHDP-IZZDOVSWSA-N	-1	0	372.384	2.988	50	0		FFAARM
CC(C)c1cc(NC(=O)c2c(C(=O)[O-])cnn2C)n(-c2ccc(F)cc2)n1	ZINC000020617034	207749663	/nfs/dbraw/zinc/74/96/63/207749663.db2.gz	DJYMKHKPHJVUEL-UHFFFAOYSA-N	-1	0	371.372	2.819	50	0		FFAARM
Cc1ccc(C(=O)[O-])cc1S(=O)(=O)Nc1cnc2c(cnn2C(C)C)c1	ZINC000032098036	208026006	/nfs/dbraw/zinc/02/60/06/208026006.db2.gz	LPKBUAUVPZPVRR-UHFFFAOYSA-N	-1	0	374.422	2.820	50	0		FFAARM
COc1cc2c(cc1OC)[C@H]1[C@@H](C(=O)[O-])c3ccccc3C(=O)N1CC2	ZINC000032916829	208056794	/nfs/dbraw/zinc/05/67/94/208056794.db2.gz	MXBNJFLOBHEONN-ROUUACIJSA-N	-1	0	353.374	2.625	50	0		FFAARM
COc1cc(NC(=O)Cc2ccccc2C(=O)[O-])ccc1N1CCCC1=O	ZINC000040158783	208240631	/nfs/dbraw/zinc/24/06/31/208240631.db2.gz	KUYGTGMOXWGSOH-UHFFFAOYSA-N	-1	0	368.389	2.701	50	0		FFAARM
CCOc1cc(/C=C/C(=O)N2CCC[C@H]2C(=O)[O-])cc(Cl)c1OC	ZINC000299255876	208255596	/nfs/dbraw/zinc/25/55/96/208255596.db2.gz	CAVOBAPHBWXXRC-YBJDMEARSA-N	-1	0	353.802	2.836	50	0		FFAARM
[O-]c1c([C@H](c2ccccc2Cl)N2CCOCC2)sc2ncnn12	ZINC000041636508	208287761	/nfs/dbraw/zinc/28/77/61/208287761.db2.gz	PQRGYNYKQKAVGU-LBPRGKRZSA-N	-1	0	350.831	2.571	50	0		FFAARM
Cc1c(C(=O)[O-])cnn1-c1ccc(C(=O)N[C@@H]2CCC[C@H]3OCC[C@H]32)cc1	ZINC000299746471	208340116	/nfs/dbraw/zinc/34/01/16/208340116.db2.gz	XPVIPDGFDPGVPT-CGTJXYLNSA-N	-1	0	369.421	2.566	50	0		FFAARM
O=S(=O)([N-]c1ccccc1-n1cnnn1)c1ccc2ccccc2c1	ZINC000047328536	208375820	/nfs/dbraw/zinc/37/58/20/208375820.db2.gz	FUAOYFOBANNBIC-UHFFFAOYSA-N	-1	0	351.391	2.616	50	0		FFAARM
COc1ccc(S(=O)(=O)[N-]c2cccn3nc(C)nc23)c2c1CCCC2	ZINC000072408102	208847669	/nfs/dbraw/zinc/84/76/69/208847669.db2.gz	DEHFHHKORLJMRA-UHFFFAOYSA-N	-1	0	372.450	2.726	50	0		FFAARM
C[C@@H]1CCc2sc(C(=O)N3CCn4nc(CCC(=O)[O-])cc4C3)cc2C1	ZINC000072462603	208868754	/nfs/dbraw/zinc/86/87/54/208868754.db2.gz	AKNPHVKPPATWPS-GFCCVEGCSA-N	-1	0	373.478	2.743	50	0		FFAARM
O=C([N-]S(=O)(=O)Cc1cccnc1)c1cc(Cl)sc1Cl	ZINC000096013318	209096547	/nfs/dbraw/zinc/09/65/47/209096547.db2.gz	IJTVMDNBOHYNSF-UHFFFAOYSA-N	-1	0	351.236	2.710	50	0		FFAARM
COc1ccc([C@@H](C(=O)[O-])N(C)Cc2cccc3cccnc32)c(OC)n1	ZINC000095361200	209027152	/nfs/dbraw/zinc/02/71/52/209027152.db2.gz	ILMJWKLEOHHZFI-SFHVURJKSA-N	-1	0	367.405	2.905	50	0		FFAARM
CC(C)c1cc(C(=O)N2C[C@H]3COc4ccccc4C[C@@]3(C(=O)[O-])C2)on1	ZINC000095359017	209028090	/nfs/dbraw/zinc/02/80/90/209028090.db2.gz	ZYGIGWFDCIISOJ-VBKZILBWSA-N	-1	0	370.405	2.576	50	0		FFAARM
O=C([O-])c1ccc(C(=O)N[C@@H]2CCCN(c3ccccc3Cl)C2=O)o1	ZINC000238033809	132248976	/nfs/dbraw/zinc/24/89/76/132248976.db2.gz	UFKPWMXNXCLHQK-LLVKDONJSA-N	-1	0	362.769	2.557	50	0		FFAARM
O=S(=O)([N-]c1ccc(N2CCOCC2)cc1)c1ccc(F)cc1F	ZINC000003282767	132254345	/nfs/dbraw/zinc/25/43/45/132254345.db2.gz	APIPENOFULMXFA-UHFFFAOYSA-N	-1	0	354.378	2.602	50	0		FFAARM
COCCN1CCCc2ccc([N-]S(=O)(=O)c3cccs3)cc21	ZINC000035588196	136118237	/nfs/dbraw/zinc/11/82/37/136118237.db2.gz	KUMCZRHQABUPGJ-UHFFFAOYSA-N	-1	0	352.481	2.948	50	0		FFAARM
CCCC[C@@H](CC(=O)[O-])NC(=O)N1CCN(Cc2cccc(F)c2)CC1	ZINC000426583953	263639741	/nfs/dbraw/zinc/63/97/41/263639741.db2.gz	GZAWSJNWDLDUKK-KRWDZBQOSA-N	-1	0	365.449	2.686	50	0		FFAARM
O=C([O-])[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc(Br)cn1	ZINC000249917763	509781154	/nfs/dbraw/zinc/78/11/54/509781154.db2.gz	TXNDPVMTFHCJFB-BIMULSAOSA-N	-1	0	353.216	2.702	50	0		FFAARM
C[C@@H](NS(=O)(=O)c1ccc(Oc2ccccc2Cl)cc1)C(=O)[O-]	ZINC000000953575	506239982	/nfs/dbraw/zinc/23/99/82/506239982.db2.gz	IETNEQSPEDIHAV-SNVBAGLBSA-N	-1	0	355.799	2.884	50	0		FFAARM
O=C(NCc1ccccc1Cl)c1c([O-])c2cccc3c2n(c1=O)CC3	ZINC000001249004	506255923	/nfs/dbraw/zinc/25/59/23/506255923.db2.gz	LNTFIKKUBTVQRZ-UHFFFAOYSA-N	-1	0	354.793	2.847	50	0		FFAARM
COC(=O)c1cc(Cl)c(NS(=O)(=O)c2ccccc2)cc1OC	ZINC000001446222	506262401	/nfs/dbraw/zinc/26/24/01/506262401.db2.gz	AEQVSNRZXZYCGV-UHFFFAOYSA-N	-1	0	355.799	2.936	50	0		FFAARM
CC(=O)N1CCc2sc(S(=O)(=O)[N-]c3cccc(C)c3)cc2C1	ZINC000065196136	506268324	/nfs/dbraw/zinc/26/83/24/506268324.db2.gz	XTZNFMCLUAWZAL-UHFFFAOYSA-N	-1	0	350.465	2.762	50	0		FFAARM
CCCC[C@@H](NC(=O)[C@H](C)Oc1ccc2c(C)cc(=O)oc2c1)C(=O)[O-]	ZINC000002097476	506272499	/nfs/dbraw/zinc/27/24/99/506272499.db2.gz	CKGWKEONMUYSQY-SWLSCSKDSA-N	-1	0	361.394	2.628	50	0	biogenic	FFAARM
CCOC(=O)c1cccc(NC(=O)/N=c2\[n-]nc3cccc(Cl)n32)c1	ZINC000065314625	506286623	/nfs/dbraw/zinc/28/66/23/506286623.db2.gz	MXUWTDLMPAFSPL-UHFFFAOYSA-N	-1	0	359.773	3.203	50	0		FFAARM
O=C(NC1CCCC1)c1ccc2c(c1)[n-]c(=S)n(C[C@H]1CCCO1)c2=O	ZINC000002971823	506304930	/nfs/dbraw/zinc/30/49/30/506304930.db2.gz	DKRXBHYTCJTOOZ-CQSZACIVSA-N	-1	0	373.478	2.910	50	0		FFAARM
COc1ccc(N(C)S(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)cc1	ZINC000003223894	506313728	/nfs/dbraw/zinc/31/37/28/506313728.db2.gz	APWASPNYSYXNHS-UHFFFAOYSA-N	-1	0	355.799	2.872	50	0		FFAARM
COc1ccc([C@@H](CC(=O)[O-])NC(=O)COc2ccccc2C)cc1OC	ZINC000003626931	506347556	/nfs/dbraw/zinc/34/75/56/506347556.db2.gz	GQHRPCWAXLBKPL-OAHLLOKOSA-N	-1	0	373.405	2.723	50	0		FFAARM
COc1cc(/C=C/C(=O)NC[C@@H](CC(=O)[O-])c2ccccc2)ccc1O	ZINC000004090803	506359304	/nfs/dbraw/zinc/35/93/04/506359304.db2.gz	INIMXTMRPDDBBA-XAVKZTDYSA-N	-1	0	355.390	2.789	50	0	biogenic	FFAARM
O=C([O-])c1ccc(NS(=O)(=O)c2ccc(Br)cc2)cc1O	ZINC000004641418	506386129	/nfs/dbraw/zinc/38/61/29/506386129.db2.gz	FWQFAURLMDTDCV-UHFFFAOYSA-N	-1	0	372.196	2.654	50	0		FFAARM
CCCC[C@@H](NC(=O)[C@H](CCC)NC(=O)OCc1ccccc1)C(=O)[O-]	ZINC000004760577	506393469	/nfs/dbraw/zinc/39/34/69/506393469.db2.gz	XPRXIIXCLWGYHA-JKSUJKDBSA-N	-1	0	364.442	2.841	50	0		FFAARM
O=C(NC[C@@H]1CN(Cc2ccccc2)CCO1)c1ccc([O-])c(Cl)c1	ZINC000039975642	506456764	/nfs/dbraw/zinc/45/67/64/506456764.db2.gz	USBNALPFBKMNGS-MRXNPFEDSA-N	-1	0	360.841	2.676	50	0		FFAARM
O=C([O-])c1cccc(Nc2nc3ccccc3c(N3CCOCC3)n2)c1	ZINC000041148866	506494769	/nfs/dbraw/zinc/49/47/69/506494769.db2.gz	MBJXKKJCTJLRDV-UHFFFAOYSA-N	-1	0	350.378	2.908	50	0		FFAARM
COc1ccc(N2C(=O)[N-]C(=O)C(=C(C)Nc3ccccc3F)C2=O)cc1	ZINC000008970501	506675282	/nfs/dbraw/zinc/67/52/82/506675282.db2.gz	RFPRJUGHAGYHST-LFIBNONCSA-N	-1	0	369.352	2.803	50	0		FFAARM
O=C(C1CC1)N1CCc2ccc([N-]S(=O)(=O)c3ccccc3F)cc2C1	ZINC000008977355	506675797	/nfs/dbraw/zinc/67/57/97/506675797.db2.gz	XVJWMFMKDHIKTI-UHFFFAOYSA-N	-1	0	374.437	2.921	50	0		FFAARM
Cc1cc(S(=O)(=O)N2CCCc3ccccc32)ccc1OCC(=O)[O-]	ZINC000009226277	506687536	/nfs/dbraw/zinc/68/75/36/506687536.db2.gz	FNKBDMBDBVNYAL-UHFFFAOYSA-N	-1	0	361.419	2.600	50	0		FFAARM
O=C([O-])[C@@]1(NC(=O)c2cc(Br)ccc2Cl)CCSC1	ZINC000043510978	506753297	/nfs/dbraw/zinc/75/32/97/506753297.db2.gz	BTZMBZXTDFYKDL-GFCCVEGCSA-N	-1	0	364.648	2.793	50	0		FFAARM
O=C1OCCN1Cc1cccc([N-]S(=O)(=O)c2cc(F)ccc2F)c1	ZINC000055609521	506797192	/nfs/dbraw/zinc/79/71/92/506797192.db2.gz	GRJAJYRICLEPOD-UHFFFAOYSA-N	-1	0	368.361	2.718	50	0		FFAARM
CNS(=O)(=O)c1cc(NC(=O)c2ccc([O-])c(Cl)c2)ccc1C	ZINC000012740317	506894252	/nfs/dbraw/zinc/89/42/52/506894252.db2.gz	AVYPSYVNXRZWQK-UHFFFAOYSA-N	-1	0	354.815	2.514	50	0		FFAARM
Cc1cccc(CNC(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)[O-])c1	ZINC000013235642	506933841	/nfs/dbraw/zinc/93/38/41/506933841.db2.gz	YMEUYQJZIHEZAA-GOSISDBHSA-N	-1	0	351.406	2.971	50	0		FFAARM
COc1ccccc1CNC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)[O-]	ZINC000013236906	506934462	/nfs/dbraw/zinc/93/44/62/506934462.db2.gz	IDOPFGHMSXHKRF-QGZVFWFLSA-N	-1	0	367.405	2.672	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)c1ccc(N2CCCC2=O)cc1)c1ccc(F)cc1	ZINC000013257575	506934570	/nfs/dbraw/zinc/93/45/70/506934570.db2.gz	QQANTBZZVSFGPH-QGZVFWFLSA-N	-1	0	370.380	2.898	50	0		FFAARM
CCOc1ccc(/C=C2\SC(=O)N(CCCC(=O)[O-])C2=O)cc1OC	ZINC000013776749	506955599	/nfs/dbraw/zinc/95/55/99/506955599.db2.gz	XWHNQRSTHGZXOD-UVTDQMKNSA-N	-1	0	365.407	2.995	50	0		FFAARM
Cc1ccc(C)c(-c2n[nH]cc2CN2CCn3nc(C(=O)[O-])cc3C2)c1	ZINC000067804748	507012078	/nfs/dbraw/zinc/01/20/78/507012078.db2.gz	LDWCPSNWIGMHHW-UHFFFAOYSA-N	-1	0	351.410	2.604	50	0		FFAARM
O=C([O-])c1nn(CCCc2ccccc2)c2c1CN(C(=O)C1CCC1)CC2	ZINC000067804951	507013180	/nfs/dbraw/zinc/01/31/80/507013180.db2.gz	SRUWQXAQASFJKT-UHFFFAOYSA-N	-1	0	367.449	2.899	50	0		FFAARM
O=C(Nc1cc(=O)nc2[n-]c(CCc3ccccc3)nn21)c1ccccc1	ZINC000017027468	507111706	/nfs/dbraw/zinc/11/17/06/507111706.db2.gz	JRVQTQSCANBRIJ-UHFFFAOYSA-N	-1	0	359.389	2.867	50	0		FFAARM
CC(NCCc1ccccc1)=C1C(=O)[N-]C(=O)N(c2ccccc2C)C1=O	ZINC000020265669	507218197	/nfs/dbraw/zinc/21/81/97/507218197.db2.gz	GBSKYJNNFXKUNO-SDXDJHTJSA-N	-1	0	363.417	2.684	50	0		FFAARM
Cc1cc(C)cc([N-]S(=O)(=O)c2cc(Br)cnc2N)c1	ZINC000020467621	507221964	/nfs/dbraw/zinc/22/19/64/507221964.db2.gz	UAOYHDGJNXLMAY-UHFFFAOYSA-N	-1	0	356.245	2.844	50	0		FFAARM
Cc1noc(C)c1CN1CCN([C@H](C(=O)[O-])c2c[nH]c3ccccc32)CC1	ZINC000020745895	507233426	/nfs/dbraw/zinc/23/34/26/507233426.db2.gz	JGLBBFXSCBEJIM-IBGZPJMESA-N	-1	0	368.437	2.716	50	0		FFAARM
O=C([O-])[C@H](Cc1ccccc1)NC=C1C(=O)CC(c2ccccc2)CC1=O	ZINC000022135417	507281509	/nfs/dbraw/zinc/28/15/09/507281509.db2.gz	XIEGZCYGJBLBSA-NNBQYGFHSA-N	-1	0	363.413	2.872	50	0		FFAARM
Cc1nc2sc([C@@H](c3ccc(F)c(F)c3)N3CCOCC3)c([O-])n2n1	ZINC000022626678	507301108	/nfs/dbraw/zinc/30/11/08/507301108.db2.gz	OULAQZVVMCQQJX-CYBMUJFWSA-N	-1	0	366.393	2.505	50	0		FFAARM
O=C(Nc1ccc(N2CCCS2(=O)=O)cc1)c1cc(Cl)ccc1[O-]	ZINC000022883270	507317652	/nfs/dbraw/zinc/31/76/52/507317652.db2.gz	PELDKFHPQPJUKB-UHFFFAOYSA-N	-1	0	366.826	2.838	50	0		FFAARM
CS(=O)(=O)[N-]c1ccc(F)cc1C(=O)NCc1ccccc1Cl	ZINC000024964318	507453565	/nfs/dbraw/zinc/45/35/65/507453565.db2.gz	RFSDUTUXGPCAKH-UHFFFAOYSA-N	-1	0	356.806	2.781	50	0		FFAARM
COC(=O)COc1cccc([N-]S(=O)(=O)c2ccccc2Cl)c1	ZINC000024957856	507453606	/nfs/dbraw/zinc/45/36/06/507453606.db2.gz	GBLKYYQSNADSMM-UHFFFAOYSA-N	-1	0	355.799	2.693	50	0		FFAARM
O=C([O-])c1cc(F)c(F)cc1NS(=O)(=O)c1ccc2c(c1)CCC2	ZINC000060367177	507532169	/nfs/dbraw/zinc/53/21/69/507532169.db2.gz	QVPRZTBZZPVLFU-UHFFFAOYSA-N	-1	0	353.346	2.953	50	0		FFAARM
Nc1cc(Br)ccc1-c1nc(=O)c(-c2ccc(F)cc2)n[n-]1	ZINC000069701205	507537540	/nfs/dbraw/zinc/53/75/40/507537540.db2.gz	ZGFPCFOKTJBODM-UHFFFAOYSA-N	-1	0	361.174	2.983	50	0		FFAARM
CCc1nccn1CCC(=O)N1CC[C@@H](Cc2cccc(C(=O)[O-])c2)C1	ZINC000072159225	507764664	/nfs/dbraw/zinc/76/46/64/507764664.db2.gz	VWVYSMMHWSDSPA-INIZCTEOSA-N	-1	0	355.438	2.625	50	0		FFAARM
CC(C)=CC[C@]1(C(=O)[O-])CCCN(C(=O)c2ccccc2-c2nn[nH]n2)C1	ZINC000091364738	507982360	/nfs/dbraw/zinc/98/23/60/507982360.db2.gz	CNTMNZBQNKWKNI-LJQANCHMSA-N	-1	0	369.425	2.530	50	0		FFAARM
Cc1ccc2[nH]nc(C(=O)N3C[C@@H](c4ccc(F)cc4)[C@H](C(=O)[O-])C3)c2c1	ZINC000091695576	508002886	/nfs/dbraw/zinc/00/28/86/508002886.db2.gz	IEVWALZQRVQHSS-JKSUJKDBSA-N	-1	0	367.380	2.951	50	0		FFAARM
CCc1ccc([N-]S(=O)(=O)c2ccc(Cl)nc2C(=O)OC)cc1	ZINC000075105027	508083287	/nfs/dbraw/zinc/08/32/87/508083287.db2.gz	DOYRWSWBEJNQIG-UHFFFAOYSA-N	-1	0	354.815	2.885	50	0		FFAARM
CC[C@H](C)NC(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1O	ZINC000097254613	508222003	/nfs/dbraw/zinc/22/20/03/508222003.db2.gz	IAQNQCWONVAWPM-JTQLQIEISA-N	-1	0	354.453	2.783	50	0		FFAARM
Cc1cc2ncc(C(=O)N3CCCC[C@H]3CCc3ccccc3)c(=O)n2[n-]1	ZINC000102589333	508278279	/nfs/dbraw/zinc/27/82/79/508278279.db2.gz	VAJSPWIGZBKJGK-KRWDZBQOSA-N	-1	0	364.449	2.959	50	0		FFAARM
C[C@](O)(CNC(=O)OCC1c2ccccc2-c2ccccc21)CC(=O)[O-]	ZINC000084999882	508300246	/nfs/dbraw/zinc/30/02/46/508300246.db2.gz	JUZAKNZIIRTEEQ-HXUWFJFHSA-N	-1	0	355.390	2.751	50	0		FFAARM
COc1ccc([C@@H](C2=C([O-])COC2=O)c2cc3c(cc2O)OCO3)cc1	ZINC000199162824	509233618	/nfs/dbraw/zinc/23/36/18/509233618.db2.gz	RIEROYUYIIFCAA-QGZVFWFLSA-N	-1	0	356.330	2.630	50	0		FFAARM
Cn1cc(Br)cc1C(=O)N1[C@H](C(=O)[O-])C[C@@H]2CCCC[C@@H]21	ZINC000220941953	509304360	/nfs/dbraw/zinc/30/43/60/509304360.db2.gz	IWTBQHFADKVOPH-GAFUQQFSSA-N	-1	0	355.232	2.646	50	0		FFAARM
O=S(=O)([N-]c1nncn1Cc1ccccc1)c1ccc(F)cc1Cl	ZINC000225397748	509370183	/nfs/dbraw/zinc/37/01/83/509370183.db2.gz	HWVUZICBQCNSFS-UHFFFAOYSA-N	-1	0	366.805	2.920	50	0		FFAARM
Cc1cc(F)cc(S(=O)(=O)[N-]C(=O)c2csc([C@@H]3CCCO3)n2)c1	ZINC000167012778	509621902	/nfs/dbraw/zinc/62/19/02/509621902.db2.gz	QYLAKXMMTGRQBO-ZDUSSCGKSA-N	-1	0	370.427	2.561	50	0		FFAARM
Cc1ccc(N2CC[C@@H](C(=O)N3CCC[C@H](CCC(=O)[O-])C3)C2=O)cc1C	ZINC000237629135	509695986	/nfs/dbraw/zinc/69/59/86/509695986.db2.gz	XUDIVKFQVCOTQN-AEFFLSMTSA-N	-1	0	372.465	2.760	50	0		FFAARM
CCC[C@@H](NC(=O)Cc1ccccc1)C(=O)Nc1ccc(F)c(C(=O)[O-])c1	ZINC000170672176	509711488	/nfs/dbraw/zinc/71/14/88/509711488.db2.gz	OXJDSSVUJVMFHX-QGZVFWFLSA-N	-1	0	372.396	2.990	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)/C=C(/c2ccc(Cl)cc2)C(F)(F)F)CCO1	ZINC000237962727	509786268	/nfs/dbraw/zinc/78/62/68/509786268.db2.gz	NLJJQJZENVJRRS-RDQDRAATSA-N	-1	0	363.719	2.598	50	0		FFAARM
COCc1c(C(=O)N(C)C[C@H](C)c2nnn[n-]2)sc2cccc(F)c21	ZINC000183433663	509788028	/nfs/dbraw/zinc/78/80/28/509788028.db2.gz	VDVVWKNKSVWUCW-VIFPVBQESA-N	-1	0	363.418	2.576	50	0		FFAARM
NC(=O)c1ccc(N2CCCCC2)c(NC(=O)c2cccc(C(=O)[O-])c2)c1	ZINC000261901738	510108325	/nfs/dbraw/zinc/10/83/25/510108325.db2.gz	WEHTVXXVCMUUIT-UHFFFAOYSA-N	-1	0	367.405	2.726	50	0		FFAARM
CC(C)(C(=O)[O-])n1cc(NC(=O)c2csc(Br)c2)cn1	ZINC000262855869	510442068	/nfs/dbraw/zinc/44/20/68/510442068.db2.gz	YBQBJBWRUYTNSN-UHFFFAOYSA-N	-1	0	358.217	2.779	50	0		FFAARM
CC(C)(C)c1cc([N-]S(=O)(=O)c2ccc(N3CCCC3=O)cc2)on1	ZINC000175651240	510714142	/nfs/dbraw/zinc/71/41/42/510714142.db2.gz	GZYLNPOWJANAGQ-UHFFFAOYSA-N	-1	0	363.439	2.900	50	0		FFAARM
CC(C)(NC(=O)c1cnc(C(=O)[O-])cn1)c1ccc(OC(F)(F)F)cc1	ZINC000263573031	510754903	/nfs/dbraw/zinc/75/49/03/510754903.db2.gz	LUAPXGVFEZVCMM-UHFFFAOYSA-N	-1	0	369.299	2.739	50	0		FFAARM
CC(C)C[C@H](NC(=O)c1ccc(CN2C[C@@H](C)O[C@@H](C)C2)cc1)C(=O)[O-]	ZINC000185317150	510803219	/nfs/dbraw/zinc/80/32/19/510803219.db2.gz	NKEILEYWIPSLQD-DAYGRLMNSA-N	-1	0	362.470	2.525	50	0		FFAARM
Cc1cc(C2CC2)nc([N-]S(=O)(=O)c2ccc3c(c2)CCCC3=O)n1	ZINC000296089915	511617134	/nfs/dbraw/zinc/61/71/34/511617134.db2.gz	WNBDBSQQNIGESK-UHFFFAOYSA-N	-1	0	357.435	2.982	50	0		FFAARM
Cc1cc(C)cc(CSCC(=O)N2CCc3c(c(C(=O)[O-])nn3C)C2)c1	ZINC000299762766	511671862	/nfs/dbraw/zinc/67/18/62/511671862.db2.gz	APUWAGHNYXBJKB-UHFFFAOYSA-N	-1	0	373.478	2.553	50	0		FFAARM
O=C([O-])[C@H]1CCN(C(=O)NCc2ccccc2OCc2ccccc2)C1	ZINC000311360492	511776210	/nfs/dbraw/zinc/77/62/10/511776210.db2.gz	GTBNODCGVPKKCZ-KRWDZBQOSA-N	-1	0	354.406	2.882	50	0		FFAARM
COc1n[n-]c(=NC(=O)N2CCC(c3nc4cccc(C)c4o3)CC2)s1	ZINC000374637508	512930448	/nfs/dbraw/zinc/93/04/48/512930448.db2.gz	OBLCEWRQCRTINX-UHFFFAOYSA-N	-1	0	373.438	3.408	50	0		FFAARM
Cc1cccc([C@@H](NC(=O)N2CCN(Cc3cccs3)CC2)C(=O)[O-])c1	ZINC000426475327	513951264	/nfs/dbraw/zinc/95/12/64/513951264.db2.gz	CCRZKZKSYMDKEH-QGZVFWFLSA-N	-1	0	373.478	2.710	50	0		FFAARM
CC(C)CN(C(=O)c1cnc(C(=O)[O-])cn1)[C@H]1CCCc2cccnc21	ZINC000455780508	514734734	/nfs/dbraw/zinc/73/47/34/514734734.db2.gz	KRLAAMNNIWRXGZ-INIZCTEOSA-N	-1	0	354.410	2.746	50	0		FFAARM
CCOc1cc(C(=O)N2CCC[C@@H]2C(=O)[O-])ccc1OCc1cccnc1	ZINC000263309907	520658998	/nfs/dbraw/zinc/65/89/98/520658998.db2.gz	PBJKYERPZCJYIK-MRXNPFEDSA-N	-1	0	370.405	2.749	50	0		FFAARM
Cc1nc(COc2cccc(/C=C\C(=O)N3CC[C@@H](C(=O)[O-])C3)c2)cs1	ZINC000606441989	521068989	/nfs/dbraw/zinc/06/89/89/521068989.db2.gz	VAPRWQWJYSLSOV-IYKSTZQJSA-N	-1	0	372.446	2.977	50	0		FFAARM
Cc1nn(CC(C)C)c(Cl)c1/C=C\C(=O)N1CCC[C@@H](C(=O)[O-])C1	ZINC000606441289	521069302	/nfs/dbraw/zinc/06/93/02/521069302.db2.gz	PZDYYVKDECBORB-FMFIFOJESA-N	-1	0	353.850	2.837	50	0		FFAARM
COc1cccc([C@H]2C[C@H]2C(=O)NCc2ccc(OC)c(C(=O)[O-])c2)c1	ZINC000299752558	524185455	/nfs/dbraw/zinc/18/54/55/524185455.db2.gz	UOQSGCROFATVFO-HZPDHXFCSA-N	-1	0	355.390	2.822	50	0		FFAARM
C[C@@H]1CC[C@@H](CCC(=O)N[C@H](Cc2c[nH]c3cc(F)ccc23)C(=O)[O-])O1	ZINC000299744772	524587555	/nfs/dbraw/zinc/58/75/55/524587555.db2.gz	PUHCAAQJQWXZCP-HYSWKAIVSA-N	-1	0	362.401	2.767	50	0		FFAARM
O=C([O-])CC[C@@]1(CCC(=O)N2CCC(c3ccccc3)CC2)CCC(=O)N1	ZINC000218457442	527597730	/nfs/dbraw/zinc/59/77/30/527597730.db2.gz	QQNDSDYEZAZFEV-NRFANRHFSA-N	-1	0	372.465	2.686	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)[C@@H]1CCCOC1)c1cccc(Br)c1	ZINC000238142875	527626221	/nfs/dbraw/zinc/62/62/21/527626221.db2.gz	LITPEXUALWNLBW-DGCLKSJQSA-N	-1	0	356.216	2.508	50	0		FFAARM
CNC(=O)c1cccc(S(=O)(=O)[N-]c2cc(Cl)ccc2OC)c1	ZINC000047652505	570929337	/nfs/dbraw/zinc/92/93/37/570929337.db2.gz	VHQVFVXFYTWEQZ-UHFFFAOYSA-N	-1	0	354.815	2.509	50	0		FFAARM
O=C([O-])c1cccc(C[C@H]2CCN(C(=O)c3cn4ccsc4n3)C2)c1	ZINC000072144276	571172410	/nfs/dbraw/zinc/17/24/10/571172410.db2.gz	KPGWRRQAHOCARQ-CYBMUJFWSA-N	-1	0	355.419	2.799	50	0		FFAARM
CC[C@@H](C)Oc1ccccc1/C=C\C(=O)N(CC(=O)[O-])C1CCOCC1	ZINC000584907994	600957525	/nfs/dbraw/zinc/95/75/25/600957525.db2.gz	BLVUDWQARLAJAO-WHLNPGIBSA-N	-1	0	361.438	2.969	50	0		FFAARM
C[C@@H](CCNC(=O)N1CCO[C@H](C(=O)[O-])C1)c1cccc(C(F)(F)F)c1	ZINC000666534281	600997637	/nfs/dbraw/zinc/99/76/37/600997637.db2.gz	HRRCHMOAHIDFQO-FZMZJTMJSA-N	-1	0	374.359	2.694	50	0		FFAARM
Cc1cc2ncc(C(=O)N[C@H](c3ccccc3)[C@@H](C)C(=O)[O-])c(C)n2n1	ZINC000262544428	601169314	/nfs/dbraw/zinc/16/93/14/601169314.db2.gz	VPRSZWIAUXAALY-PXAZEXFGSA-N	-1	0	352.394	2.538	50	0		FFAARM
O=C([O-])[C@@H](CC(F)F)NC(=O)c1cccc(Br)c1Cl	ZINC000261580452	729650436	/nfs/dbraw/zinc/65/04/36/729650436.db2.gz	FISLIFUPEVOFGC-SSDOTTSWSA-N	-1	0	356.550	2.941	50	0		FFAARM
CN1C(=O)CCc2cc(C(=O)N[C@H](CC(=O)[O-])c3cccs3)ccc21	ZINC000683298957	734142457	/nfs/dbraw/zinc/14/24/57/734142457.db2.gz	OIRVTJZNVTVFRV-CYBMUJFWSA-N	-1	0	358.419	2.603	50	0		FFAARM
O=C([O-])C1(NC(=O)N2CCO[C@@H](c3ccc(Cl)cc3)C2)CCCC1	ZINC000827969376	939220065	/nfs/dbraw/zinc/22/00/65/939220065.db2.gz	DOPLKYJMOVRLPV-CQSZACIVSA-N	-1	0	352.818	2.820	50	0		FFAARM
COc1cc(C(=O)[O-])cc(C(=O)NCc2ccc3c(c2)nc(C)n3C)c1	ZINC000824583618	999238949	/nfs/dbraw/zinc/23/89/49/999238949.db2.gz	GLMLMIMIPZVGJP-UHFFFAOYSA-N	-1	0	353.378	2.519	50	0		FFAARM
Cc1nc2ccccc2n1CCC(=O)N[C@@H](Cc1ccccc1)C(=O)[O-]	ZINC000952988619	1011046304	/nfs/dbraw/zinc/04/63/04/1011046304.db2.gz	JWULTXOVHZADCJ-KRWDZBQOSA-N	-1	0	351.406	2.547	50	0		FFAARM
O=C([O-])[C@H](Cc1nc2ccccc2[nH]1)Nc1nccc(-c2cccnc2)n1	ZINC000097551360	1012869011	/nfs/dbraw/zinc/86/90/11/1012869011.db2.gz	XEVVRZJQJABVCP-INIZCTEOSA-N	-1	0	360.377	2.523	50	0		FFAARM
O=C([O-])c1cc2c(nc1N1CCC[C@]3(CCC(=O)N(C4CC4)C3)C1)CCC2	ZINC000077375347	1020667499	/nfs/dbraw/zinc/66/74/99/1020667499.db2.gz	OKMQZSBQIXIMNX-NRFANRHFSA-N	-1	0	369.465	2.640	50	0		FFAARM
O=C([O-])c1ccc(NC(=O)[C@@H]2CC(=O)N=C(Nc3ccccc3)S2)cc1	ZINC000000710540	219316766	/nfs/dbraw/zinc/31/67/66/219316766.db2.gz	OEERBGJJZFJVNB-AWEZNQCLSA-N	-1	0	369.402	2.824	50	0		FFAARM
CS(=O)(=O)[N-]c1ccccc1C(=O)NCCc1cccc(Cl)c1	ZINC000012729730	209570111	/nfs/dbraw/zinc/57/01/11/209570111.db2.gz	LDTBCCYUNUSDQT-UHFFFAOYSA-N	-1	0	352.843	2.684	50	0		FFAARM
CCc1ccc(OCC(=O)NC(=S)Nc2ccc(C(=O)[O-])cc2)cc1	ZINC000002214533	209491098	/nfs/dbraw/zinc/49/10/98/209491098.db2.gz	DIVMKLWELRLIEE-UHFFFAOYSA-N	-1	0	358.419	2.839	50	0		FFAARM
COc1ccc2c(cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)[O-])n2C)c1	ZINC000004000335	209407675	/nfs/dbraw/zinc/40/76/75/209407675.db2.gz	YTOGFSIWNWHSDG-INIZCTEOSA-N	-1	0	352.390	2.613	50	0	biogenic	FFAARM
Cc1coc2cc3oc(=O)c(CCC(=O)N[C@@H](C)C(=O)[O-])c(C)c3cc12	ZINC000002102054	209394297	/nfs/dbraw/zinc/39/42/97/209394297.db2.gz	LTILAAFZTKPTEL-NSHDSACASA-N	-1	0	357.362	2.678	50	0	biogenic	FFAARM
O=C([O-])CN(C(=O)c1cc(F)c(Cl)cc1Cl)C1CCOCC1	ZINC000238108006	209360375	/nfs/dbraw/zinc/36/03/75/209360375.db2.gz	ZQYWNPLMUWEBRA-UHFFFAOYSA-N	-1	0	350.173	2.838	50	0		FFAARM
O=C([O-])CC[C@H]1CCCCN1C(=O)Cc1ccc(N2CCCC2=O)cc1	ZINC000237986748	209358862	/nfs/dbraw/zinc/35/88/62/209358862.db2.gz	LETGPIJCXPVMFK-MRXNPFEDSA-N	-1	0	358.438	2.602	50	0		FFAARM
O=C([O-])C1(c2ccccc2)CCN(C(=O)Cc2cn3ccsc3n2)CC1	ZINC000238062746	209358014	/nfs/dbraw/zinc/35/80/14/209358014.db2.gz	LVFBNAGTDQDDRK-UHFFFAOYSA-N	-1	0	369.446	2.583	50	0		FFAARM
O=C([O-])[C@H]1Cc2ccccc2CN1C(=O)C[C@@H]1OCCc2ccccc21	ZINC000238029983	209357369	/nfs/dbraw/zinc/35/73/69/209357369.db2.gz	QKKHGQNSRYDBHG-MOPGFXCFSA-N	-1	0	351.402	2.729	50	0		FFAARM
Cc1c(C(=O)N(CC(=O)[O-])C2CC2)cnn1-c1cccc(C(F)(F)F)c1	ZINC000237726640	209355019	/nfs/dbraw/zinc/35/50/19/209355019.db2.gz	KYRCUACDGYTKEF-UHFFFAOYSA-N	-1	0	367.327	2.889	50	0		FFAARM
Cc1ccc(-c2nc(C(=O)N3CCO[C@@H](CC(=O)[O-])C3)cs2)c(C)c1	ZINC000237748098	209354155	/nfs/dbraw/zinc/35/41/55/209354155.db2.gz	DPYYCJXQSQSYSY-ZDUSSCGKSA-N	-1	0	360.435	2.743	50	0		FFAARM
Cc1nn(-c2ccc(F)cc2)c(Cl)c1C(=O)N1CC[C@@H](C(=O)[O-])C1	ZINC000237768525	209353820	/nfs/dbraw/zinc/35/38/20/209353820.db2.gz	OVHPFYSVELEEBS-SNVBAGLBSA-N	-1	0	351.765	2.520	50	0		FFAARM
Cc1nc2ccccc2c(C)c1CC(=O)N(CCC(=O)[O-])C1CCOCC1	ZINC000237751281	209353589	/nfs/dbraw/zinc/35/35/89/209353589.db2.gz	UBEWEDGPIRUIJN-UHFFFAOYSA-N	-1	0	370.449	2.876	50	0		FFAARM
COc1ccc(-n2ccc(C(=O)N3[C@H](C(=O)[O-])C[C@H]4CCCC[C@@H]43)n2)cc1	ZINC000237446695	209347979	/nfs/dbraw/zinc/34/79/79/209347979.db2.gz	SUWQTTWPQCYDOG-BVGQSLNGSA-N	-1	0	369.421	2.739	50	0		FFAARM
CN(Cc1ccc(C(=O)[O-])cc1)C(=O)Cc1ccc(N2CCCC2=O)cc1	ZINC000237036242	209324867	/nfs/dbraw/zinc/32/48/67/209324867.db2.gz	GVGOKCZTHITHHL-UHFFFAOYSA-N	-1	0	366.417	2.713	50	0		FFAARM
CC[C@H](C)[C@H](NC(=O)c1ccc(CN2C[C@@H](C)O[C@@H](C)C2)cc1)C(=O)[O-]	ZINC000236990719	209283420	/nfs/dbraw/zinc/28/34/20/209283420.db2.gz	LYYQMWIQKAKXBA-AFIMGQEJSA-N	-1	0	362.470	2.525	50	0		FFAARM
COc1cccc(-n2c(=O)c3[n-][nH]n(-c4cccc(Cl)c4)c=3c2=O)c1	ZINC000102818220	209241823	/nfs/dbraw/zinc/24/18/23/209241823.db2.gz	WSKUWHKKNDAKHO-CABCVRRESA-N	-1	0	356.769	2.846	50	0		FFAARM
CN(C(=O)c1ccc2c(c1)[n-]c(=S)n(C)c2=O)[C@H]1CCc2ccccc21	ZINC000102832870	209242589	/nfs/dbraw/zinc/24/25/89/209242589.db2.gz	OYJMGGPRVHSLAY-KRWDZBQOSA-N	-1	0	365.458	2.982	50	0		FFAARM
COc1cccc(-n2[nH][n-]c3c(=O)n(-c4ccc(C)c(C)c4)c(=O)c2=3)c1	ZINC000102820655	209242536	/nfs/dbraw/zinc/24/25/36/209242536.db2.gz	GLQNSHWKFXFICN-DLBZAZTESA-N	-1	0	350.378	2.810	50	0		FFAARM
CC(C)c1ccc(-c2noc(CCC(=O)N3CC[C@H](C(=O)[O-])C3)n2)cc1	ZINC000236854022	209218916	/nfs/dbraw/zinc/21/89/16/209218916.db2.gz	HFGQECYBWNGCSZ-HNNXBMFYSA-N	-1	0	357.410	2.726	50	0		FFAARM
C[C@@H]1CCc2cc(F)cc3c([O-])c(C(=O)NCc4ccccn4)c(=O)n1c23	ZINC000100630056	209216649	/nfs/dbraw/zinc/21/66/49/209216649.db2.gz	UKGPVLKYKZWJSU-LLVKDONJSA-N	-1	0	367.380	2.678	50	0		FFAARM
CCOC(=O)c1ccccc1NC(=O)c1c([O-])c2ccccc2n(C)c1=O	ZINC000100668370	209216385	/nfs/dbraw/zinc/21/63/85/209216385.db2.gz	LYQDZUCRJZDDCP-UHFFFAOYSA-N	-1	0	366.373	2.673	50	0		FFAARM
COc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccccc4Cl)c=3c2=O)cc1	ZINC000096286251	209149639	/nfs/dbraw/zinc/14/96/39/209149639.db2.gz	NZQBOKANXRQAPA-HOTGVXAUSA-N	-1	0	370.796	2.842	50	0		FFAARM
O=C([O-])CCCC(=O)Nc1ccc(C(=O)OCC(=O)c2ccccc2)cc1	ZINC000000993367	206852909	/nfs/dbraw/zinc/85/29/09/206852909.db2.gz	GWUCGEYLVDIYDC-UHFFFAOYSA-N	-1	0	369.373	2.920	50	0		FFAARM
O=C([O-])CC[C@H](NC(=O)OCc1ccccc1)C(=O)OCc1ccccc1	ZINC000001678265	206892546	/nfs/dbraw/zinc/89/25/46/206892546.db2.gz	VWHKODOUMSMUAF-KRWDZBQOSA-N	-1	0	371.389	2.890	50	0	in-vitro	FFAARM
C[C@@H](NC(=O)/C(=C/c1ccc(Cl)cc1)NC(=O)c1ccccc1)C(=O)[O-]	ZINC000002948904	206947719	/nfs/dbraw/zinc/94/77/19/206947719.db2.gz	BCGZSUJANOSRFW-COOUDCDJSA-N	-1	0	372.808	2.700	50	0		FFAARM
CCc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccc(F)cc4)c=3c2=O)cc1	ZINC000004483712	207021149	/nfs/dbraw/zinc/02/11/49/207021149.db2.gz	YNWWZRCPBFWBLT-IAGOWNOFSA-N	-1	0	352.369	2.882	50	0		FFAARM
O=C([O-])CCNC(=O)/C(=C/c1ccc(Cl)cc1)NC(=O)c1ccccc1	ZINC000004579440	207029231	/nfs/dbraw/zinc/02/92/31/207029231.db2.gz	XUJMPCQZKXWGEP-VBKFSLOCSA-N	-1	0	372.808	2.702	50	0		FFAARM
CC(C)OC(=O)c1cc(NC(=O)CCC(=O)[O-])cc(C(=O)OC(C)C)c1	ZINC000004651256	207034192	/nfs/dbraw/zinc/03/41/92/207034192.db2.gz	SXZKHYRUWUZFRN-UHFFFAOYSA-N	-1	0	365.382	2.620	50	0		FFAARM
CCOc1ccc([C@@H](CC(=O)[O-])NC(=O)Cc2ccccc2)cc1OC	ZINC000004580573	207029992	/nfs/dbraw/zinc/02/99/92/207029992.db2.gz	RQGVWRJQTSUSJZ-MRXNPFEDSA-N	-1	0	357.406	2.969	50	0		FFAARM
CC(C)(C)OC(=O)NCCC[C@@H](NC(=O)OCc1ccccc1)C(=O)[O-]	ZINC000004764534	207046051	/nfs/dbraw/zinc/04/60/51/207046051.db2.gz	RWQCKACYKKSOKK-CQSZACIVSA-N	-1	0	366.414	2.671	50	0		FFAARM
COc1ccc(CCNC(=O)[C@H]2CC(C)=C(C)C[C@@H]2C(=O)[O-])cc1OC	ZINC000004894540	207060131	/nfs/dbraw/zinc/06/01/31/207060131.db2.gz	UYOJBKFIFVXBNI-HOTGVXAUSA-N	-1	0	361.438	2.810	50	0		FFAARM
COc1ccc(-n2c3nnc([S-])n3c3sc4c(c3c2=O)CCC4)cc1	ZINC000005893697	207122289	/nfs/dbraw/zinc/12/22/89/207122289.db2.gz	MZVYKULKXCVMMI-UHFFFAOYSA-N	-1	0	370.459	2.881	50	0		FFAARM
O=c1c2ccccc2cnn1Cc1n[n-]c(=S)n1-c1ccc(F)cc1	ZINC000005906637	207122418	/nfs/dbraw/zinc/12/24/18/207122418.db2.gz	HUYDDIQIHYGAJN-UHFFFAOYSA-N	-1	0	353.382	2.827	50	0		FFAARM
COc1ccc(S(=O)(=O)[N-]c2ccccc2C(C)=O)cc1NC(C)=O	ZINC000006328858	207137629	/nfs/dbraw/zinc/13/76/29/207137629.db2.gz	UIYWDGCBDSMAOT-UHFFFAOYSA-N	-1	0	362.407	2.657	50	0		FFAARM
O=C([O-])CCC(=O)Nc1sc2c(c1C(=O)NCc1ccccc1)CCC2	ZINC000006699099	207154082	/nfs/dbraw/zinc/15/40/82/207154082.db2.gz	PBKRZJRKBWQVNP-UHFFFAOYSA-N	-1	0	372.446	2.970	50	0		FFAARM
COc1ccc(NC(C)=O)cc1[N-]S(=O)(=O)c1ccc(F)c(F)c1	ZINC000007051183	207186476	/nfs/dbraw/zinc/18/64/76/207186476.db2.gz	AVWRXDTXFXTXIU-UHFFFAOYSA-N	-1	0	356.350	2.733	50	0		FFAARM
Cc1cc(C)nc(SCc2cc(=O)n(-c3nc4ccccc4[nH]3)[n-]2)n1	ZINC000009059900	207256569	/nfs/dbraw/zinc/25/65/69/207256569.db2.gz	CSGFYPVOMMQVBX-UHFFFAOYSA-N	-1	0	352.423	2.741	50	0		FFAARM
O=C(Nc1cc(=O)nc2[n-]c(COc3ccccc3)nn21)C1CCCCC1	ZINC000009332856	207267019	/nfs/dbraw/zinc/26/70/19/207267019.db2.gz	OBILXAROMYWCBF-UHFFFAOYSA-N	-1	0	367.409	2.515	50	0		FFAARM
O=C([O-])[C@H](Cc1c[nH]c2ccccc12)NC(=O)NCCOc1ccccc1	ZINC000013234922	207454471	/nfs/dbraw/zinc/45/44/71/207454471.db2.gz	FZFSBYBPJODCJE-SFHVURJKSA-N	-1	0	367.405	2.542	50	0		FFAARM
O=C([O-])[C@@H]1CC=CC[C@@H]1C(=O)Nc1sc2c(c1C(=O)NC1CC1)CCC2	ZINC000017076635	207611471	/nfs/dbraw/zinc/61/14/71/207611471.db2.gz	ZAQVOIXDPXEAFA-NWDGAFQWSA-N	-1	0	374.462	2.735	50	0		FFAARM
COc1ccc(OC)c(S(=O)(=O)[N-]c2ccnn2[C@H](C)C2CC2)c1	ZINC000032604202	208033310	/nfs/dbraw/zinc/03/33/10/208033310.db2.gz	FTSAWEDSBMBVID-LLVKDONJSA-N	-1	0	351.428	2.672	50	0		FFAARM
Cc1c(C(=O)[O-])sc2[nH]c(=O)cc(CSc3nnc(C4CC4)[nH]3)c12	ZINC000032885620	208053244	/nfs/dbraw/zinc/05/32/44/208053244.db2.gz	RXPMMITYMALENR-UHFFFAOYSA-N	-1	0	362.436	2.884	50	0		FFAARM
O=c1ccc2cc(S(=O)(=O)[N-]c3cc(Cl)ccc3O)ccc2o1	ZINC000035592609	208132934	/nfs/dbraw/zinc/13/29/34/208132934.db2.gz	WLRDGMOKIWFJMX-UHFFFAOYSA-N	-1	0	351.767	2.953	50	0		FFAARM
CCCOc1ccc(-c2nnc(CCC(=O)NC(C)(C)C)c(=O)[n-]2)cc1	ZINC000034763773	208109248	/nfs/dbraw/zinc/10/92/48/208109248.db2.gz	BRWCMRGKFGMWCY-UHFFFAOYSA-N	-1	0	358.442	2.880	50	0		FFAARM
CC(C)CNC(=O)CCc1nnc(-c2ccc(C(F)(F)F)cc2)[n-]c1=O	ZINC000034768124	208109741	/nfs/dbraw/zinc/10/97/41/208109741.db2.gz	JWDDMJIEXUOLBV-UHFFFAOYSA-N	-1	0	368.359	2.968	50	0		FFAARM
COc1cc2c(cc1OC)[C@@H](CC(=O)[O-])N(C(=O)/C=C/c1ccco1)CC2	ZINC000299265704	208262379	/nfs/dbraw/zinc/26/23/79/208262379.db2.gz	JFHMTWQEBIFUCV-SQRWCISFSA-N	-1	0	371.389	2.911	50	0		FFAARM
CCOc1ccc2c(c1)C[C@H](C(=O)NCc1cc(C(=O)[O-])c(C)o1)CO2	ZINC000299747418	208341719	/nfs/dbraw/zinc/34/17/19/208341719.db2.gz	CXXUYPSEKZAUEW-ZDUSSCGKSA-N	-1	0	359.378	2.552	50	0		FFAARM
CCCc1noc2nc(-c3ccco3)cc(C(=O)N3CC[C@H](C(=O)[O-])C3)c12	ZINC000299745202	208342083	/nfs/dbraw/zinc/34/20/83/208342083.db2.gz	WONGVGOGWOLZHI-NSHDSACASA-N	-1	0	369.377	2.982	50	0		FFAARM
CCOc1ccc2c(c1)C[C@@H](C(=O)NCc1cc(C(=O)[O-])c(C)o1)CO2	ZINC000299747417	208342477	/nfs/dbraw/zinc/34/24/77/208342477.db2.gz	CXXUYPSEKZAUEW-CYBMUJFWSA-N	-1	0	359.378	2.552	50	0		FFAARM
C[C@]1(C(=O)[O-])CCN(C(=O)[C@H]2C[C@H]2c2ccc(Br)cc2)C1	ZINC000299746271	208342564	/nfs/dbraw/zinc/34/25/64/208342564.db2.gz	WGLAKHHJBKONIC-XEZPLFJOSA-N	-1	0	352.228	2.876	50	0		FFAARM
CCCc1noc2nc(-c3ccco3)cc(C(=O)N3CC[C@@H](C(=O)[O-])C3)c12	ZINC000299745201	208342652	/nfs/dbraw/zinc/34/26/52/208342652.db2.gz	WONGVGOGWOLZHI-LLVKDONJSA-N	-1	0	369.377	2.982	50	0		FFAARM
CN(Cc1ccc(C(=O)[O-])cc1)C(=O)[C@H]1CC(=O)N(C)[C@@H]1c1cccs1	ZINC000299749483	208355354	/nfs/dbraw/zinc/35/53/54/208355354.db2.gz	KMOPJIKNQUWDKJ-YOEHRIQHSA-N	-1	0	372.446	2.624	50	0		FFAARM
Cc1cc(Cl)ccc1O[C@@H](C)C(=O)N(CCC(=O)[O-])C1CCOCC1	ZINC000299753621	208362274	/nfs/dbraw/zinc/36/22/74/208362274.db2.gz	YUVUTPHLRKSOBD-ZDUSSCGKSA-N	-1	0	369.845	2.898	50	0		FFAARM
O=C([O-])[C@H](Cc1c[nH]c2cc(F)ccc12)NC(=O)CC[C@H]1CCCCO1	ZINC000095989864	209092635	/nfs/dbraw/zinc/09/26/35/209092635.db2.gz	FBDADPPUHSKQPJ-PBHICJAKSA-N	-1	0	362.401	2.768	50	0		FFAARM
CSCc1ccc(C(=O)N2C[C@@H]3c4ccccc4OC[C@]3(C(=O)[O-])C2)o1	ZINC000095354700	209025192	/nfs/dbraw/zinc/02/51/92/209025192.db2.gz	WYTHMDNCAYRYAO-AUUYWEPGSA-N	-1	0	373.430	2.846	50	0		FFAARM
Cc1cc(C)n(-c2ccc(C(=O)N(C)[C@H](C(=O)[O-])c3cccnc3)cc2)n1	ZINC000095376193	209036721	/nfs/dbraw/zinc/03/67/21/209036721.db2.gz	VRVBLJGRKMDRIO-SFHVURJKSA-N	-1	0	364.405	2.782	50	0		FFAARM
Cc1cc(C)n(-c2ccc(C(=O)N(C)[C@@H](C(=O)[O-])c3cccnc3)cc2)n1	ZINC000095376194	209036885	/nfs/dbraw/zinc/03/68/85/209036885.db2.gz	VRVBLJGRKMDRIO-GOSISDBHSA-N	-1	0	364.405	2.782	50	0		FFAARM
C[C@@H](c1ccc(S(C)(=O)=O)cc1)n1cc(-c2ccc(C(=O)[O-])cc2)nn1	ZINC000095377899	209039139	/nfs/dbraw/zinc/03/91/39/209039139.db2.gz	BMMYWYKXWZKCRH-LBPRGKRZSA-N	-1	0	371.418	2.656	50	0		FFAARM
Cc1ccc(Cn2[nH][n-]c3c(=O)n(-c4ccc(F)c(F)c4)c(=O)c2=3)cc1	ZINC000095481462	209060383	/nfs/dbraw/zinc/06/03/83/209060383.db2.gz	GIVYTRMNKCEZMN-HZPDHXFCSA-N	-1	0	356.332	2.767	50	0		FFAARM
O=C([O-])c1cccc(N2CCC[C@H](c3nccn3Cc3ccncc3)C2)n1	ZINC000092028849	132205650	/nfs/dbraw/zinc/20/56/50/132205650.db2.gz	BAQCIHMEAJOSGW-INIZCTEOSA-N	-1	0	363.421	2.804	50	0		FFAARM
O=C([O-])c1ccc(N2CCC[C@H](c3nccn3Cc3ccccn3)C2)nc1	ZINC000095367469	132208294	/nfs/dbraw/zinc/20/82/94/132208294.db2.gz	MYCMZGAWOMIHOA-INIZCTEOSA-N	-1	0	363.421	2.804	50	0		FFAARM
Cc1cc(C)cc(CN2CCN(c3ccc(Cl)c(C(=O)[O-])n3)CC2=O)c1	ZINC000095503155	132212258	/nfs/dbraw/zinc/21/22/58/132212258.db2.gz	OROGIXHXDMZMKE-UHFFFAOYSA-N	-1	0	373.840	2.899	50	0		FFAARM
O=C([O-])[C@H]1CN(C(=O)C2(c3ccc(F)cc3)CC2)CCN1c1ccccc1	ZINC000095522667	132214401	/nfs/dbraw/zinc/21/44/01/132214401.db2.gz	WMBOXUASLUDUAN-GOSISDBHSA-N	-1	0	368.408	2.659	50	0		FFAARM
O=C([O-])c1cn(C2CC2)c2c(F)c(N3CCSCC3)c(F)cc2c1=O	ZINC000005127391	132256229	/nfs/dbraw/zinc/25/62/29/132256229.db2.gz	LXQKRMWLZNCAFF-UHFFFAOYSA-N	-1	0	366.389	2.866	50	0		FFAARM
CC(C)C(=O)Nc1ccc(N2CCN(c3ccccn3)CC2)cc1C(=O)[O-]	ZINC000064589694	136133463	/nfs/dbraw/zinc/13/34/63/136133463.db2.gz	KPYBYQCKTUGIHD-UHFFFAOYSA-N	-1	0	368.437	2.701	50	0		FFAARM
O=C([O-])[C@]1(Cc2cccc(Cl)c2)CCCN(c2ncnc3nc[nH]c32)C1	ZINC000071776909	136141041	/nfs/dbraw/zinc/14/10/41/136141041.db2.gz	ZOQZNTOVFJLKAW-SFHVURJKSA-N	-1	0	371.828	2.920	50	0		FFAARM
C[C@H](O)c1cccc(N2CCC(C(=O)[O-])(n3ccc(C(C)(C)C)n3)CC2)n1	ZINC000072433477	136147208	/nfs/dbraw/zinc/14/72/08/136147208.db2.gz	FRLMAZIOHYVIIE-AWEZNQCLSA-N	-1	0	372.469	2.709	50	0		FFAARM
COc1ccc(C(=O)Nc2ccccc2C(=O)N[C@H](C(=O)[O-])C(C)C)cc1	ZINC000000846188	506235449	/nfs/dbraw/zinc/23/54/49/506235449.db2.gz	ICNWLOCYNRZUJT-KRWDZBQOSA-N	-1	0	370.405	2.787	50	0	biogenic	FFAARM
CCOC(=O)c1c(C)c(S(=O)(=O)[N-]c2cccc(C)c2)c(C)n1C	ZINC000064863355	506235925	/nfs/dbraw/zinc/23/59/25/506235925.db2.gz	UVNIFNOFVKITOA-UHFFFAOYSA-N	-1	0	350.440	2.928	50	0		FFAARM
CC(=O)Nc1ccc(S(=O)(=O)[N-]c2nnc(C)c3ccccc23)cc1	ZINC000000907188	506239301	/nfs/dbraw/zinc/23/93/01/506239301.db2.gz	IPHBJCRHYUIHPN-UHFFFAOYSA-N	-1	0	356.407	2.697	50	0		FFAARM
CC(C)(C)c1ccc(S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)[O-])cc1	ZINC000000952960	506240044	/nfs/dbraw/zinc/24/00/44/506240044.db2.gz	AJHUCLCRIWTQMB-KRWDZBQOSA-N	-1	0	361.463	2.958	50	0		FFAARM
CCOc1cc(/C=C2/NC(=O)[N-]C2=O)ccc1OCc1cccc(F)c1	ZINC000000979796	506242612	/nfs/dbraw/zinc/24/26/12/506242612.db2.gz	JHZOUUJJONNLNQ-OQLLNIDSSA-N	-1	0	356.353	2.984	50	0		FFAARM
CC[C@H](C(=O)Nc1ccc(S(=O)(=O)[N-]C(C)=O)cc1)c1ccccc1	ZINC000001088661	506247836	/nfs/dbraw/zinc/24/78/36/506247836.db2.gz	MMIQEAZQBGGRID-KRWDZBQOSA-N	-1	0	360.435	2.644	50	0		FFAARM
Cc1nc(N)nc(-c2cc(Br)cc(Br)c2[O-])n1	ZINC000001419193	506262718	/nfs/dbraw/zinc/26/27/18/506262718.db2.gz	JSFFAABHJHRVOR-UHFFFAOYSA-N	-1	0	360.009	2.660	50	0		FFAARM
CC(=O)N1CCc2sc(S(=O)(=O)[N-]c3ccc(C)c(F)c3)cc2C1	ZINC000065196123	506267627	/nfs/dbraw/zinc/26/76/27/506267627.db2.gz	ABXFKKAWJDWGQG-UHFFFAOYSA-N	-1	0	368.455	2.901	50	0		FFAARM
CCOc1ccccc1[N-]S(=O)(=O)c1c(C)nc2sc(C)nn21	ZINC000065183636	506267647	/nfs/dbraw/zinc/26/76/47/506267647.db2.gz	POLHXYHEQZZDQI-UHFFFAOYSA-N	-1	0	352.441	2.607	50	0		FFAARM
CS(=O)(=O)[N-]c1nc2nc(-c3ccccc3)cc(-c3ccccc3)n2n1	ZINC000002194495	506274301	/nfs/dbraw/zinc/27/43/01/506274301.db2.gz	DKLDKKOFLQDREQ-UHFFFAOYSA-N	-1	0	365.418	2.830	50	0		FFAARM
CCc1ccc([N-]S(=O)(=O)c2cc3n(c2)CCCN(CC)C3=O)cc1	ZINC000065258813	506277377	/nfs/dbraw/zinc/27/73/77/506277377.db2.gz	VCFIRPNJODJTCO-UHFFFAOYSA-N	-1	0	361.467	2.717	50	0		FFAARM
CSCC[C@H](NC(=O)Nc1ccc(OC(F)(F)F)cc1)C(=O)[O-]	ZINC000002430378	506280601	/nfs/dbraw/zinc/28/06/01/506280601.db2.gz	NIRUOVUTNPIHJE-JTQLQIEISA-N	-1	0	352.334	2.913	50	0		FFAARM
O=C([O-])[C@H](Cc1ccccc1)NS(=O)(=O)c1cccc2ccccc21	ZINC000002556842	506283452	/nfs/dbraw/zinc/28/34/52/506283452.db2.gz	NWHURKYFYGKGRT-KRWDZBQOSA-N	-1	0	355.415	2.814	50	0		FFAARM
Cc1cc(C)n([N-]C(=O)c2cnn3c2nc(C2CC2)cc3C(F)F)c(=O)c1	ZINC000002796741	506293086	/nfs/dbraw/zinc/29/30/86/506293086.db2.gz	ZMDYYJXZFLCNAO-UHFFFAOYSA-N	-1	0	373.363	2.707	50	0		FFAARM
O=C([O-])c1cccnc1CN1CCC[C@@H]1c1nc(-c2ccccn2)no1	ZINC000065408462	506295428	/nfs/dbraw/zinc/29/54/28/506295428.db2.gz	UDXOEKQGFBZIJO-OAHLLOKOSA-N	-1	0	351.366	2.562	50	0		FFAARM
Cc1ccc(N2CCC(Oc3ccc4ncccc4c3)(C(=O)[O-])CC2)nn1	ZINC000065460163	506302841	/nfs/dbraw/zinc/30/28/41/506302841.db2.gz	CAKPNQIWFJCRCI-UHFFFAOYSA-N	-1	0	364.405	2.836	50	0		FFAARM
O=C(C[C@H](C(=O)[O-])N1CCOCC1)Nc1ccc(Oc2ccccc2)cc1	ZINC000004487934	506377404	/nfs/dbraw/zinc/37/74/04/506377404.db2.gz	MEGODSAOAKOGED-GOSISDBHSA-N	-1	0	370.405	2.593	50	0		FFAARM
O=S(=O)([N-]c1cccc(-c2ccc3nncn3n2)c1)c1ccccc1F	ZINC000005150760	506424627	/nfs/dbraw/zinc/42/46/27/506424627.db2.gz	INKPORNRSITIKY-UHFFFAOYSA-N	-1	0	369.381	2.731	50	0		FFAARM
Cc1cccc(-n2nnnc2C2([N-]C(=O)C(F)(F)F)CCCCC2)c1	ZINC000005942990	506461629	/nfs/dbraw/zinc/46/16/29/506461629.db2.gz	PVBWOAUOJWAWDN-UHFFFAOYSA-N	-1	0	353.348	2.809	50	0		FFAARM
Cc1ccc(Br)cc1S(=O)(=O)[N-]c1ccccc1C(N)=O	ZINC000008778920	506668551	/nfs/dbraw/zinc/66/85/51/506668551.db2.gz	BQESFZKBVYFMMW-UHFFFAOYSA-N	-1	0	369.240	2.657	50	0		FFAARM
Cc1cc([C@H](C(=O)[O-])N2CCN(Cc3ncccc3C)CC2)ccc1F	ZINC000055060801	506669530	/nfs/dbraw/zinc/66/95/30/506669530.db2.gz	FUEBTXLPJMMVHP-LJQANCHMSA-N	-1	0	357.429	2.781	50	0		FFAARM
O=C([O-])[C@H]1CC=CC[C@@H]1C(=O)Nc1ccc(C(=O)NC2CC2)c(Cl)c1	ZINC000055150041	506687447	/nfs/dbraw/zinc/68/74/47/506687447.db2.gz	UNOATPDTPZJHQB-STQMWFEESA-N	-1	0	362.813	2.838	50	0		FFAARM
COc1ccc(C)cc1[C@H](C(=O)[O-])N(C)Cc1nc(-c2cccnc2)no1	ZINC000055255179	506709888	/nfs/dbraw/zinc/70/98/88/506709888.db2.gz	UVZBOJVXZYVOHV-QGZVFWFLSA-N	-1	0	368.393	2.706	50	0		FFAARM
COc1ccc(C)cc1[C@@H](C(=O)[O-])N(C)Cc1nc(-c2cccnc2)no1	ZINC000055255177	506710446	/nfs/dbraw/zinc/71/04/46/506710446.db2.gz	UVZBOJVXZYVOHV-KRWDZBQOSA-N	-1	0	368.393	2.706	50	0		FFAARM
C[C@@H](NC(=O)CSc1nnc(-c2ccccc2)c(=O)[n-]1)c1ccccc1	ZINC000011990559	506807838	/nfs/dbraw/zinc/80/78/38/506807838.db2.gz	YVOLDOCGAIDGIH-CYBMUJFWSA-N	-1	0	366.446	2.801	50	0		FFAARM
O=C([O-])[C@@H](Cc1c[nH]c2ccccc12)NC(=O)NCCOc1ccccc1	ZINC000013234920	506934532	/nfs/dbraw/zinc/93/45/32/506934532.db2.gz	FZFSBYBPJODCJE-GOSISDBHSA-N	-1	0	367.405	2.542	50	0		FFAARM
O=C([O-])CCNC(=O)/C(=C/C=C/c1ccccc1)NC(=O)c1ccccc1	ZINC000013523578	506942390	/nfs/dbraw/zinc/94/23/90/506942390.db2.gz	LCHWSKYUXRJEFA-DQBOXZGESA-N	-1	0	364.401	2.605	50	0		FFAARM
CCOc1ccc(/C=C2\SC(=O)N(CCC(=O)[O-])C2=O)cc1OC	ZINC000013758375	506956302	/nfs/dbraw/zinc/95/63/02/506956302.db2.gz	VOJITLZDVITQIT-LCYFTJDESA-N	-1	0	351.380	2.605	50	0		FFAARM
CCOc1ccc(C(=O)N(C)Cc2nc(=O)c3sccc3[n-]2)cc1OC	ZINC000014168931	506974458	/nfs/dbraw/zinc/97/44/58/506974458.db2.gz	MZDYDEGDWMVRJW-UHFFFAOYSA-N	-1	0	373.434	2.664	50	0		FFAARM
Cc1ccc(C)c(S(=O)(=O)n2cc(C(=O)c3cc(F)ccc3[O-])cn2)c1	ZINC000014198510	506977801	/nfs/dbraw/zinc/97/78/01/506977801.db2.gz	SXSLUZYWSGSSJA-UHFFFAOYSA-N	-1	0	374.393	2.813	50	0		FFAARM
CCCOc1ccccc1[N-]S(=O)(=O)c1ccc2c(c1)NC(=O)CO2	ZINC000014849829	507002579	/nfs/dbraw/zinc/00/25/79/507002579.db2.gz	MBQNFUKCNFEFBF-UHFFFAOYSA-N	-1	0	362.407	2.607	50	0		FFAARM
CCn1nc(C(=O)[O-])c2c1CC[C@H](N1CC(OCc3ccccc3C)C1)C2	ZINC000067770618	507003762	/nfs/dbraw/zinc/00/37/62/507003762.db2.gz	QVVNYIYIBSDKQC-INIZCTEOSA-N	-1	0	369.465	2.668	50	0		FFAARM
CCn1c(=O)c2ccc(C(=O)NCCc3ccc(F)cc3)cc2[n-]c1=S	ZINC000016640407	507100607	/nfs/dbraw/zinc/10/06/07/507100607.db2.gz	QGNFKGYKDBYPRW-UHFFFAOYSA-N	-1	0	371.437	2.817	50	0		FFAARM
O=C([O-])[C@@H]1C2CCC(CC2)[C@@H]1C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000017075897	507115261	/nfs/dbraw/zinc/11/52/61/507115261.db2.gz	QJYMVHPWVBCBQO-JOCCRWCTSA-N	-1	0	370.449	2.998	50	0		FFAARM
Cc1ccc(NS(=O)(=O)c2cc3c(c(C(=O)[O-])c2)OCCO3)c(C)c1	ZINC000057115549	507174668	/nfs/dbraw/zinc/17/46/68/507174668.db2.gz	QXHKQIQBPGHPMM-UHFFFAOYSA-N	-1	0	363.391	2.574	50	0		FFAARM
COc1ccccc1C[C@H](C(=O)Nc1cccc(C)c1C)c1nnn[n-]1	ZINC000057524718	507284846	/nfs/dbraw/zinc/28/48/46/507284846.db2.gz	GOUQZWDXRUYLHO-HNNXBMFYSA-N	-1	0	351.410	2.790	50	0		FFAARM
COc1cc(C)c(S(=O)(=O)Nc2cc(C(=O)[O-])ccc2C)cc1OC	ZINC000026529512	507596336	/nfs/dbraw/zinc/59/63/36/507596336.db2.gz	REVRGVZWJYEIFP-UHFFFAOYSA-N	-1	0	365.407	2.820	50	0		FFAARM
Cc1cccn2c(CC(=O)N3CC[C@@H](c4ccccc4C(=O)[O-])C3)cnc12	ZINC000072160967	507765946	/nfs/dbraw/zinc/76/59/46/507765946.db2.gz	VWXBWIFYZKRKSV-OAHLLOKOSA-N	-1	0	363.417	2.900	50	0		FFAARM
O=C([O-])c1cc(S(=O)(=O)N2CCc3ccccc32)c(Cl)cc1F	ZINC000063877023	507778310	/nfs/dbraw/zinc/77/83/10/507778310.db2.gz	PCBYGJMVZPZSAS-UHFFFAOYSA-N	-1	0	355.774	2.929	50	0		FFAARM
Cc1cccc(C(=O)N2CCC(Oc3ccccc3C)(C(=O)[O-])CC2)n1	ZINC000072420925	507787097	/nfs/dbraw/zinc/78/70/97/507787097.db2.gz	BXWGVZABPYITCC-UHFFFAOYSA-N	-1	0	354.406	2.837	50	0		FFAARM
Cc1cc(C)n(-c2ccc(F)cc2CN2CCc3nc[nH]c3[C@@H]2C(=O)[O-])n1	ZINC000072432939	507790604	/nfs/dbraw/zinc/79/06/04/507790604.db2.gz	PSBJASUXAHJILI-GOSISDBHSA-N	-1	0	369.400	2.535	50	0		FFAARM
CCOc1ccc(CN2CCc3nc[nH]c3[C@@H]2C(=O)[O-])c(OCC)c1C	ZINC000072434559	507791170	/nfs/dbraw/zinc/79/11/70/507791170.db2.gz	GIMVLETYTSWOOZ-QGZVFWFLSA-N	-1	0	359.426	2.700	50	0		FFAARM
O=C([O-])[C@@H]1c2[nH]cnc2CCN1Cc1ccc(OCc2ccccn2)cc1	ZINC000072440336	507792532	/nfs/dbraw/zinc/79/25/32/507792532.db2.gz	IFSBUZXKOBWXLK-IBGZPJMESA-N	-1	0	364.405	2.568	50	0		FFAARM
COc1ccc(C)cc1C(=O)N1C[C@@H](c2ccccc2OC)[C@H](C(=O)[O-])C1	ZINC000091320014	507980188	/nfs/dbraw/zinc/98/01/88/507980188.db2.gz	IAOBKVKRAXNWTI-DLBZAZTESA-N	-1	0	369.417	2.953	50	0		FFAARM
CC1(C)Cc2c(cnn2-c2cccc(F)c2)[C@@H](NC(=O)c2cc(=O)[nH][n-]2)C1	ZINC000091435228	507985634	/nfs/dbraw/zinc/98/56/34/507985634.db2.gz	JFHLUDCYOUYIOJ-HNNXBMFYSA-N	-1	0	369.400	2.884	50	0		FFAARM
CCC[C@]1(C(=O)[O-])CCCN(C(=O)c2cc(=O)[nH]c3ccc(C)cc32)C1	ZINC000091563120	507993118	/nfs/dbraw/zinc/99/31/18/507993118.db2.gz	JNWZTNYTKZJCEI-FQEVSTJZSA-N	-1	0	356.422	2.944	50	0		FFAARM
CO[C@H]1CCN(c2ccc([N-]S(=O)(=O)c3c(F)cccc3F)cc2)C1	ZINC000096122368	508206607	/nfs/dbraw/zinc/20/66/07/508206607.db2.gz	BLMMPJSXLDSNJK-AWEZNQCLSA-N	-1	0	368.405	2.991	50	0		FFAARM
COc1cccc(C)c1C(=O)N1C[C@@H]2c3ccccc3OC[C@]2(C(=O)[O-])C1	ZINC000096149369	508208432	/nfs/dbraw/zinc/20/84/32/508208432.db2.gz	BKYFGTRUAHOFQV-QVKFZJNVSA-N	-1	0	367.401	2.707	50	0		FFAARM
COc1ccc(/C=C\c2nc3ccccc3c(=O)n2CCC(=O)[O-])cc1O	ZINC000096765378	508215953	/nfs/dbraw/zinc/21/59/53/508215953.db2.gz	LVOAKMPULCSROJ-CLFYSBASSA-N	-1	0	366.373	2.756	50	0		FFAARM
CCCCCn1c2ccccc2c([O-])c(C(=O)Nc2cnccn2)c1=O	ZINC000100621177	508239516	/nfs/dbraw/zinc/23/95/16/508239516.db2.gz	TWBBAPGQSWOGQU-UHFFFAOYSA-N	-1	0	352.394	2.940	50	0		FFAARM
CCc1ccc(CN(C(=O)C(C)C)c2nn3c(nc(C)c(C)c3=O)[nH]2)cc1	ZINC000101877841	508259088	/nfs/dbraw/zinc/25/90/88/508259088.db2.gz	WIOJUHCWZVDZIU-UHFFFAOYSA-N	-1	0	367.453	2.786	50	0		FFAARM
CCOc1ccc(-c2ccnc(N(C)Cc3cnn(C)c3)n2)cc1C(=O)[O-]	ZINC000077438275	508315595	/nfs/dbraw/zinc/31/55/95/508315595.db2.gz	QIHUIRBUYXXZDH-UHFFFAOYSA-N	-1	0	367.409	2.610	50	0		FFAARM
Cc1ccc([C@@H]2NC(=O)N[C@](O)(C(F)(F)F)C2=C([O-])c2cccs2)o1	ZINC000106213533	508398001	/nfs/dbraw/zinc/39/80/01/508398001.db2.gz	NICRJXXZPLAFMD-UHIISALHSA-N	-1	0	374.340	2.753	50	0		FFAARM
COc1cc(Br)ccc1C(=O)NC1CCC(C(=O)[O-])CC1	ZINC000126827427	509134204	/nfs/dbraw/zinc/13/42/04/509134204.db2.gz	QBHUBDNHHLQWHT-UHFFFAOYSA-N	-1	0	356.216	2.831	50	0		FFAARM
CCC[C@@H](C)c1cc([N-]S(=O)(=O)c2cnc3c(c2)c(C)nn3C)n[nH]1	ZINC000162675161	509277138	/nfs/dbraw/zinc/27/71/38/509277138.db2.gz	RRYSMEXVEYNIGE-SNVBAGLBSA-N	-1	0	362.459	2.704	50	0		FFAARM
CCC[C@@H](NC(=O)C[C@H](NC(=O)c1ccccc1)c1ccccc1)C(=O)[O-]	ZINC000225484639	509374067	/nfs/dbraw/zinc/37/40/67/509374067.db2.gz	IJWNUFTYMLJFEL-MSOLQXFVSA-N	-1	0	368.433	2.917	50	0		FFAARM
CCCCCn1nc(C(=O)N2CCC[C@@H](C(=O)[O-])C2)c2ccccc2c1=O	ZINC000236696442	509483521	/nfs/dbraw/zinc/48/35/21/509483521.db2.gz	YVFLQTZTDIXHDA-CQSZACIVSA-N	-1	0	371.437	2.524	50	0		FFAARM
CCn1c(=O)c2ccc(C(=O)N[C@H](C)CC(C)(C)OC)cc2[n-]c1=S	ZINC000170640975	509692173	/nfs/dbraw/zinc/69/21/73/509692173.db2.gz	FXEUBTHFBAWLHF-LLVKDONJSA-N	-1	0	363.483	2.639	50	0		FFAARM
Cn1c(C(=O)N2CCO[C@H](CC(=O)[O-])C2)cc2cc(C(F)(F)F)ccc21	ZINC000237713881	509716735	/nfs/dbraw/zinc/71/67/35/509716735.db2.gz	MKNHQFOOJRVUND-GFCCVEGCSA-N	-1	0	370.327	2.513	50	0		FFAARM
O=C([O-])c1ccc(CNC(=O)CCCc2ccc3c(c2)CC(=O)N3)cc1	ZINC000238107352	509821588	/nfs/dbraw/zinc/82/15/88/509821588.db2.gz	NMPZDKNIZJCKIN-UHFFFAOYSA-N	-1	0	352.390	2.519	50	0		FFAARM
CCOC(=O)C(C(=O)OCC)=C([O-])c1ccc(Br)c(F)c1	ZINC000238860522	509835810	/nfs/dbraw/zinc/83/58/10/509835810.db2.gz	ZRFBAFIUHGHMIQ-UHFFFAOYSA-N	-1	0	361.163	2.513	50	0		FFAARM
COc1cc(C(C)=NNc2ccccc2C(=O)[O-])ccc1S(C)(=O)=O	ZINC000252667759	509858223	/nfs/dbraw/zinc/85/82/23/509858223.db2.gz	DLCRMXXBMFEQTH-UHFFFAOYSA-N	-1	0	362.407	2.633	50	0		FFAARM
O=C([O-])[C@@H]1c2ccccc2CCN1C(=O)c1ccc(N2CCCC2=O)cc1	ZINC000262506702	510302873	/nfs/dbraw/zinc/30/28/73/510302873.db2.gz	JFGUXIAGXQJTAY-IBGZPJMESA-N	-1	0	364.401	2.638	50	0		FFAARM
C[C@H](c1ccccc1)N1C[C@@H](C(=O)NCc2ccc(C(=O)[O-])s2)CC1=O	ZINC000263164957	510592505	/nfs/dbraw/zinc/59/25/05/510592505.db2.gz	ISBHIUOAQJEANN-OCCSQVGLSA-N	-1	0	372.446	2.672	50	0		FFAARM
COc1ccc(CCC(=O)N2[C@H](C(=O)[O-])C[C@H]3CCCC[C@@H]32)cc1OC	ZINC000263680040	510786493	/nfs/dbraw/zinc/78/64/93/510786493.db2.gz	GZJOMPUUNLBZPA-PMPSAXMXSA-N	-1	0	361.438	2.881	50	0		FFAARM
Cn1cc(C(=O)N2CCC(c3cc(CC(=O)[O-])n[nH]3)CC2)c2ccccc21	ZINC000299802813	511685882	/nfs/dbraw/zinc/68/58/82/511685882.db2.gz	QJYUTXBGMYIUJA-UHFFFAOYSA-N	-1	0	366.421	2.548	50	0		FFAARM
COCC(=O)Nc1cc2ncn(CCc3ccccc3)c2c(C(=O)[O-])c1	ZINC000299802192	511685954	/nfs/dbraw/zinc/68/59/54/511685954.db2.gz	YVHPEBOGGXLDJC-UHFFFAOYSA-N	-1	0	353.378	2.562	50	0		FFAARM
Cc1c(Cl)cccc1OCC(=O)N(CCC(=O)[O-])C1CCOCC1	ZINC000328595522	511889898	/nfs/dbraw/zinc/88/98/98/511889898.db2.gz	XEYRXTXQPKJSFW-UHFFFAOYSA-N	-1	0	355.818	2.510	50	0		FFAARM
CCOc1cccc2c1OC[C@H](C(=O)NCc1cc(C(=O)[O-])c(C)o1)C2	ZINC000372022863	512682725	/nfs/dbraw/zinc/68/27/25/512682725.db2.gz	AGIMOUQRDZNOEB-CYBMUJFWSA-N	-1	0	359.378	2.552	50	0		FFAARM
O=C([O-])CCN(C[C@@H]1CCCO1)C(=O)[C@H]1C[C@H]1c1cccc(F)c1F	ZINC000408513244	513083227	/nfs/dbraw/zinc/08/32/27/513083227.db2.gz	FGULFEMWQFQOKV-UBHSHLNASA-N	-1	0	353.365	2.551	50	0		FFAARM
C[C@@H](C(=O)[O-])N(C)C(=O)[C@H](c1cccc(Br)c1)N1CCCC1	ZINC000408513538	513083973	/nfs/dbraw/zinc/08/39/73/513083973.db2.gz	VCRSHTUKJFJQGO-FZMZJTMJSA-N	-1	0	369.259	2.518	50	0		FFAARM
CCOc1ccc(S(=O)(=O)[N-]c2cc(C)n(C(C)C)n2)cc1C(=O)[O-]	ZINC000421182235	513140082	/nfs/dbraw/zinc/14/00/82/513140082.db2.gz	KNGMGGKICZEDNE-UHFFFAOYSA-N	-1	0	367.427	2.670	50	0		FFAARM
O=C([O-])c1csc(CCNC(=O)N2CCCC[C@H]2c2cccnc2)n1	ZINC000426414245	513934736	/nfs/dbraw/zinc/93/47/36/513934736.db2.gz	FNVFHYZIDBLVNH-AWEZNQCLSA-N	-1	0	360.439	2.716	50	0		FFAARM
O=C([O-])CC1(NC(=O)N2CCN(Cc3cccs3)CC2)CCCCC1	ZINC000426441737	513942657	/nfs/dbraw/zinc/94/26/57/513942657.db2.gz	HEIBGAXCIHSTCH-UHFFFAOYSA-N	-1	0	365.499	2.753	50	0		FFAARM
CC[C@H]1CCN(C(=O)c2cn(CCc3ccccc3)cc(C(=O)[O-])c2=O)C1	ZINC000426511627	513965859	/nfs/dbraw/zinc/96/58/59/513965859.db2.gz	IQZKTIXEPKQPDN-HNNXBMFYSA-N	-1	0	368.433	2.661	50	0		FFAARM
CCN(Cc1noc(C2CC2)n1)C(=O)N[C@@H](C(=O)[O-])c1cccc(C)c1	ZINC000426689346	514016931	/nfs/dbraw/zinc/01/69/31/514016931.db2.gz	WWMZGUPLNYJAQQ-OAHLLOKOSA-N	-1	0	358.398	2.613	50	0		FFAARM
O=C([O-])Cn1ccc([C@@H]2CCCN(C(=O)c3ccnc4ccccc43)C2)n1	ZINC000426705562	514019645	/nfs/dbraw/zinc/01/96/45/514019645.db2.gz	COQKAGVRQPOLCO-CQSZACIVSA-N	-1	0	364.405	2.536	50	0		FFAARM
COCC[C@]1(C(=O)[O-])CCCN(C(=O)c2csc3c2CCCC3)C1	ZINC000091625899	518073836	/nfs/dbraw/zinc/07/38/36/518073836.db2.gz	FHBOWTPIDIQLPI-GOSISDBHSA-N	-1	0	351.468	2.970	50	0		FFAARM
CCC[C@H](NC(=O)CSc1ccc(Br)cc1)c1nnn[n-]1	ZINC000089949574	521128085	/nfs/dbraw/zinc/12/80/85/521128085.db2.gz	JTGJJBQMJNNGET-NSHDSACASA-N	-1	0	370.276	2.712	50	0		FFAARM
CCc1nc(C)sc1C(=O)N1C[C@@H](c2cccc(OC)c2)[C@H](C(=O)[O-])C1	ZINC000091469033	522240285	/nfs/dbraw/zinc/24/02/85/522240285.db2.gz	KQHIQZUCFJNMES-LSDHHAIUSA-N	-1	0	374.462	2.963	50	0		FFAARM
O=C([O-])c1cnc(C2CCN(C(=O)c3cnn4ccccc34)CC2)s1	ZINC000630246380	522736384	/nfs/dbraw/zinc/73/63/84/522736384.db2.gz	WTKMLPRRDRZPQT-UHFFFAOYSA-N	-1	0	356.407	2.509	50	0		FFAARM
COC(=O)C[C@H](NC(=O)[C@H]1CCCC[C@H]1C(=O)[O-])c1cc(C)ccc1C	ZINC000239222093	523336807	/nfs/dbraw/zinc/33/68/07/523336807.db2.gz	UIZSNGWYNLFTHM-UXLLHSPISA-N	-1	0	361.438	2.915	50	0		FFAARM
COc1ccc(C(NC(=O)[C@H]2C[C@@H]2C(=O)[O-])c2ccc(OC)cc2)cc1	ZINC000299753611	523796794	/nfs/dbraw/zinc/79/67/94/523796794.db2.gz	YUFIDRRBKHGYJX-IRXDYDNUSA-N	-1	0	355.390	2.630	50	0		FFAARM
COc1cccc([C@@H]2CN(C(=O)c3ccc(OC)c(F)c3)C[C@H]2C(=O)[O-])c1	ZINC000091444504	524120846	/nfs/dbraw/zinc/12/08/46/524120846.db2.gz	JEOPPXBBMOQUCP-JKSUJKDBSA-N	-1	0	373.380	2.783	50	0		FFAARM
C[C@@H](Sc1ccccc1Cl)C(=O)N1CCC[C@H](c2nnn[n-]2)C1	ZINC000089420092	525994539	/nfs/dbraw/zinc/99/45/39/525994539.db2.gz	NCJJLCDGQZTTHR-MNOVXSKESA-N	-1	0	351.863	2.740	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)C[C@@H]1CCCO1)c1ccc(Br)cc1	ZINC000238128027	527624092	/nfs/dbraw/zinc/62/40/92/527624092.db2.gz	WZSWPTNEPDCJCV-QWHCGFSZSA-N	-1	0	356.216	2.650	50	0		FFAARM
O=C([O-])C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2Cl)CCO1	ZINC000268942531	527630147	/nfs/dbraw/zinc/63/01/47/527630147.db2.gz	FTHODCZSPUCXTO-ADEWGFFLSA-N	-1	0	358.221	2.799	50	0		FFAARM
Cc1nc(-c2ncccn2)sc1C(=O)N[C@@H]1CCCCC[C@@H]1C(=O)[O-]	ZINC000120177361	570806890	/nfs/dbraw/zinc/80/68/90/570806890.db2.gz	WSDKWZWWRFFBHV-NWDGAFQWSA-N	-1	0	360.439	2.672	50	0		FFAARM
Cn1c2ccccc2c([O-])c(-c2nc(-c3ccc4c(c3)OCO4)no2)c1=O	ZINC000101725644	570822925	/nfs/dbraw/zinc/82/29/25/570822925.db2.gz	FWVQLTJRBJFRHQ-UHFFFAOYSA-N	-1	0	363.329	2.690	50	0		FFAARM
O=C([O-])[C@H]1COCCN(C(=O)OCC2c3ccccc3-c3ccccc32)C1	ZINC000307122452	571114504	/nfs/dbraw/zinc/11/45/04/571114504.db2.gz	LTFXJQSQUFXUSI-CQSZACIVSA-N	-1	0	367.401	2.969	50	0		FFAARM
CS(=O)(=O)[C@H]1CCC[C@H](NC(=O)c2ccc3[n-]c(=S)oc3c2)C1	ZINC000073930092	571138943	/nfs/dbraw/zinc/13/89/43/571138943.db2.gz	SFBPURUEVAYNSH-QWRGUYRKSA-N	-1	0	354.453	2.576	50	0		FFAARM
CCc1n[nH]c(=S)n1CCNC(=O)[C@H]1CCCC[C@H]1C(F)(F)F	ZINC000073997831	571139073	/nfs/dbraw/zinc/13/90/73/571139073.db2.gz	JBKQPBQXCPWDAS-VHSXEESVSA-N	-1	0	350.410	2.988	50	0		FFAARM
COc1ccc(CNC(=O)c2cnn(-c3ccccc3C)c2)cc1C(=O)[O-]	ZINC000170043711	571261097	/nfs/dbraw/zinc/26/10/97/571261097.db2.gz	TVERHXLPTHIHKL-UHFFFAOYSA-N	-1	0	365.389	2.818	50	0		FFAARM
O=C([O-])CC1(NC(=O)c2ccc(N3CCC(O)CC3)cc2)CCCCC1	ZINC000663120593	601185397	/nfs/dbraw/zinc/18/53/97/601185397.db2.gz	ZKOCFQCGOLQMKR-UHFFFAOYSA-N	-1	0	360.454	2.555	50	0		FFAARM
Nc1ccc([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])c(C(F)(F)F)c1	ZINC000325034226	729758165	/nfs/dbraw/zinc/75/81/65/729758165.db2.gz	KHIJIYGIYOUACM-UHFFFAOYSA-N	-1	0	361.301	2.997	50	0		FFAARM
O=C([O-])C1(C(=O)N[C@@H]2CSCc3ccc(Br)cc32)CC1	ZINC000585094070	729982339	/nfs/dbraw/zinc/98/23/39/729982339.db2.gz	NDCBIWIMBOXTND-LLVKDONJSA-N	-1	0	356.241	2.718	50	0		FFAARM
O=C([O-])C1(Oc2ccc(Cl)cc2)CCN(C(=O)Cc2ccncc2)CC1	ZINC000199454717	973355187	/nfs/dbraw/zinc/35/51/87/973355187.db2.gz	ZVLPRUZJZPZNSS-UHFFFAOYSA-N	-1	0	374.824	2.802	50	0		FFAARM
O=C([O-])c1cc2ncc(-c3cc(F)ccc3OC[C@H]3CCCO3)cn2n1	ZINC000874969891	990783907	/nfs/dbraw/zinc/78/39/07/990783907.db2.gz	HVPSSOLMGGPVAE-CYBMUJFWSA-N	-1	0	357.341	2.791	50	0		FFAARM
Cc1cc(C(=O)N2CCC[C@H]2C(=O)[O-])nn1-c1cccc(C(F)(F)F)c1	ZINC000652069343	1024817448	/nfs/dbraw/zinc/81/74/48/1024817448.db2.gz	HSLDOTJYKSVOKC-AWEZNQCLSA-N	-1	0	367.327	2.889	50	0		FFAARM
C[C@@H]1OCCC[C@H]1C(=O)Nc1cccc(C(=O)N2CCCC[C@@H]2C(=O)[O-])c1	ZINC000668274520	1027582745	/nfs/dbraw/zinc/58/27/45/1027582745.db2.gz	FQQAYIWKXPVUTG-IAOVAPTHSA-N	-1	0	374.437	2.520	50	0		FFAARM
CC[C@@H](C)[C@H](NC(=O)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1)C(=O)[O-]	ZINC000236866111	1031681184	/nfs/dbraw/zinc/68/11/84/1031681184.db2.gz	YCKHWAZAWYDYAM-BZNIZROVSA-N	-1	0	359.426	2.674	50	0		FFAARM
COc1ccc2[nH]c(CCN(C)C(=O)c3c(C)[nH]c(C(=O)[O-])c3C)nc2c1	ZINC001506407018	1059498684	/nfs/dbraw/zinc/49/86/84/1059498684.db2.gz	IFXKBEJEKUUTJP-UHFFFAOYSA-N	-1	0	370.409	2.529	50	0		FFAARM
Cc1cccc(-n2c(=O)cc([O-])nc2SCC(=O)NC2CCCCC2)c1	ZINC000001115709	219372421	/nfs/dbraw/zinc/37/24/21/219372421.db2.gz	QJUCWDOQFPFYPJ-UHFFFAOYSA-N	-1	0	373.478	2.788	50	0		FFAARM
Cc1oc2cc3oc(=O)c(CCC(=O)NCCC(=O)[O-])c(C)c3cc2c1C	ZINC000002104755	209394148	/nfs/dbraw/zinc/39/41/48/209394148.db2.gz	ZDAUBNBVRMFRNA-UHFFFAOYSA-N	-1	0	371.389	2.988	50	0	biogenic	FFAARM
O=C([O-])CC[C@@H](CNS(=O)(=O)c1ccc(Cl)s1)C(F)(F)F	ZINC000001802364	209391821	/nfs/dbraw/zinc/39/18/21/209391821.db2.gz	MMJIZRQLHKWCBH-LURJTMIESA-N	-1	0	365.782	2.723	50	0		FFAARM
CN(C(=O)c1cccc(C(=O)N2CCC[C@H](C(=O)[O-])C2)c1)c1ccccc1	ZINC000136127093	209373307	/nfs/dbraw/zinc/37/33/07/209373307.db2.gz	PQXAMQQMPLRCQV-KRWDZBQOSA-N	-1	0	366.417	2.900	50	0		FFAARM
O=C([O-])CN(C(=O)c1cnc(-c2ccsc2)s1)C1CCOCC1	ZINC000238114928	209359490	/nfs/dbraw/zinc/35/94/90/209359490.db2.gz	OZRHTXPUWSLSEN-UHFFFAOYSA-N	-1	0	352.437	2.577	50	0		FFAARM
O=C([O-])C1CCN(C(=O)[C@@H]2C[C@@H]2c2ccc(Br)cc2)CC1	ZINC000238025436	209358009	/nfs/dbraw/zinc/35/80/09/209358009.db2.gz	UZDHDNHZFSSDIO-ZIAGYGMSSA-N	-1	0	352.228	2.876	50	0		FFAARM
O=C([O-])CN(C(=O)CCc1ncc(-c2ccc(F)cc2F)o1)C1CC1	ZINC000238072458	209357442	/nfs/dbraw/zinc/35/74/42/209357442.db2.gz	MOLJCKZRIZEINH-UHFFFAOYSA-N	-1	0	350.321	2.628	50	0		FFAARM
O=C([O-])C1(c2ccccc2)CCN(C(=O)C[C@H](O)c2cccc(F)c2)CC1	ZINC000237995004	209357453	/nfs/dbraw/zinc/35/74/53/209357453.db2.gz	NLTLXSJUBAHEJA-SFHVURJKSA-N	-1	0	371.408	2.894	50	0		FFAARM
O=C([O-])CC[C@@H]1CCCCN1C(=O)CCCc1ccc2c(c1)CC(=O)N2	ZINC000237922249	209356457	/nfs/dbraw/zinc/35/64/57/209356457.db2.gz	FIJLHERVCKFIJH-INIZCTEOSA-N	-1	0	358.438	2.750	50	0		FFAARM
O=C([O-])c1ccc(/C=C/C(=O)N2CCC(CN3CCCCC3=O)CC2)cc1	ZINC000237947404	209355352	/nfs/dbraw/zinc/35/53/52/209355352.db2.gz	MNVIFCLLEANIAO-RMKNXTFCSA-N	-1	0	370.449	2.649	50	0		FFAARM
Cc1nn(-c2ccc(F)cc2)c(Cl)c1C(=O)N1CCC(C(=O)[O-])CC1	ZINC000237767810	209353708	/nfs/dbraw/zinc/35/37/08/209353708.db2.gz	SMASOCSXODSMIV-UHFFFAOYSA-N	-1	0	365.792	2.910	50	0		FFAARM
Cc1nc(-c2cnn(C)c2)sc1C(=O)N1CCCC[C@H]1CCC(=O)[O-]	ZINC000237733385	209353485	/nfs/dbraw/zinc/35/34/85/209353485.db2.gz	GVSFPNGKCJHEAF-ZDUSSCGKSA-N	-1	0	362.455	2.712	50	0		FFAARM
Cc1nc(-c2ncccn2)sc1C(=O)N[C@H]1CCCCC[C@H]1C(=O)[O-]	ZINC000120177831	209352013	/nfs/dbraw/zinc/35/20/13/209352013.db2.gz	WSDKWZWWRFFBHV-NEPJUHHUSA-N	-1	0	360.439	2.672	50	0		FFAARM
CCn1c2ccccc2c([O-])c(C(=O)NCc2ccccc2OC)c1=O	ZINC000100621130	209214864	/nfs/dbraw/zinc/21/48/64/209214864.db2.gz	CDELIKZWJREZTE-UHFFFAOYSA-N	-1	0	352.390	2.666	50	0		FFAARM
CC(C)CCn1c2ccccc2c([O-])c(C(=O)Nc2ncccn2)c1=O	ZINC000100472735	209214479	/nfs/dbraw/zinc/21/44/79/209214479.db2.gz	XPKGFLMSKFQGPR-UHFFFAOYSA-N	-1	0	352.394	2.796	50	0		FFAARM
Cc1nnc(CN(C)Cc2ccc(OCc3ccc(C(=O)[O-])o3)cc2)o1	ZINC000097797502	209196692	/nfs/dbraw/zinc/19/66/92/209196692.db2.gz	WDLMGKMHBXAWMR-UHFFFAOYSA-N	-1	0	357.366	2.880	50	0		FFAARM
CC(C)C[C@@H](NC(=O)c1ccc(CN2C[C@@H](C)O[C@H](C)C2)cc1)C(=O)[O-]	ZINC000236602817	209188509	/nfs/dbraw/zinc/18/85/09/209188509.db2.gz	NKEILEYWIPSLQD-IIDMSEBBSA-N	-1	0	362.470	2.525	50	0		FFAARM
COCCOc1cc(NC(=O)CSCC(=O)[O-])c(Cl)cc1Cl	ZINC000002571582	206921213	/nfs/dbraw/zinc/92/12/13/206921213.db2.gz	WDKRFQJFCOSDID-UHFFFAOYSA-N	-1	0	368.238	2.775	50	0		FFAARM
COc1ccc(OC)c(NC(=O)[N-]S(=O)(=O)c2ccc(C)cc2)c1	ZINC000002807036	206937092	/nfs/dbraw/zinc/93/70/92/206937092.db2.gz	RDCLIUXFPRICNL-UHFFFAOYSA-N	-1	0	350.396	2.523	50	0		FFAARM
CCCCNC(=O)Nc1ccc(S(=O)(=O)[N-]c2cc(C)on2)cc1	ZINC000004297039	207010364	/nfs/dbraw/zinc/01/03/64/207010364.db2.gz	YQVISLXZBTVKNJ-UHFFFAOYSA-N	-1	0	352.416	2.705	50	0		FFAARM
O=C([O-])c1cnn2c1N[C@@H](c1ccc3c(c1)OCO3)C[C@H]2C(F)(F)F	ZINC000004666110	207035077	/nfs/dbraw/zinc/03/50/77/207035077.db2.gz	BLNNAPTWPAAZLE-SKDRFNHKSA-N	-1	0	355.272	2.970	50	0		FFAARM
CC(=O)Oc1ccc(NC(=O)COc2ccccc2Cl)c(C(=O)[O-])c1	ZINC000004824146	207053568	/nfs/dbraw/zinc/05/35/68/207053568.db2.gz	VEOHEMTWKKQHAA-UHFFFAOYSA-N	-1	0	363.753	2.981	50	0		FFAARM
COc1ccc(CN2C(=O)[C@]([O-])(C(F)(F)F)N=C2c2ccccc2)cc1	ZINC000005324311	207092330	/nfs/dbraw/zinc/09/23/30/207092330.db2.gz	VHTJTDNSMZKGIV-KRWDZBQOSA-N	-1	0	364.323	2.735	50	0		FFAARM
CCCCOC(=O)CN1C(=O)S/C(=C\c2ccc(C(=O)[O-])cc2)C1=O	ZINC000006650140	207152194	/nfs/dbraw/zinc/15/21/94/207152194.db2.gz	XFYZYUDXGJQZMB-LCYFTJDESA-N	-1	0	363.391	2.764	50	0		FFAARM
Cc1cccc([N-]S(=O)(=O)c2ccc(I)cc2)n1	ZINC000006700637	207154102	/nfs/dbraw/zinc/15/41/02/207154102.db2.gz	DPKNXUNXTANXPN-UHFFFAOYSA-N	-1	0	374.203	2.795	50	0		FFAARM
O=C([O-])[C@H]1CC=CC[C@H]1C(=O)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000006726758	207156608	/nfs/dbraw/zinc/15/66/08/207156608.db2.gz	CMRMAQFDMFBWPC-SJORKVTESA-N	-1	0	362.857	2.651	50	0		FFAARM
Cc1nn([C@@H](C)C(=O)[O-])c(=O)n1-c1ccc(OCc2ccccc2)cc1	ZINC000006925412	207178643	/nfs/dbraw/zinc/17/86/43/207178643.db2.gz	IUPSRCJRVQLHCV-ZDUSSCGKSA-N	-1	0	353.378	2.567	50	0		FFAARM
Cc1ccc([N-]S(=O)(=O)c2ccc(-c3ccc(=O)[nH]n3)o2)cc1Cl	ZINC000006973979	207180773	/nfs/dbraw/zinc/18/07/73/207180773.db2.gz	WIOMQWXIXKGCPW-UHFFFAOYSA-N	-1	0	365.798	2.793	50	0		FFAARM
CCOC(=O)c1c(C)[nH]c(C)c1S(=O)(=O)[N-]c1ccc(F)c(F)c1	ZINC000007006861	207183880	/nfs/dbraw/zinc/18/38/80/207183880.db2.gz	LFVLZNXDCVQSEM-UHFFFAOYSA-N	-1	0	358.366	2.887	50	0		FFAARM
CCOc1ccc(NS(=O)(=O)c2ccc(OCC(=O)[O-])c(C)c2)cc1	ZINC000007361963	207194436	/nfs/dbraw/zinc/19/44/36/207194436.db2.gz	DDKBTVXWHXITNZ-UHFFFAOYSA-N	-1	0	365.407	2.658	50	0		FFAARM
O=c1nc(CSc2nnc3[nH]c4ccccc4n32)[n-]c2ccsc21	ZINC000009219816	207262642	/nfs/dbraw/zinc/26/26/42/207262642.db2.gz	OVDGLVZTHVRMLV-UHFFFAOYSA-N	-1	0	354.420	2.801	50	0		FFAARM
CC[C@H](C)[C@H](NC(=O)Cc1csc(-c2cccc(OC)c2)n1)C(=O)[O-]	ZINC000036580003	207285188	/nfs/dbraw/zinc/28/51/88/207285188.db2.gz	MXBZDJYAFAKPQJ-ZBEGNZNMSA-N	-1	0	362.451	2.977	50	0		FFAARM
CCOC(=O)c1ccc(NC(=O)CSc2ncccc2C(=O)[O-])cc1	ZINC000009970612	207290805	/nfs/dbraw/zinc/29/08/05/207290805.db2.gz	SZVIIIPDEBSBNJ-UHFFFAOYSA-N	-1	0	360.391	2.687	50	0		FFAARM
O=C([O-])[C@H]1CN(C(=O)OCC2c3ccccc3-c3ccccc32)CCO1	ZINC000014632631	207523683	/nfs/dbraw/zinc/52/36/83/207523683.db2.gz	TUZVFPRISNDQLQ-GOSISDBHSA-N	-1	0	353.374	2.721	50	0		FFAARM
O=C([O-])c1cccnc1S[C@@H]1CC(=O)N(c2ccccc2Cl)C1=O	ZINC000019789800	207712435	/nfs/dbraw/zinc/71/24/35/207712435.db2.gz	CUXULQVPZZCWTB-GFCCVEGCSA-N	-1	0	362.794	2.857	50	0		FFAARM
Cc1nc(NC(=O)c2ccc([O-])c(Cl)c2)sc1SCC(N)=O	ZINC000030686493	208004834	/nfs/dbraw/zinc/00/48/34/208004834.db2.gz	PTENMERJXGACJT-UHFFFAOYSA-N	-1	0	357.844	2.640	50	0		FFAARM
O=S(=O)([N-]c1ccc(Cn2cncn2)cc1)c1ccc(Cl)s1	ZINC000032592277	208031366	/nfs/dbraw/zinc/03/13/66/208031366.db2.gz	DQORSMYWEWDJRU-UHFFFAOYSA-N	-1	0	354.844	2.842	50	0		FFAARM
O=C([O-])c1cccc(NC(=O)N2CCc3[nH]cnc3[C@H]2c2ccncc2)c1	ZINC000040312903	208179408	/nfs/dbraw/zinc/17/94/08/208179408.db2.gz	MOEXCQNQTXHNIG-QGZVFWFLSA-N	-1	0	363.377	2.683	50	0	biogenic	FFAARM
CCSc1ncc(Cl)c(C(=O)N[C@H](Cc2ccccc2)C(=O)[O-])n1	ZINC000041097332	208280572	/nfs/dbraw/zinc/28/05/72/208280572.db2.gz	WRIYDVMOOICWAC-GFCCVEGCSA-N	-1	0	365.842	2.668	50	0		FFAARM
COc1ccc(S(=O)(=O)[N-]C(=O)[C@@H]2[C@@H](C=C(C)C)C2(C)C)cc1OC	ZINC000042295062	208290777	/nfs/dbraw/zinc/29/07/77/208290777.db2.gz	WVMXLKXRMGDETI-CJNGLKHVSA-N	-1	0	367.467	2.747	50	0		FFAARM
COc1cc(C(=O)N2CC[C@H](C(=O)[O-])C2)ccc1OCc1ccccc1	ZINC000299741575	208337921	/nfs/dbraw/zinc/33/79/21/208337921.db2.gz	GNVCGFSBAZOGDP-INIZCTEOSA-N	-1	0	355.390	2.821	50	0		FFAARM
O=C([O-])[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)CCc1nc(C2CCCC2)no1	ZINC000299744582	208340042	/nfs/dbraw/zinc/34/00/42/208340042.db2.gz	PHFMUJDIPFZISY-ILXRZTDVSA-N	-1	0	361.442	2.904	50	0		FFAARM
CCOc1c(Br)cc(C(=O)N(CC(=O)[O-])C2CC2)cc1OC	ZINC000299744013	208340665	/nfs/dbraw/zinc/34/06/65/208340665.db2.gz	NHMYYRVTKZVSQJ-UHFFFAOYSA-N	-1	0	372.215	2.546	50	0		FFAARM
O=C([O-])[C@@H]1Cc2ccccc2CN1C(=O)Cc1cc2ccccc2[nH]c1=O	ZINC000299748998	208355069	/nfs/dbraw/zinc/35/50/69/208355069.db2.gz	IVKUPMKQRBDPLQ-SFHVURJKSA-N	-1	0	362.385	2.521	50	0		FFAARM
COc1ccc(CNC(=O)C[C@@H]2CCOc3ccccc32)cc1C(=O)[O-]	ZINC000299750376	208357391	/nfs/dbraw/zinc/35/73/91/208357391.db2.gz	NHOPNVPRJXDQIX-AWEZNQCLSA-N	-1	0	355.390	2.966	50	0		FFAARM
O=C([O-])CN(CCc1ccccc1)C(=O)c1ccc2c(c1)NC(=O)CS2	ZINC000299753927	208362137	/nfs/dbraw/zinc/36/21/37/208362137.db2.gz	ZUQOSMMTNLRWOX-UHFFFAOYSA-N	-1	0	370.430	2.500	50	0		FFAARM
O=C([O-])CCN(C[C@@H]1CCCO1)C(=O)[C@@H]1C[C@H]1c1cc(F)ccc1F	ZINC000299753700	208363007	/nfs/dbraw/zinc/36/30/07/208363007.db2.gz	YZZHXJWSWDJHIW-KCQAQPDRSA-N	-1	0	353.365	2.551	50	0		FFAARM
Cc1cc(C(=O)[O-])c(O)c(S(=O)(=O)N(C)c2c(F)cccc2F)c1	ZINC000058377399	208583083	/nfs/dbraw/zinc/58/30/83/208583083.db2.gz	CPNHLMQPLKVKEP-UHFFFAOYSA-N	-1	0	357.334	2.502	50	0		FFAARM
Cc1ccccc1OC1(C(=O)[O-])CCN(C(=O)CCn2cccc2)CC1	ZINC000072407769	208848670	/nfs/dbraw/zinc/84/86/70/208848670.db2.gz	XJGPDYQIVRBSQG-UHFFFAOYSA-N	-1	0	356.422	2.711	50	0		FFAARM
CCOc1ccc(-c2ccnc(N3CC[C@@H](COC)C3)n2)cc1C(=O)[O-]	ZINC000072409227	208850149	/nfs/dbraw/zinc/85/01/49/208850149.db2.gz	SAQXTTPXKYPWRY-CYBMUJFWSA-N	-1	0	357.410	2.713	50	0		FFAARM
CCc1ccccc1C(=O)N1CCC2(CCC(=O)N([C@H](C)C(=O)[O-])C2)CC1	ZINC000091860759	209001591	/nfs/dbraw/zinc/00/15/91/209001591.db2.gz	IYOKNWCJOBREBJ-OAHLLOKOSA-N	-1	0	372.465	2.567	50	0		FFAARM
COc1cccc([C@@H]2CN(C(=O)CC3CCCC3)C[C@H]2C(=O)[O-])c1OC	ZINC000091974408	209009149	/nfs/dbraw/zinc/00/91/49/209009149.db2.gz	VEAOXIPAEOLPKO-JKSUJKDBSA-N	-1	0	361.438	2.911	50	0		FFAARM
CSc1ccccc1[C@H](C(=O)[O-])N1CCN(Cc2cccnc2)CC1	ZINC000095363130	209030070	/nfs/dbraw/zinc/03/00/70/209030070.db2.gz	APHOMWXKLCJVIZ-GOSISDBHSA-N	-1	0	357.479	2.747	50	0		FFAARM
O=C([O-])c1cccc([C@@H]2CCCN(CC(=O)NCc3cccs3)C2)c1	ZINC000095389233	209045471	/nfs/dbraw/zinc/04/54/71/209045471.db2.gz	MCHBCVDJJUFIQS-MRXNPFEDSA-N	-1	0	358.463	2.942	50	0		FFAARM
CCOc1cc(F)cc([C@H](C(=O)[O-])N2CCN(c3ncccc3C)CC2)c1	ZINC000095531538	132215354	/nfs/dbraw/zinc/21/53/54/132215354.db2.gz	MANPGWREHVFVKO-GOSISDBHSA-N	-1	0	373.428	2.876	50	0		FFAARM
C[C@H](Nc1ncc(C(C)(C)C(=O)[O-])c(N2CCOCC2)n1)C1CCCC1	ZINC000096149722	132220747	/nfs/dbraw/zinc/22/07/47/132220747.db2.gz	XQOHAKYSIUJRJQ-ZDUSSCGKSA-N	-1	0	362.474	2.666	50	0		FFAARM
Cc1ccc(S(=O)(=O)N2C[C@H](C(=O)[O-])Oc3ccc(Cl)cc32)cc1	ZINC000226087916	132287878	/nfs/dbraw/zinc/28/78/78/132287878.db2.gz	RGMOHJSNWVEDIY-OAHLLOKOSA-N	-1	0	367.810	2.689	50	0		FFAARM
CN(C)c1ccc(NC(=O)[N-]S(=O)(=O)c2ccc(Cl)cc2)cc1	ZINC000000537807	506224515	/nfs/dbraw/zinc/22/45/15/506224515.db2.gz	SUQZXLUIKZXADU-UHFFFAOYSA-N	-1	0	353.831	2.916	50	0	in-man	FFAARM
COc1ccc(S(=O)(=O)[N-]c2ccccc2C(=O)N2CCCC2)cc1	ZINC000000784406	506232366	/nfs/dbraw/zinc/23/23/66/506232366.db2.gz	ZMTLEJWYMOQIIR-UHFFFAOYSA-N	-1	0	360.435	2.732	50	0		FFAARM
COc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000000889046	506238906	/nfs/dbraw/zinc/23/89/06/506238906.db2.gz	KGQLSYJNOJMIRM-UHFFFAOYSA-N	-1	0	355.799	2.921	50	0		FFAARM
Cc1nnc(-c2c(C)n(C)c(C)c2S(=O)(=O)[N-]c2ccc(F)cc2)o1	ZINC000065194069	506268109	/nfs/dbraw/zinc/26/81/09/506268109.db2.gz	DCJQDGXIINFKPV-UHFFFAOYSA-N	-1	0	364.402	2.940	50	0		FFAARM
CCc1nn2c(nc(C)c2S(=O)(=O)[N-]c2cc(F)cc(F)c2)s1	ZINC000065183782	506268374	/nfs/dbraw/zinc/26/83/74/506268374.db2.gz	ZYDIIRVHEUNBLP-UHFFFAOYSA-N	-1	0	358.395	2.741	50	0		FFAARM
O=C([O-])[C@H](COC(=O)OCc1ccccc1)NC(=O)OCc1ccccc1	ZINC000002145471	506271802	/nfs/dbraw/zinc/27/18/02/506271802.db2.gz	KUTZESLKEBHGMZ-INIZCTEOSA-N	-1	0	373.361	2.719	50	0		FFAARM
O=C([O-])c1ccccc1C(=O)N1CCN(C(=O)c2ccccc2Cl)CC1	ZINC000002456555	506280642	/nfs/dbraw/zinc/28/06/42/506280642.db2.gz	YUDHEDOQPKBUOY-UHFFFAOYSA-N	-1	0	372.808	2.636	50	0		FFAARM
Cc1nc2sc3c(c2c(=O)n1[N-]C(=O)c1ccn(C)n1)CCCCCC3	ZINC000002780285	506291122	/nfs/dbraw/zinc/29/11/22/506291122.db2.gz	QBLDGLIMTHHGIM-UHFFFAOYSA-N	-1	0	371.466	2.543	50	0		FFAARM
O=C([O-])c1cccnc1CN1CCC[C@H]1c1nc(-c2ccccn2)no1	ZINC000065408461	506294361	/nfs/dbraw/zinc/29/43/61/506294361.db2.gz	UDXOEKQGFBZIJO-HNNXBMFYSA-N	-1	0	351.366	2.562	50	0		FFAARM
O=C([O-])[C@H](Cc1ccccc1)NC(=O)Nc1ccc2oc(=O)ccc2c1	ZINC000004088847	506358917	/nfs/dbraw/zinc/35/89/17/506358917.db2.gz	RLDRQCCBPPMQCJ-HNNXBMFYSA-N	-1	0	352.346	2.610	50	0	biogenic	FFAARM
C[C@@H](C1CC1)N(C)S(=O)(=O)c1ccc(C(=O)[O-])cc1Br	ZINC000036785300	506417672	/nfs/dbraw/zinc/41/76/72/506417672.db2.gz	JYJLPKUKPGALMX-QMMMGPOBSA-N	-1	0	362.245	2.566	50	0		FFAARM
COc1ccc2c(c1)[C@]1(C)CCCc3c1n-2c(=O)c1c([O-])cc(=O)oc31	ZINC000005433410	506442369	/nfs/dbraw/zinc/44/23/69/506442369.db2.gz	STGAIJDJYXRWJV-FQEVSTJZSA-N	-1	0	351.358	2.614	50	0		FFAARM
COc1ccc(CCNS(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)cc1	ZINC000006848533	506512255	/nfs/dbraw/zinc/51/22/55/506512255.db2.gz	GBNWOVLVGLWCJB-UHFFFAOYSA-N	-1	0	369.826	2.568	50	0		FFAARM
COc1ccc([N-]S(=O)(=O)c2ccc(Br)c(C)c2)cn1	ZINC000007056594	506530896	/nfs/dbraw/zinc/53/08/96/506530896.db2.gz	UUIDXMXRTKAWNZ-UHFFFAOYSA-N	-1	0	357.229	2.962	50	0		FFAARM
CC(=O)N1CCc2ccc([N-]S(=O)(=O)c3cc(F)ccc3F)cc2C1	ZINC000008976861	506675601	/nfs/dbraw/zinc/67/56/01/506675601.db2.gz	VEAUXWUQWMZIRA-UHFFFAOYSA-N	-1	0	366.389	2.670	50	0		FFAARM
CC[C@@H](C)n1c(=O)[nH]c([O-])c([C@H]2c3[nH]c4ccccc4c3CCN2C)c1=O	ZINC000009011854	506677195	/nfs/dbraw/zinc/67/71/95/506677195.db2.gz	MYWOOYZAOLXOOB-DIFFPNOSSA-N	-1	0	368.437	2.684	50	0	biogenic	FFAARM
O=C([O-])c1cc2c(c(S(=O)(=O)Nc3cc(F)cc(F)c3)c1)CCC2	ZINC000055576848	506785091	/nfs/dbraw/zinc/78/50/91/506785091.db2.gz	JOEOATFBNAMZDT-UHFFFAOYSA-N	-1	0	353.346	2.953	50	0		FFAARM
CCNC(=O)c1cccc(NC(=O)CSc2ccccc2C(=O)[O-])c1	ZINC000012983530	506920957	/nfs/dbraw/zinc/92/09/57/506920957.db2.gz	ZSMNNMLIQONMBV-UHFFFAOYSA-N	-1	0	358.419	2.865	50	0		FFAARM
CCN(CC(=O)NCc1ccc(Cl)cc1)C(=O)c1ccc(C(=O)[O-])cc1	ZINC000012992851	506921651	/nfs/dbraw/zinc/92/16/51/506921651.db2.gz	HMQMFXWAJSBMFM-UHFFFAOYSA-N	-1	0	374.824	2.817	50	0		FFAARM
COc1ccc([C@H](CC(=O)[O-])NC(=O)CCc2ccccc2OC)cc1	ZINC000013188946	506932787	/nfs/dbraw/zinc/93/27/87/506932787.db2.gz	ZTXLRBBDKIGIBP-KRWDZBQOSA-N	-1	0	357.406	2.969	50	0		FFAARM
CS(=O)(=O)[N-]c1nc2ccc(NC(=O)NC3CCCC3)cc2s1	ZINC000013348774	506939863	/nfs/dbraw/zinc/93/98/63/506939863.db2.gz	QDTREMVDRONKAE-UHFFFAOYSA-N	-1	0	354.457	2.732	50	0		FFAARM
COc1ccc(S(=O)(=O)Nc2ccc(C(=O)[O-])cc2C)cc1OC	ZINC000014097358	506966509	/nfs/dbraw/zinc/96/65/09/506966509.db2.gz	QKAFIXPRFOHWMT-UHFFFAOYSA-N	-1	0	351.380	2.511	50	0		FFAARM
O=S(=O)(Cc1ccccc1)[N-]c1ncn(Cc2ccc(Cl)cc2)n1	ZINC000014250706	506983642	/nfs/dbraw/zinc/98/36/42/506983642.db2.gz	FAYBYXFJMQGZRN-UHFFFAOYSA-N	-1	0	362.842	2.922	50	0		FFAARM
CC[C@@H]1CCCCN1C(=O)CSC1=Nc2ccccc2S(=O)(=O)[N-]1	ZINC000015826908	507063332	/nfs/dbraw/zinc/06/33/32/507063332.db2.gz	BTKKQEVPVHXKQT-GFCCVEGCSA-N	-1	0	367.496	2.681	50	0		FFAARM
Cc1ccc(C(=O)COC(=O)c2ccc(NC(=O)C=CC(=O)[O-])cc2)cc1	ZINC000017075400	507115378	/nfs/dbraw/zinc/11/53/78/507115378.db2.gz	NYFMRJSEDQRLCR-ZHACJKMWSA-N	-1	0	367.357	2.614	50	0		FFAARM
COc1ccc(NC(C)=O)c([N-]S(=O)(=O)c2cc(F)ccc2F)c1	ZINC000057121920	507179013	/nfs/dbraw/zinc/17/90/13/507179013.db2.gz	KATZSIJDTQRUQT-UHFFFAOYSA-N	-1	0	356.350	2.733	50	0		FFAARM
O=C([O-])CCc1nnc2ccc(N3CCC(Cc4ccccc4)CC3)nn21	ZINC000020737431	507233076	/nfs/dbraw/zinc/23/30/76/507233076.db2.gz	URTLZZQIYIYAOP-UHFFFAOYSA-N	-1	0	365.437	2.601	50	0		FFAARM
CC(=O)c1ccccc1[N-]S(=O)(=O)c1ccc2c(c1)C(C)(C)C(=O)N2C	ZINC000021108977	507243143	/nfs/dbraw/zinc/24/31/43/507243143.db2.gz	CKBAEYBRLQIQPJ-UHFFFAOYSA-N	-1	0	372.446	2.944	50	0		FFAARM
COc1ccc(Cl)cc1C(=O)NCCc1ccc(S(=O)(=O)[O-])cc1	ZINC000022054654	507277361	/nfs/dbraw/zinc/27/73/61/507277361.db2.gz	PTQOLPXVAGTTDK-UHFFFAOYSA-N	-1	0	369.826	2.568	50	0	in-vitro	FFAARM
O=C([N-]N1C(=O)NC2(CCCCC2)C1=O)c1csc(-c2ccccc2)n1	ZINC000023805129	507376808	/nfs/dbraw/zinc/37/68/08/507376808.db2.gz	RGBFWCRHOSGPHB-UHFFFAOYSA-N	-1	0	370.434	2.710	50	0		FFAARM
CN(c1ccccc1)S(=O)(=O)c1ccc(OCCCC(=O)[O-])c(F)c1	ZINC000058283036	507400575	/nfs/dbraw/zinc/40/05/75/507400575.db2.gz	YDHCLKZUHDRRSE-UHFFFAOYSA-N	-1	0	367.398	2.894	50	0		FFAARM
O=C([N-]O[C@@H]1CCCCO1)c1nn(-c2ccccc2)c(=O)c2ccccc21	ZINC000058418937	507417107	/nfs/dbraw/zinc/41/71/07/507417107.db2.gz	ZSPAVPJNVWRCMX-QGZVFWFLSA-N	-1	0	365.389	2.574	50	0		FFAARM
COc1cc(C)ccc1OCC(=O)[N-]S(=O)(=O)c1ccccc1Cl	ZINC000069600698	507522581	/nfs/dbraw/zinc/52/25/81/507522581.db2.gz	AITKPAFQEGXMIA-UHFFFAOYSA-N	-1	0	369.826	2.541	50	0		FFAARM
C[C@@]1(C(=O)[O-])CCN(C(=O)CCOc2cccc(Br)c2)C1	ZINC000062913228	507688251	/nfs/dbraw/zinc/68/82/51/507688251.db2.gz	GTAGGALGBOIOQT-OAHLLOKOSA-N	-1	0	356.216	2.541	50	0		FFAARM
CC1(C)[C@@H](C(=O)[O-])[C@@H]1C(=O)Nc1cccc(C(=O)Nc2ccccn2)c1	ZINC000071285787	507700928	/nfs/dbraw/zinc/70/09/28/507700928.db2.gz	ZGQUQGRADZIJNE-HUUCEWRRSA-N	-1	0	353.378	2.629	50	0		FFAARM
O=C([O-])c1cc(-n2ncc3ccccc32)cc(S(=O)(=O)N2CCCC2)c1	ZINC000071746612	507710210	/nfs/dbraw/zinc/71/02/10/507710210.db2.gz	WQNOGQTWWKAZFI-UHFFFAOYSA-N	-1	0	371.418	2.508	50	0		FFAARM
Cc1ccc(NS(=O)(=O)c2ccc(OCC(=O)[O-])c(C)c2)c(F)c1	ZINC000063476338	507734870	/nfs/dbraw/zinc/73/48/70/507734870.db2.gz	AWVRGOHRWCKOJH-UHFFFAOYSA-N	-1	0	353.371	2.707	50	0		FFAARM
Cc1nc(C(=O)N2CCC(C(=O)[O-])(n3ccc(C(C)(C)C)n3)CC2)c(C)o1	ZINC000072438191	507792416	/nfs/dbraw/zinc/79/24/16/507792416.db2.gz	LETFUIJKVOFORD-UHFFFAOYSA-N	-1	0	374.441	2.502	50	0		FFAARM
O=C([O-])C1(n2cnc3ccccc32)CCN(C(=O)c2ccsc2)CC1	ZINC000072479564	507797413	/nfs/dbraw/zinc/79/74/13/507797413.db2.gz	LDZZOFCKGHHXQP-UHFFFAOYSA-N	-1	0	355.419	2.814	50	0		FFAARM
O=C([O-])c1csc(S(=O)(=O)N2CCCc3cc(F)c(F)cc32)c1	ZINC000031669710	507821033	/nfs/dbraw/zinc/82/10/33/507821033.db2.gz	GAHMZUZODGXGKA-UHFFFAOYSA-N	-1	0	359.375	2.866	50	0		FFAARM
O=C([O-])CN1C(=O)/C(=C/c2ccc(Br)s2)SC1=S	ZINC000096663509	508215322	/nfs/dbraw/zinc/21/53/22/508215322.db2.gz	XQVZRDORJGVRDZ-UTCJRWHESA-N	-1	0	364.267	2.796	50	0		FFAARM
CC(N[C@@H](C)c1ccccc1)=C1C(=O)[N-]C(=O)N(Cc2ccccc2)C1=O	ZINC000101038006	508240854	/nfs/dbraw/zinc/24/08/54/508240854.db2.gz	CAUIGXDAFLGOLN-JZYMCLRRSA-N	-1	0	363.417	2.890	50	0		FFAARM
Cc1cc(S(=O)(=O)[N-]c2ccc(N3CCCC3=O)cn2)c(F)cc1F	ZINC000153495764	508589838	/nfs/dbraw/zinc/58/98/38/508589838.db2.gz	OTEFSNHFDVAZSX-UHFFFAOYSA-N	-1	0	367.377	2.596	50	0		FFAARM
C[C@H](Oc1ccccc1Br)C(=O)N1CCC[C@H](C(=O)[O-])C1	ZINC000136165302	508675119	/nfs/dbraw/zinc/67/51/19/508675119.db2.gz	OWPOGKFKAKTOGA-QWRGUYRKSA-N	-1	0	356.216	2.540	50	0		FFAARM
O=C(NCCc1csc(-c2ncccn2)n1)c1ccc([O-])c(Cl)c1	ZINC000219103132	509285690	/nfs/dbraw/zinc/28/56/90/509285690.db2.gz	LAQUJGFXQLDEPK-UHFFFAOYSA-N	-1	0	360.826	2.932	50	0		FFAARM
Cc1cccc(S(=O)(=O)[N-]c2nnc(C3CC3)o2)c1Br	ZINC000170615581	509681685	/nfs/dbraw/zinc/68/16/85/509681685.db2.gz	IXBKBUBBWRNVCT-UHFFFAOYSA-N	-1	0	358.217	2.819	50	0		FFAARM
COc1ccc(S(=O)(=O)Nc2cccc(-n3cccc3)c2)cc1C(=O)[O-]	ZINC000170624753	509683058	/nfs/dbraw/zinc/68/30/58/509683058.db2.gz	JNXHKFLHMUKHEZ-UHFFFAOYSA-N	-1	0	372.402	2.985	50	0		FFAARM
CC(C)[C@@H]1CC[C@H](C)CCN1C(=O)Cc1csc([N-]S(C)(=O)=O)n1	ZINC000170629882	509686343	/nfs/dbraw/zinc/68/63/43/509686343.db2.gz	SDNVLKRQEPLOKI-JSGCOSHPSA-N	-1	0	373.544	2.730	50	0		FFAARM
CC[C@H](Oc1ccccc1F)C(=O)[N-]S(=O)(=O)c1sc(C)nc1C	ZINC000170652334	509700678	/nfs/dbraw/zinc/70/06/78/509700678.db2.gz	NVZRMSBOJFPCOG-LBPRGKRZSA-N	-1	0	372.443	2.562	50	0		FFAARM
Cc1nc(C)n(-c2ccc(C(=O)N3CCCC[C@H]3CCC(=O)[O-])cc2)n1	ZINC000237696598	509713154	/nfs/dbraw/zinc/71/31/54/509713154.db2.gz	JPPIOWPCDLDHMK-INIZCTEOSA-N	-1	0	356.426	2.744	50	0		FFAARM
Cc1nc2cc(F)ccc2cc1C(=O)N(CCC(=O)[O-])C1CCOCC1	ZINC000237744924	509725622	/nfs/dbraw/zinc/72/56/22/509725622.db2.gz	UXBZHSZAHHBHFU-UHFFFAOYSA-N	-1	0	360.385	2.778	50	0		FFAARM
Cc1ccc2[nH]c(SCC(=O)N[C@H]3C[C@H](c4cc(=O)[nH]cn4)C3)nc2c1	ZINC000253535506	509886377	/nfs/dbraw/zinc/88/63/77/509886377.db2.gz	XTTITTZCTSICCL-HAQNSBGRSA-N	-1	0	369.450	2.521	50	0		FFAARM
CCc1oc(C(=O)NC2(c3noc(C4CC4)n3)CCCC2)cc1C(=O)[O-]	ZINC000261597498	509992719	/nfs/dbraw/zinc/99/27/19/509992719.db2.gz	AFIVQLWXFDZSAZ-UHFFFAOYSA-N	-1	0	359.382	3.000	50	0		FFAARM
CC[C@@](NC(=O)c1ccc2c(c1)CCC(=O)N2C)(C(=O)[O-])c1ccccc1	ZINC000263253274	510632904	/nfs/dbraw/zinc/63/29/04/510632904.db2.gz	KDOSIJFVXMQLRK-NRFANRHFSA-N	-1	0	366.417	2.716	50	0		FFAARM
CN(Cc1ccoc1)Cc1cc(-c2cnccn2)ccc1OCC(=O)[O-]	ZINC000299770767	511674407	/nfs/dbraw/zinc/67/44/07/511674407.db2.gz	RAZQYRLSCLTGQH-UHFFFAOYSA-N	-1	0	353.378	2.832	50	0		FFAARM
O=C([O-])c1ccc([C@@H]2CCCN(C(=O)C3(Cn4ccnc4)CC3)C2)cc1	ZINC000299772248	511674660	/nfs/dbraw/zinc/67/46/60/511674660.db2.gz	UGAAUUTUNBXIFP-QGZVFWFLSA-N	-1	0	353.422	2.768	50	0		FFAARM
CC(C)c1nc(/C=C\c2ccc(S(C)(=O)=O)s2)ncc1C(=O)[O-]	ZINC000414061063	513958881	/nfs/dbraw/zinc/95/88/81/513958881.db2.gz	BMNQITXDTZJWMD-XQRVVYSFSA-N	-1	0	352.437	2.934	50	0		FFAARM
Cc1cc(Cl)ccc1O[C@@H](C)C(=O)N(CC(=O)[O-])C1CCOCC1	ZINC000486002993	515293701	/nfs/dbraw/zinc/29/37/01/515293701.db2.gz	HOAAYQCVOXMLCG-LBPRGKRZSA-N	-1	0	355.818	2.508	50	0		FFAARM
CC[C@H](C(=O)N1CCC(NC(=O)C2(C(=O)[O-])CCC2)CC1)c1ccccc1	ZINC000573614134	518751939	/nfs/dbraw/zinc/75/19/39/518751939.db2.gz	VQFAFOUJMDYUCA-KRWDZBQOSA-N	-1	0	372.465	2.542	50	0		FFAARM
CCn1ncc(Cl)c1C(=O)Nc1ccc(O[C@H](C)C(=O)[O-])c(F)c1	ZINC000630260320	522745339	/nfs/dbraw/zinc/74/53/39/522745339.db2.gz	JVAYZXNFWBIXAO-MRVPVSSYSA-N	-1	0	355.753	2.800	50	0		FFAARM
Cc1nn(CCC(=O)[O-])c(C)c1NC(=O)[C@@H]1C[C@@H]1c1ccc(F)c(F)c1	ZINC000630331941	522795357	/nfs/dbraw/zinc/79/53/57/522795357.db2.gz	RMZPZWJNSVLQNB-CHWSQXEVSA-N	-1	0	363.364	2.995	50	0		FFAARM
C[C@@H]1CCc2c(sc(NC(=O)[C@H]3CCCC[C@H]3C(=O)[O-])c2C(N)=O)C1	ZINC000239402966	524724697	/nfs/dbraw/zinc/72/46/97/524724697.db2.gz	RIVQMHSILJEIBU-OUAUKWLOSA-N	-1	0	364.467	2.801	50	0		FFAARM
COc1ccc([C@H](CC(=O)[O-])NC(=O)[C@@H]2COc3ccccc32)cc1OC	ZINC000268941094	525346370	/nfs/dbraw/zinc/34/63/70/525346370.db2.gz	LQAZKYSMDPYLAM-CABCVRRESA-N	-1	0	371.389	2.512	50	0		FFAARM
O=C([O-])c1ccc(N2CCC(c3nccn3Cc3cccnc3)CC2)nc1	ZINC000091410333	526373443	/nfs/dbraw/zinc/37/34/43/526373443.db2.gz	ZFHTXVXAJDACCU-UHFFFAOYSA-N	-1	0	363.421	2.804	50	0		FFAARM
Cc1oc(CN(C)C(=O)[C@H]2C[C@@H]2c2ccc3c(c2)OCCO3)cc1C(=O)[O-]	ZINC000268944384	526769887	/nfs/dbraw/zinc/76/98/87/526769887.db2.gz	VHWZGMNFQCZURJ-CVEARBPZSA-N	-1	0	371.389	2.820	50	0		FFAARM
O=C([O-])CC[C@]1(CCC(=O)N2CCC(c3ccccc3)CC2)CCC(=O)N1	ZINC000218457519	527600613	/nfs/dbraw/zinc/60/06/13/527600613.db2.gz	QQNDSDYEZAZFEV-OAQYLSRUSA-N	-1	0	372.465	2.686	50	0		FFAARM
O=C([O-])C[C@H]1CN(C(=O)/C=C/c2cccc(OC3CCCC3)c2)CCO1	ZINC000268942490	527636383	/nfs/dbraw/zinc/63/63/83/527636383.db2.gz	FNINPSQRHZXSBJ-BLGFXRMMSA-N	-1	0	359.422	2.723	50	0		FFAARM
CCc1ccc([C@@H](COC)NC(=O)CC2(C(=O)[O-])Cc3ccccc3C2)o1	ZINC000236964548	571098727	/nfs/dbraw/zinc/09/87/27/571098727.db2.gz	WALIODYBHZKKMP-QGZVFWFLSA-N	-1	0	371.433	2.906	50	0		FFAARM
COc1ccc(S(=O)(=O)[N-]C(=O)c2csc(C3CC3)n2)c(C)c1C	ZINC000117539534	571161192	/nfs/dbraw/zinc/16/11/92/571161192.db2.gz	JXZGXCMUIWRFLR-UHFFFAOYSA-N	-1	0	366.464	2.765	50	0		FFAARM
COc1ccc(NC(=O)N2CCO[C@@H](C(=O)[O-])C2)cc1Cc1ccccc1	ZINC000669495120	600006206	/nfs/dbraw/zinc/00/62/06/600006206.db2.gz	KMXCGIYXYYXSKK-GOSISDBHSA-N	-1	0	370.405	2.603	50	0		FFAARM
O=C([O-])c1ccccc1C(=O)c1ccc(Cl)c(N2C(=O)CCC2=O)c1	ZINC000001209039	727774302	/nfs/dbraw/zinc/77/43/02/727774302.db2.gz	XJTGLAKVPZRJNK-UHFFFAOYSA-N	-1	0	357.749	2.923	50	0		FFAARM
COc1cc(C2NC(=O)N=C2c2c([O-])c3ccccc3oc2=O)ccc1O	ZINC000888090138	975992309	/nfs/dbraw/zinc/99/23/09/975992309.db2.gz	DYTRPXULNXJBJJ-UHFFFAOYSA-N	-1	0	366.329	2.976	50	0		FFAARM
Cc1ccc(F)cc1C(=O)NCC1CCN(c2ncccc2C(=O)[O-])CC1	ZINC000952985478	1011040394	/nfs/dbraw/zinc/04/03/94/1011040394.db2.gz	BPYLLIREOFHJGL-UHFFFAOYSA-N	-1	0	371.412	2.874	50	0		FFAARM
CC(C)Oc1ccc([C@@H]2CC(=O)N(c3ccc(O)c(C(=O)[O-])c3)C2=O)cc1	ZINC000019450545	1022518417	/nfs/dbraw/zinc/51/84/17/1022518417.db2.gz	USSUOTMWDBLJDL-HNNXBMFYSA-N	-1	0	369.373	2.925	50	0		FFAARM
Cc1c(C(=O)N[C@@H]2C[C@H](C(=O)[O-])c3ccccc32)cnn1C1CCOCC1	ZINC000653327134	1024901209	/nfs/dbraw/zinc/90/12/09/1024901209.db2.gz	RBCQQMZHALPHJU-FUHWJXTLSA-N	-1	0	369.421	2.586	50	0		FFAARM
COc1nccc(NC(=O)N2CCC(c3ccccc3C(=O)[O-])CC2)n1	ZINC000669504042	1027965271	/nfs/dbraw/zinc/96/52/71/1027965271.db2.gz	REOSUEZFHUSWHR-UHFFFAOYSA-N	-1	0	356.382	2.595	50	0		FFAARM
Cc1cccc(-c2cccc(C(=O)N[C@H](C)c3n[nH]c(CC(=O)[O-])n3)c2)c1	ZINC001506408812	1059501340	/nfs/dbraw/zinc/50/13/40/1059501340.db2.gz	QHIQTROUWSWUTP-CYBMUJFWSA-N	-1	0	364.405	2.898	50	0		FFAARM
Cc1ccc(NC2(C(=O)N3CCN(CCC(=O)[O-])CC3)CCCCC2)cc1	ZINC001506429534	1059516186	/nfs/dbraw/zinc/51/61/86/1059516186.db2.gz	UDNKNPXPAFDSFB-UHFFFAOYSA-N	-1	0	373.497	2.729	50	0		FFAARM
CC[C@@H](C(=O)[O-])N(c1ccc(Cl)c(C(F)(F)F)c1)S(C)(=O)=O	ZINC000242498521	209896367	/nfs/dbraw/zinc/89/63/67/209896367.db2.gz	HKFWELCOJPNKEW-JTQLQIEISA-N	-1	0	359.753	2.988	50	0		FFAARM
O=C([O-])CSc1nnc([C@@H]2COc3ccccc3O2)n1-c1ccccc1	ZINC000000711294	219315889	/nfs/dbraw/zinc/31/58/89/219315889.db2.gz	BWVXIKFLTDGBIN-HNNXBMFYSA-N	-1	0	369.402	2.957	50	0		FFAARM
Cc1nn(-c2ccc(F)cc2)c(C)c1CC(=O)N1CCCC[C@H]1C(=O)[O-]	ZINC000136472817	209374287	/nfs/dbraw/zinc/37/42/87/209374287.db2.gz	FDARZMDJLKDOMU-KRWDZBQOSA-N	-1	0	359.401	2.636	50	0		FFAARM
O=C([O-])[C@H]1CCCN1Cc1nc(-c2cc(Br)cs2)no1	ZINC000238102398	209361004	/nfs/dbraw/zinc/36/10/04/209361004.db2.gz	XSAFYGBTUSIGGN-MRVPVSSYSA-N	-1	0	358.217	2.610	50	0		FFAARM
O=C([O-])CN(C(=O)[C@H]1C[C@H]1c1c(F)cccc1Cl)C1CCOCC1	ZINC000238105347	209359387	/nfs/dbraw/zinc/35/93/87/209359387.db2.gz	LPGSFIMUFIMLKY-NEPJUHHUSA-N	-1	0	355.793	2.675	50	0		FFAARM
Cc1nc(C)c(S(=O)(=O)[N-]C(=O)[C@H](C)OC2CCCCCC2)s1	ZINC000121743255	209355924	/nfs/dbraw/zinc/35/59/24/209355924.db2.gz	WACZVCHKSAOMFN-NSHDSACASA-N	-1	0	360.501	2.693	50	0		FFAARM
Cc1nc(COc2ccccc2/C=C/C(=O)N2CC[C@H](C(=O)[O-])C2)cs1	ZINC000237738363	209353422	/nfs/dbraw/zinc/35/34/22/209353422.db2.gz	RTKZJQAFJPXUFJ-LFAOLKIESA-N	-1	0	372.446	2.977	50	0		FFAARM
C[C@]1(C(=O)[O-])CCN(C(=O)C2(c3cccc(Br)c3)CC2)C1	ZINC000237639193	209351907	/nfs/dbraw/zinc/35/19/07/209351907.db2.gz	WLBAENZXMBPKIL-HNNXBMFYSA-N	-1	0	352.228	2.804	50	0		FFAARM
O=C([O-])c1ccc(S(=O)(=O)Nc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000048382875	209332012	/nfs/dbraw/zinc/33/20/12/209332012.db2.gz	QEFIFEDQVWOSBE-UHFFFAOYSA-N	-1	0	364.398	2.925	50	0		FFAARM
COc1cccc(-n2[nH][n-]c3c(=O)n(-c4ccc5c(c4)CCC5)c(=O)c2=3)c1	ZINC000102818829	209242804	/nfs/dbraw/zinc/24/28/04/209242804.db2.gz	LZCXMLMRZMLRSJ-ROUUACIJSA-N	-1	0	362.389	2.682	50	0		FFAARM
CCOc1ccc(NC(=O)C(=O)c2c(C)[n-]n(-c3ccccc3)c2=O)cc1	ZINC000100721676	209215878	/nfs/dbraw/zinc/21/58/78/209215878.db2.gz	RCHNHGUXMZHGIG-QGZVFWFLSA-N	-1	0	365.389	2.632	50	0		FFAARM
O=C(NCc1ccc(F)cc1)c1c([O-])c2cccc3c2n(c1=O)CCC3	ZINC000100331714	209211226	/nfs/dbraw/zinc/21/12/26/209211226.db2.gz	FAJYOWADSFVCJF-UHFFFAOYSA-N	-1	0	352.365	2.722	50	0		FFAARM
O=c1c2[n-][nH]n(-c3cccc(F)c3)c=2c(=O)n1-c1ccc2c(c1)CCC2	ZINC000096500400	209152879	/nfs/dbraw/zinc/15/28/79/209152879.db2.gz	KWFFTOLQYSTKOC-DLBZAZTESA-N	-1	0	350.353	2.812	50	0		FFAARM
CS(=O)(=O)[N-]c1nc2ccc(C(=O)N3CCc4ccccc43)cc2s1	ZINC000013682845	220085433	/nfs/dbraw/zinc/08/54/33/220085433.db2.gz	FFMKCZXLNYYPLF-UHFFFAOYSA-N	-1	0	373.459	2.871	50	0		FFAARM
O=C([O-])C1CCN(C(=O)c2csc(-c3ccc4c(c3)CCO4)n2)CC1	ZINC000004332849	207014548	/nfs/dbraw/zinc/01/45/48/207014548.db2.gz	LGVNGMWVNWKZMC-UHFFFAOYSA-N	-1	0	358.419	2.682	50	0		FFAARM
CCOc1ccc(NC(=O)[C@@H](Cc2cccc(OC)c2)c2nnn[n-]2)cc1	ZINC000005444530	207100939	/nfs/dbraw/zinc/10/09/39/207100939.db2.gz	VSCXAMVUCTZLEB-KRWDZBQOSA-N	-1	0	367.409	2.572	50	0		FFAARM
CCc1ccccc1NC(=O)[C@H](Cc1cccc(OC)c1)c1nnn[n-]1	ZINC000005445040	207101161	/nfs/dbraw/zinc/10/11/61/207101161.db2.gz	XYRHJEZNDGYKCK-MRXNPFEDSA-N	-1	0	351.410	2.736	50	0		FFAARM
CCOC(=O)Cc1csc(SCc2nc(=O)c3sccc3[n-]2)n1	ZINC000006612776	207148928	/nfs/dbraw/zinc/14/89/28/207148928.db2.gz	ZBSDBJZCKLFTBC-UHFFFAOYSA-N	-1	0	367.477	2.839	50	0		FFAARM
CCC(=O)c1ccc(OCC(=O)N2Cc3ccccc3C[C@H]2C(=O)[O-])cc1	ZINC000007786622	207207862	/nfs/dbraw/zinc/20/78/62/207207862.db2.gz	XNWXBBCIZWPVFY-SFHVURJKSA-N	-1	0	367.401	2.696	50	0		FFAARM
CCCNC(=O)c1ccccc1[N-]S(=O)(=O)c1cc(F)ccc1F	ZINC000008109156	207219720	/nfs/dbraw/zinc/21/97/20/207219720.db2.gz	HTLJUCUCZSAIAK-UHFFFAOYSA-N	-1	0	354.378	2.905	50	0		FFAARM
O=C([O-])c1ccc2c(=O)n(-c3ccc(Cl)c(Cl)c3)c(=O)[nH]c2c1	ZINC000009172354	207259743	/nfs/dbraw/zinc/25/97/43/207259743.db2.gz	NQBQEMKLPBAXOK-UHFFFAOYSA-N	-1	0	351.145	2.684	50	0		FFAARM
Cc1ccc(O[C@H](C)C(=O)N(C)Cc2nc(=O)c3sccc3[n-]2)cc1	ZINC000010721126	207304953	/nfs/dbraw/zinc/30/49/53/207304953.db2.gz	LSXNDWIPNPVSBR-GFCCVEGCSA-N	-1	0	357.435	2.719	50	0		FFAARM
Cc1c(Cl)ccc(S(=O)(=O)N2CCC(C(=O)[O-])CC2)c1Cl	ZINC000011566085	207315537	/nfs/dbraw/zinc/31/55/37/207315537.db2.gz	KSVTXDDOXACWIG-UHFFFAOYSA-N	-1	0	352.239	2.787	50	0		FFAARM
CN1c2ccc(S(=O)(=O)[N-]c3ccccc3O)c3cccc(c23)C1=O	ZINC000011851925	207326022	/nfs/dbraw/zinc/32/60/22/207326022.db2.gz	VAUHLDJXILETDL-UHFFFAOYSA-N	-1	0	354.387	2.936	50	0		FFAARM
COc1ccccc1[N-]S(=O)(=O)c1ccc(/C=C/C(=O)N2CCC2)cc1	ZINC000012552304	207391833	/nfs/dbraw/zinc/39/18/33/207391833.db2.gz	DZHVITOTNZMXLX-FMIVXFBMSA-N	-1	0	372.446	2.742	50	0		FFAARM
COc1cc(OC)cc([C@H](Nc2ncccc2C(=O)[O-])c2nccn2C)c1	ZINC000012627347	207405384	/nfs/dbraw/zinc/40/53/84/207405384.db2.gz	DZGWOCGDOSIWCX-INIZCTEOSA-N	-1	0	368.393	2.732	50	0		FFAARM
Cc1ccc2c(CC(=O)N[C@@H](Cc3ccc(O)cc3)C(=O)[O-])coc2c1	ZINC000012993199	207445121	/nfs/dbraw/zinc/44/51/21/207445121.db2.gz	KQTIVCFEJOVWMB-KRWDZBQOSA-N	-1	0	353.374	2.801	50	0		FFAARM
COc1ccc([C@@H](CC(=O)[O-])NC(=O)[C@H]2COc3ccccc3C2)cc1	ZINC000013427430	207459570	/nfs/dbraw/zinc/45/95/70/207459570.db2.gz	VPVQFLCASGYOGY-NVXWUHKLSA-N	-1	0	355.390	2.579	50	0		FFAARM
O=C([O-])c1ccc(OCC(=O)N(Cc2ccco2)CC(F)(F)F)cc1	ZINC000013413483	207459696	/nfs/dbraw/zinc/45/96/96/207459696.db2.gz	ZSLGCUHJXDYMRQ-UHFFFAOYSA-N	-1	0	357.284	2.948	50	0		FFAARM
O=C([O-])[C@@H]1CC=CC[C@@H]1C(=O)Nc1sccc1C(=O)NCc1ccco1	ZINC000017076580	207611176	/nfs/dbraw/zinc/61/11/76/207611176.db2.gz	RHNLMMNMLNXGEK-QWHCGFSZSA-N	-1	0	374.418	2.877	50	0		FFAARM
Cc1cccc(NC(=O)CSc2nn(-c3ccccc3)c(=O)[n-]2)c1C	ZINC000032871471	208051104	/nfs/dbraw/zinc/05/11/04/208051104.db2.gz	LBGHEDLZXVUAOD-UHFFFAOYSA-N	-1	0	354.435	2.908	50	0		FFAARM
O=C([O-])CCC(=O)Nc1ccc2c(c1)[nH]cc2[C@@H](C(=O)[O-])[NH+]1CCCCC1	ZINC000031818632	208017790	/nfs/dbraw/zinc/01/77/90/208017790.db2.gz	VYZVOYPXDMMIST-SFHVURJKSA-N	-1	0	373.409	2.583	50	0		FFAARM
COc1cccc(-c2nc(CC(=O)N3CCC[C@H](C(=O)[O-])C3)cs2)c1	ZINC000032092542	208022977	/nfs/dbraw/zinc/02/29/77/208022977.db2.gz	VBFTWHICXCNMMP-ZDUSSCGKSA-N	-1	0	360.435	2.684	50	0		FFAARM
COc1ccc([C@@H]2CCCN2C(=O)c2ccc(C(=O)[O-])nc2)cc1OC	ZINC000298164964	208088620	/nfs/dbraw/zinc/08/86/20/208088620.db2.gz	YEKDNADVLJYQPA-HNNXBMFYSA-N	-1	0	356.378	2.774	50	0		FFAARM
CC(=O)Oc1ccc2ccccc2c1/C=C(/C(=O)[O-])N(C(C)=O)C(C)=O	ZINC000035681312	208135361	/nfs/dbraw/zinc/13/53/61/208135361.db2.gz	SRVWYACDSRNVOJ-YVLHZVERSA-N	-1	0	355.346	2.586	50	0		FFAARM
COc1cccc(-c2nnc(CCC(=O)NC3CCCCC3)c(=O)[n-]2)c1	ZINC000034764579	208108391	/nfs/dbraw/zinc/10/83/91/208108391.db2.gz	IFVUQUMKUXBRAE-UHFFFAOYSA-N	-1	0	356.426	2.634	50	0		FFAARM
O=C([O-])CCCS(=O)(=O)c1nc(-c2ccccc2)cc(C(F)(F)F)n1	ZINC000034928894	208116059	/nfs/dbraw/zinc/11/60/59/208116059.db2.gz	ABLRUDJEJGFGLN-UHFFFAOYSA-N	-1	0	374.340	2.801	50	0		FFAARM
CO[N-]C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccccc1Cl	ZINC000037127652	208176072	/nfs/dbraw/zinc/17/60/72/208176072.db2.gz	OUXVCEVOAUPPGL-KRWDZBQOSA-N	-1	0	371.824	2.840	50	0		FFAARM
Cc1nn(C)c(Cl)c1/C=C/C(=O)N1[C@@H]2CCCC[C@H]2C[C@H]1C(=O)[O-]	ZINC000299327517	208285602	/nfs/dbraw/zinc/28/56/02/208285602.db2.gz	AYEUTBUGBGOVDZ-LZFDNUDYSA-N	-1	0	351.834	2.639	50	0		FFAARM
COc1ccc(C2(C(=O)N3CC[C@@H](C(=O)[O-])C3)CCCCC2)cc1OC	ZINC000299741400	208338419	/nfs/dbraw/zinc/33/84/19/208338419.db2.gz	FQXJZCPDMZXGFE-CQSZACIVSA-N	-1	0	361.438	2.839	50	0		FFAARM
O=C([O-])[C@@H]1Cc2ccccc2CN1C(=O)Cc1coc(-c2cccs2)n1	ZINC000299746870	208339876	/nfs/dbraw/zinc/33/98/76/208339876.db2.gz	BMJUBHGPXPWESR-HNNXBMFYSA-N	-1	0	368.414	2.984	50	0		FFAARM
CN(Cc1ccc(C(=O)[O-])cc1)C(=O)[C@@H]1CC(=O)N(C)[C@@H]1c1cccs1	ZINC000299749480	208354449	/nfs/dbraw/zinc/35/44/49/208354449.db2.gz	KMOPJIKNQUWDKJ-PBHICJAKSA-N	-1	0	372.446	2.624	50	0		FFAARM
O=C([O-])[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1cc(N2CCCC2=O)ccc1F	ZINC000299748984	208355039	/nfs/dbraw/zinc/35/50/39/208355039.db2.gz	ITGQBULXBUWDHJ-VUCTXSBTSA-N	-1	0	374.412	2.810	50	0		FFAARM
O=C([O-])[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1cc(N2CCCC2=O)ccc1F	ZINC000299748982	208355478	/nfs/dbraw/zinc/35/54/78/208355478.db2.gz	ITGQBULXBUWDHJ-DQYPLSBCSA-N	-1	0	374.412	2.810	50	0		FFAARM
COc1ccc2c(c1)CCC[C@@H]2CC(=O)N(CC(=O)[O-])C1CCOCC1	ZINC000299748366	208355839	/nfs/dbraw/zinc/35/58/39/208355839.db2.gz	HDAJVXPBJYRRDZ-OAHLLOKOSA-N	-1	0	361.438	2.597	50	0		FFAARM
O=S(=O)([N-]c1ccccc1-n1cnnn1)c1cc(Cl)cc(Cl)c1	ZINC000047328508	208377167	/nfs/dbraw/zinc/37/71/67/208377167.db2.gz	VASJDZGNVAPAFF-UHFFFAOYSA-N	-1	0	370.221	2.770	50	0		FFAARM
COc1ccccc1-n1c(SCC(=O)[O-])nnc1-c1oc(C)nc1C	ZINC000067434702	208703703	/nfs/dbraw/zinc/70/37/03/208703703.db2.gz	VDSPZJGASHVBQZ-UHFFFAOYSA-N	-1	0	360.395	2.724	50	0		FFAARM
CC1(C)[C@H](C(=O)Nc2ccc(C(=O)NCc3ccco3)cc2)[C@@H]1C(=O)[O-]	ZINC000071288217	208761569	/nfs/dbraw/zinc/76/15/69/208761569.db2.gz	LPHKYQKNKXIOBP-LSDHHAIUSA-N	-1	0	356.378	2.505	50	0		FFAARM
COc1ccc(OC)c(CC(=O)N2CC[C@@H](c3ccccc3C(=O)[O-])C2)c1	ZINC000072169395	208821310	/nfs/dbraw/zinc/82/13/10/208821310.db2.gz	CMGRYQAYHBPYRP-CQSZACIVSA-N	-1	0	369.417	2.961	50	0		FFAARM
CN(Cc1cc(C2CC2)on1)c1nccc(-c2cc(C(=O)[O-])ccn2)n1	ZINC000077287795	208895287	/nfs/dbraw/zinc/89/52/87/208895287.db2.gz	ZGSOLKJTRCAVKW-UHFFFAOYSA-N	-1	0	351.366	2.739	50	0		FFAARM
O=C([O-])CS[C@H]1c2ccccc2C(=O)N1Cc1ccc2c(c1)OCO2	ZINC000085430412	208963801	/nfs/dbraw/zinc/96/38/01/208963801.db2.gz	SUOQMXIEYAHTTE-SFHVURJKSA-N	-1	0	357.387	2.888	50	0		FFAARM
CN(CCCC(=O)[O-])C(=O)c1ccc(CNC(=O)c2cccs2)cc1	ZINC000095969620	209090970	/nfs/dbraw/zinc/09/09/70/209090970.db2.gz	JMYCELSCALSCTO-UHFFFAOYSA-N	-1	0	360.435	2.615	50	0		FFAARM
O=C([O-])[C@@H](CO)n1cnc(-c2ccccc2)c1-c1ccc2c(c1)OCCO2	ZINC000092066397	209016454	/nfs/dbraw/zinc/01/64/54/209016454.db2.gz	SNFIXGUDPMUQIL-OAHLLOKOSA-N	-1	0	366.373	2.606	50	0		FFAARM
COc1cc(-c2cn([C@@H](Cc3ccc(O)cc3)C(=O)[O-])nn2)ccc1F	ZINC000095359410	209027941	/nfs/dbraw/zinc/02/79/41/209027941.db2.gz	BAMBFIQQOZDHQJ-INIZCTEOSA-N	-1	0	357.341	2.667	50	0		FFAARM
COc1ccccc1COc1cccc([C@H](C(=O)[O-])N2CCOCC2)c1	ZINC000095362586	209029541	/nfs/dbraw/zinc/02/95/41/209029541.db2.gz	LNQRFWIGMZLANE-LJQANCHMSA-N	-1	0	357.406	2.732	50	0		FFAARM
CCOc1cc(F)cc([C@@H](C(=O)[O-])N2CCN(Cc3ccccn3)CC2)c1	ZINC000095386920	209044333	/nfs/dbraw/zinc/04/43/33/209044333.db2.gz	MPKMOVUJYAMYGV-IBGZPJMESA-N	-1	0	373.428	2.563	50	0		FFAARM
CSc1cccc([C@H](C(=O)[O-])N2CCN(Cc3cccnc3)CC2)c1	ZINC000095386396	209044713	/nfs/dbraw/zinc/04/47/13/209044713.db2.gz	ALLIEZXCALBQQT-GOSISDBHSA-N	-1	0	357.479	2.747	50	0		FFAARM
CN1C(=O)C[C@H](C(=O)[O-])C12CCN(Cc1ccc(Cl)c(Cl)c1)CC2	ZINC000095387930	209046014	/nfs/dbraw/zinc/04/60/14/209046014.db2.gz	JRNUCXHJAKAASM-GFCCVEGCSA-N	-1	0	371.264	2.891	50	0		FFAARM
CC(C)Oc1ccc([C@@H](C(=O)[O-])N2CCN(Cc3cccnc3)CC2)cc1	ZINC000095366783	209031265	/nfs/dbraw/zinc/03/12/65/209031265.db2.gz	SFDYXNVHQRJPRA-FQEVSTJZSA-N	-1	0	369.465	2.812	50	0		FFAARM
Cc1cc(C)n(CCC(=O)N2CCC[C@H](c3cccc(C(=O)[O-])c3)C2)n1	ZINC000095366012	209031369	/nfs/dbraw/zinc/03/13/69/209031369.db2.gz	UPGSUKMUOVLCDV-SFHVURJKSA-N	-1	0	355.438	2.994	50	0		FFAARM
O=C([O-])[C@@H]1CCCN1CC(=O)N[C@H](c1cccs1)c1ccc(F)cc1	ZINC000095428052	209049844	/nfs/dbraw/zinc/04/98/44/209049844.db2.gz	ZQVYTMHRVSPQDV-YOEHRIQHSA-N	-1	0	362.426	2.642	50	0		FFAARM
O=C([O-])c1c(I)cccc1I	ZINC000095910965	209087370	/nfs/dbraw/zinc/08/73/70/209087370.db2.gz	QJASZQLQPXQBAR-UHFFFAOYSA-N	-1	0	373.915	2.594	50	0		FFAARM
O=S(=O)([N-]c1ccc2[nH]c(C3CCC3)nc2c1)c1cnc2n1CCC2	ZINC000330105148	258155383	/nfs/dbraw/zinc/15/53/83/258155383.db2.gz	IEGOQJHEZRTWHE-UHFFFAOYSA-N	-1	0	357.439	2.774	50	0		FFAARM
O=C([O-])c1cc(N2CCC[C@]3(CCC(=O)N(C4CCCC4)C3)C2)ccn1	ZINC000077437886	132185143	/nfs/dbraw/zinc/18/51/43/132185143.db2.gz	LHQLYDCOSHBJKA-FQEVSTJZSA-N	-1	0	357.454	2.931	50	0		FFAARM
COc1cccc(CCC(=O)N2C[C@H](C(=O)[O-])Oc3ccccc32)c1OC	ZINC000013436064	132867532	/nfs/dbraw/zinc/86/75/32/132867532.db2.gz	JVCWFIIGKCFHBV-QGZVFWFLSA-N	-1	0	371.389	2.515	50	0		FFAARM
O=C([O-])CCc1ccc(S(=O)(=O)N2CCCc3cccc(F)c32)cc1	ZINC000058611936	136132026	/nfs/dbraw/zinc/13/20/26/136132026.db2.gz	KRHMHFONZFAOIE-UHFFFAOYSA-N	-1	0	363.410	2.984	50	0		FFAARM
O=C([O-])[C@@]1(Cc2cccc(Cl)c2)CCCN(c2ncnc3nc[nH]c32)C1	ZINC000071776907	136141189	/nfs/dbraw/zinc/14/11/89/136141189.db2.gz	ZOQZNTOVFJLKAW-GOSISDBHSA-N	-1	0	371.828	2.920	50	0		FFAARM
C[C@@H](O)c1cccc(N2CCC(C(=O)[O-])(n3ccc(C(C)(C)C)n3)CC2)n1	ZINC000072433478	136147069	/nfs/dbraw/zinc/14/70/69/136147069.db2.gz	FRLMAZIOHYVIIE-CQSZACIVSA-N	-1	0	372.469	2.709	50	0		FFAARM
CC(C)Cc1cc(C(=O)N2CCc3ccccc3[C@H]2CC(=O)[O-])n(C)n1	ZINC000095524911	209075378	/nfs/dbraw/zinc/07/53/78/209075378.db2.gz	UFINCDDGMYFHCK-QGZVFWFLSA-N	-1	0	355.438	2.833	50	0		FFAARM
Cc1ccc(C)c(S(=O)(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)[O-])c1	ZINC000000811627	506233631	/nfs/dbraw/zinc/23/36/31/506233631.db2.gz	PQDKVOGGOLWGRX-KRWDZBQOSA-N	-1	0	372.446	2.759	50	0	biogenic,in-vitro	FFAARM
COc1ccc(/C=C2/SC(=O)N(CC(=O)[O-])C2=O)cc1Br	ZINC000001000570	506242618	/nfs/dbraw/zinc/24/26/18/506242618.db2.gz	YLSDSCIXQLKNAO-BJMVGYQFSA-N	-1	0	372.196	2.579	50	0		FFAARM
Cc1nn(C)c(Cl)c1S(=O)(=O)[N-]c1ccc(Br)cc1	ZINC000001024046	506244286	/nfs/dbraw/zinc/24/42/86/506244286.db2.gz	OZTRKAANMABSME-UHFFFAOYSA-N	-1	0	364.652	2.945	50	0		FFAARM
COc1cccc(NC(=O)c2c([O-])c3cccc4c3n(c2=O)CCC4)c1	ZINC000001249210	506256444	/nfs/dbraw/zinc/25/64/44/506256444.db2.gz	AALHOOPXGNHDJP-UHFFFAOYSA-N	-1	0	350.374	2.914	50	0		FFAARM
O=C(NCc1ccc(Cl)cc1)c1c([O-])c2cccc3c2n(c1=O)CC3	ZINC000001240525	506256894	/nfs/dbraw/zinc/25/68/94/506256894.db2.gz	MDHRWSVLNFGBRT-UHFFFAOYSA-N	-1	0	354.793	2.847	50	0		FFAARM
CCc1nc2sc(C)nn2c1S(=O)(=O)[N-]c1ccc(C)cc1F	ZINC000065183912	506267660	/nfs/dbraw/zinc/26/76/60/506267660.db2.gz	KBAZZSGVYLRHDO-UHFFFAOYSA-N	-1	0	354.432	2.910	50	0		FFAARM
CCc1nn2c(nc(C)c2S(=O)(=O)[N-]c2ccc(OC)cc2C)s1	ZINC000065183813	506268556	/nfs/dbraw/zinc/26/85/56/506268556.db2.gz	POJMKCKNGIUPSM-UHFFFAOYSA-N	-1	0	366.468	2.779	50	0		FFAARM
O=C(COC(=O)[C@H]([N-]C(=O)C(F)(F)F)c1ccccc1)c1ccccc1	ZINC000002051785	506270049	/nfs/dbraw/zinc/27/00/49/506270049.db2.gz	BCHNFCADPMRYPL-OAHLLOKOSA-N	-1	0	365.307	2.832	50	0		FFAARM
CCCc1cc(=O)oc2c(C)c(OCC(=O)N3CCC[C@H]3C(=O)[O-])ccc12	ZINC000002103832	506272023	/nfs/dbraw/zinc/27/20/23/506272023.db2.gz	VGBKUEYXIHVZRQ-HNNXBMFYSA-N	-1	0	373.405	2.508	50	0		FFAARM
CCCCC(=O)N[C@@]([N-]c1nccs1)(C(=O)OCC)C(F)(F)F	ZINC000002307332	506275936	/nfs/dbraw/zinc/27/59/36/506275936.db2.gz	XHXMYOURADNFBN-GFCCVEGCSA-N	-1	0	353.366	2.683	50	0		FFAARM
O=C([O-])CC[C@H](CNS(=O)(=O)c1ccc(Cl)cc1)C(F)(F)F	ZINC000002451276	506279715	/nfs/dbraw/zinc/27/97/15/506279715.db2.gz	VKHJEEXMUYSYLW-MRVPVSSYSA-N	-1	0	359.753	2.662	50	0		FFAARM
CN(C)c1cccc2c1cccc2S(=O)(=O)NCCCCCC(=O)[O-]	ZINC000002516261	506281317	/nfs/dbraw/zinc/28/13/17/506281317.db2.gz	GDDXNKVUNINOBA-UHFFFAOYSA-N	-1	0	364.467	2.829	50	0		FFAARM
CC(C)N1c2ccccc2[C@]([N-]C(=O)C(F)(F)F)(C(F)(F)F)C1=O	ZINC000002503881	506282109	/nfs/dbraw/zinc/28/21/09/506282109.db2.gz	KYVCBPOBAHLAPA-GFCCVEGCSA-N	-1	0	354.250	2.878	50	0		FFAARM
C[C@H](NS(=O)(=O)c1ccc(OCC(=O)[O-])c(Cl)c1)c1ccccc1	ZINC000002872279	506299678	/nfs/dbraw/zinc/29/96/78/506299678.db2.gz	ICSDHJDGCPDZIL-NSHDSACASA-N	-1	0	369.826	2.843	50	0		FFAARM
O=C([O-])CSCC(=O)Nc1nc2ccc(Br)cc2s1	ZINC000003238252	506315696	/nfs/dbraw/zinc/31/56/96/506315696.db2.gz	POICYCLNQRQEMZ-UHFFFAOYSA-N	-1	0	361.242	2.815	50	0		FFAARM
Cc1ccc(S(=O)(=O)N[C@H](C(=O)[O-])C23CC4CC(CC(C4)C2)C3)cc1	ZINC000003897568	506352135	/nfs/dbraw/zinc/35/21/35/506352135.db2.gz	RLSJDLXNDXUIDC-MUGCCGGLSA-N	-1	0	363.479	2.943	50	0		FFAARM
CCOc1cc(/C=C2/SC(=O)N(CC)C2=O)ccc1OCC(=O)[O-]	ZINC000033293530	506353799	/nfs/dbraw/zinc/35/37/99/506353799.db2.gz	JXJGZDCYLWXSJY-MDWZMJQESA-N	-1	0	351.380	2.605	50	0		FFAARM
CCCCCCOC(=O)C[C@@H](C(=O)OCCCCCC)S(=O)(=O)[O-]	ZINC000004065044	506356886	/nfs/dbraw/zinc/35/68/86/506356886.db2.gz	SOSQXPIKTBUEKF-AWEZNQCLSA-N	-1	0	366.476	2.880	50	0		FFAARM
CC[C@H](C)[C@H](NC(=O)[C@H](NC(=O)OCc1ccccc1)C(C)C)C(=O)[O-]	ZINC000004321881	506371284	/nfs/dbraw/zinc/37/12/84/506371284.db2.gz	WRWKLZMOFAMVPZ-IMJJTQAJSA-N	-1	0	364.442	2.553	50	0		FFAARM
O=C(CSc1nnc(-c2ccccc2)c(=O)[n-]1)Nc1ccc(F)cc1	ZINC000005626410	506451233	/nfs/dbraw/zinc/45/12/33/506451233.db2.gz	CZMBDNFITNISAE-UHFFFAOYSA-N	-1	0	356.382	2.702	50	0		FFAARM
CCC1=NO[C@H](Cn2c3cc(C(=O)[O-])cnc3n(C(CC)CC)c2=O)C1	ZINC000055182978	506694030	/nfs/dbraw/zinc/69/40/30/506694030.db2.gz	CJQGGBFLCPVCPA-AWEZNQCLSA-N	-1	0	360.414	2.812	50	0		FFAARM
COc1ccc(Cl)cc1S(=O)(=O)[N-]c1ccc2c(c1)CC(=O)N2	ZINC000009572799	506702574	/nfs/dbraw/zinc/70/25/74/506702574.db2.gz	HZXJJUUTMVMVPT-UHFFFAOYSA-N	-1	0	352.799	2.644	50	0		FFAARM
CCOC(=O)[C@H](CC)SC1=Nc2ccc(Cl)cc2S(=O)(=O)[N-]1	ZINC000009762029	506710590	/nfs/dbraw/zinc/71/05/90/506710590.db2.gz	LMJOMRZLWWGNNV-JTQLQIEISA-N	-1	0	362.860	2.885	50	0		FFAARM
O=C([O-])COc1ccccc1CN(Cc1ccccn1)C[C@H]1CCCO1	ZINC000055413990	506746407	/nfs/dbraw/zinc/74/64/07/506746407.db2.gz	XBLUINGJMCYSJD-GOSISDBHSA-N	-1	0	356.422	2.726	50	0		FFAARM
O=C([O-])[C@]1(NC(=O)c2cc(Br)ccc2Cl)CCSC1	ZINC000043510980	506753121	/nfs/dbraw/zinc/75/31/21/506753121.db2.gz	BTZMBZXTDFYKDL-LBPRGKRZSA-N	-1	0	364.648	2.793	50	0		FFAARM
Cc1c(F)cc(C(N)=O)cc1[N-]S(=O)(=O)c1ccc(F)cc1Cl	ZINC000055614942	506798629	/nfs/dbraw/zinc/79/86/29/506798629.db2.gz	KKEFGRPDDSEIOI-UHFFFAOYSA-N	-1	0	360.769	2.826	50	0		FFAARM
COc1c(F)cc(NS(=O)(=O)c2ccc(C)c(C(=O)[O-])c2)cc1F	ZINC000055682565	506824430	/nfs/dbraw/zinc/82/44/30/506824430.db2.gz	DJGKLWQNGJZNFH-UHFFFAOYSA-N	-1	0	357.334	2.781	50	0		FFAARM
COc1ccc(OC)c(S(=O)(=O)[N-]c2cnc(-c3ccccc3)nc2)c1	ZINC000012507887	506870081	/nfs/dbraw/zinc/87/00/81/506870081.db2.gz	PJMLSQLYYLKWFS-UHFFFAOYSA-N	-1	0	371.418	2.962	50	0		FFAARM
COc1ccc([C@H](CC(=O)[O-])NC(=O)c2sc(C)nc2C)cc1OC	ZINC000013184675	506932223	/nfs/dbraw/zinc/93/22/23/506932223.db2.gz	PRWOTVJZBNPMGJ-LBPRGKRZSA-N	-1	0	364.423	2.723	50	0		FFAARM
CC(C)n1ncc2cc(C(=O)N[C@@H](CC(=O)[O-])c3ccccc3)cnc21	ZINC000013428046	506940505	/nfs/dbraw/zinc/94/05/05/506940505.db2.gz	ONCSLWRTSSLOEA-INIZCTEOSA-N	-1	0	352.394	2.958	50	0		FFAARM
O=S(=O)([N-]c1ncn(Cc2cccc(F)c2)n1)c1ccc(F)cc1F	ZINC000014251466	506984190	/nfs/dbraw/zinc/98/41/90/506984190.db2.gz	XCZZQAJKTNSRGP-UHFFFAOYSA-N	-1	0	368.340	2.545	50	0		FFAARM
COC(=O)C1=C(C)NC(=O)[C@@]1([N-]c1nc2ccccc2s1)C(F)(F)F	ZINC000015202462	507025192	/nfs/dbraw/zinc/02/51/92/507025192.db2.gz	XKVMSAHCFDTUPQ-CQSZACIVSA-N	-1	0	371.340	2.586	50	0		FFAARM
CC(C)c1ccc([C@H]2CC(c3c([O-])n(C)c(=S)n(C)c3=O)=NN2)cc1	ZINC000015834681	507062919	/nfs/dbraw/zinc/06/29/19/507062919.db2.gz	LNCGEALFZWDGPJ-CYBMUJFWSA-N	-1	0	358.467	2.721	50	0		FFAARM
O=C([O-])CCCCCCNC1=C(Cl)C(=O)N(C2CCCCC2)C1=O	ZINC000016051217	507071176	/nfs/dbraw/zinc/07/11/76/507071176.db2.gz	WGINKXVHTVIHLN-UHFFFAOYSA-N	-1	0	356.850	2.763	50	0		FFAARM
COC(=O)c1cc(C)sc1NC(=O)[C@@H]1C2CCC(CC2)[C@@H]1C(=O)[O-]	ZINC000017072892	507112766	/nfs/dbraw/zinc/11/27/66/507112766.db2.gz	ZOVUUBNABKYVSE-UHGWMABZSA-N	-1	0	351.424	2.919	50	0		FFAARM
C[C@@H]1CCc2c(sc(NC(=O)CCCC(=O)[O-])c2C(=O)NC2CC2)C1	ZINC000017074937	507114701	/nfs/dbraw/zinc/11/47/01/507114701.db2.gz	XRIDBFCGARFCPD-SNVBAGLBSA-N	-1	0	364.467	2.959	50	0		FFAARM
O=C([O-])[C@H]1CC=CC[C@@H]1C(=O)Nc1sccc1C(=O)NCc1ccco1	ZINC000017076581	507115053	/nfs/dbraw/zinc/11/50/53/507115053.db2.gz	RHNLMMNMLNXGEK-STQMWFEESA-N	-1	0	374.418	2.877	50	0		FFAARM
O=c1[nH]c(=S)[nH]c([O-])c1[C@H]1c2ccccc2Oc2[nH]c(=S)[nH]c(=O)c21	ZINC000017246388	507118534	/nfs/dbraw/zinc/11/85/34/507118534.db2.gz	ADQXQWAHYSOCCX-SSDOTTSWSA-N	-1	0	374.403	2.582	50	0		FFAARM
COc1ccccc1[N-]S(=O)(=O)c1cc(-c2noc(C)n2)cs1	ZINC000021701927	507263659	/nfs/dbraw/zinc/26/36/59/507263659.db2.gz	SHQJDYCKBXJINY-UHFFFAOYSA-N	-1	0	351.409	2.916	50	0		FFAARM
COc1cccc(C[C@@H](C(=O)Nc2ccc(C)cc2C)c2nnn[n-]2)c1	ZINC000057525355	507285132	/nfs/dbraw/zinc/28/51/32/507285132.db2.gz	AOJDGXWETYSIRM-MRXNPFEDSA-N	-1	0	351.410	2.790	50	0		FFAARM
CC(=O)NCCc1ccc(S(=O)(=O)[N-]c2cc(C)cc(C)c2)s1	ZINC000058173108	507378019	/nfs/dbraw/zinc/37/80/19/507378019.db2.gz	LDYDGXHNVRSFHS-UHFFFAOYSA-N	-1	0	352.481	2.844	50	0		FFAARM
CCOc1ccc(S(=O)(=O)[N-]c2ccn(Cc3ccccn3)n2)cc1	ZINC000058246006	507393615	/nfs/dbraw/zinc/39/36/15/507393615.db2.gz	JZQCHWYRUVXAMV-UHFFFAOYSA-N	-1	0	358.423	2.526	50	0		FFAARM
CC(C)(C)OC(=O)N1C[C@@H](n2cc(-c3ccccc3)nn2)C[C@@H]1C(=O)[O-]	ZINC000071257081	507698845	/nfs/dbraw/zinc/69/88/45/507698845.db2.gz	ADNVHPPFKNQHHE-DZGCQCFKSA-N	-1	0	358.398	2.580	50	0		FFAARM
CC(C)(C)OC(=O)N1C[C@H](n2cc(-c3ccccc3)nn2)C[C@@H]1C(=O)[O-]	ZINC000071257080	507699409	/nfs/dbraw/zinc/69/94/09/507699409.db2.gz	ADNVHPPFKNQHHE-UKRRQHHQSA-N	-1	0	358.398	2.580	50	0		FFAARM
COc1ccc(NC(=O)C2CCC2)c(NC(=O)[C@H]2[C@H](C(=O)[O-])C2(C)C)c1	ZINC000071284126	507700846	/nfs/dbraw/zinc/70/08/46/507700846.db2.gz	MOJLNDNFKCVSHA-HUUCEWRRSA-N	-1	0	360.410	2.729	50	0		FFAARM
CC1(C)[C@H](C(=O)Nc2cccc(C(=O)Nc3nccs3)c2)[C@@H]1C(=O)[O-]	ZINC000071288993	507700984	/nfs/dbraw/zinc/70/09/84/507700984.db2.gz	ARNXSRIUXBYBEV-NWDGAFQWSA-N	-1	0	359.407	2.691	50	0		FFAARM
Cc1c(Cl)c(C(=O)N2CC[C@H](Cc3ccc(C(=O)[O-])cc3)C2)nn1C	ZINC000072429622	507789574	/nfs/dbraw/zinc/78/95/74/507789574.db2.gz	JXNRNFAJPQNFCO-CYBMUJFWSA-N	-1	0	361.829	2.785	50	0		FFAARM
O=C([O-])c1ccnc(-c2ccnc(NCc3noc(C4CCCC4)n3)n2)c1	ZINC000072476756	507795815	/nfs/dbraw/zinc/79/58/15/507795815.db2.gz	XHLAPBNYVLMREJ-UHFFFAOYSA-N	-1	0	366.381	2.890	50	0		FFAARM
Cc1ccc(C(=O)N2C[C@@H](c3ccc4c(c3)OCO4)[C@H](C(=O)[O-])C2)s1	ZINC000091769189	508010786	/nfs/dbraw/zinc/01/07/86/508010786.db2.gz	TWQPDMNGDCIDIU-QWHCGFSZSA-N	-1	0	359.403	2.726	50	0		FFAARM
CCc1nnc(-c2cc(S(=O)(=O)[N-]c3ccc(C)c(F)c3)c[nH]2)o1	ZINC000075428071	508106579	/nfs/dbraw/zinc/10/65/79/508106579.db2.gz	BHCSORVZKIQPAK-UHFFFAOYSA-N	-1	0	350.375	2.875	50	0		FFAARM
O=C([O-])c1csc(CNC(=O)/C=C/c2ccccc2Br)n1	ZINC000097658122	508227416	/nfs/dbraw/zinc/22/74/16/508227416.db2.gz	MMRDBABWYXFMHJ-AATRIKPKSA-N	-1	0	367.224	2.933	50	0		FFAARM
CC(=O)N[C@@H]1CN(c2nc(C)ccc2C(=O)[O-])C[C@H]1c1ccc(C)cc1	ZINC000077503862	508324967	/nfs/dbraw/zinc/32/49/67/508324967.db2.gz	HFBRFKFEZCWWJT-ZWKOTPCHSA-N	-1	0	353.422	2.505	50	0		FFAARM
COc1ccc(N(C)C(=O)c2c([O-])c3cccc4c3n(c2=O)CC4)cc1	ZINC000149005783	508866489	/nfs/dbraw/zinc/86/64/89/508866489.db2.gz	HMOUYQAWQRCQLQ-UHFFFAOYSA-N	-1	0	350.374	2.548	50	0		FFAARM
COc1ccc(F)cc1S(=O)(=O)NC[C@@H]1CCCN1c1ccccc1	ZINC000211121602	509240253	/nfs/dbraw/zinc/24/02/53/509240253.db2.gz	KULCTUJVCZOOPN-INIZCTEOSA-N	-1	0	364.442	2.782	50	0		FFAARM
COc1ccc(C[N@@H+]2CCCN(c3ccccc3)CC2)cc1OCC(=O)[O-]	ZINC000216138572	509258352	/nfs/dbraw/zinc/25/83/52/509258352.db2.gz	NKSYKSNARSFPDL-UHFFFAOYSA-N	-1	0	370.449	2.871	50	0		FFAARM
O=C(c1cc(=O)n(-c2ccccc2)[n-]1)N1CCCC[C@@H]1c1nccs1	ZINC000216442284	509261936	/nfs/dbraw/zinc/26/19/36/509261936.db2.gz	SHDYAFKDECODJG-OAHLLOKOSA-N	-1	0	354.435	2.990	50	0		FFAARM
Cc1ccc(Cc2ccccc2C(=O)N2CCOC[C@H]2CC(=O)[O-])cc1	ZINC000219320709	509286742	/nfs/dbraw/zinc/28/67/42/509286742.db2.gz	VBLJAJHOMZYXJX-GOSISDBHSA-N	-1	0	353.418	2.902	50	0		FFAARM
CCCc1nsc([N-]S(=O)(=O)c2ccc(C(F)(F)F)nc2)n1	ZINC000225393542	509370707	/nfs/dbraw/zinc/37/07/07/509370707.db2.gz	XJDDASISTTUQSF-UHFFFAOYSA-N	-1	0	352.363	2.705	50	0		FFAARM
Cc1ncc(C(=O)[N-]S(=O)(=O)c2cc3c(c(Cl)c2)O[C@H](C)C3)s1	ZINC000225393557	509371176	/nfs/dbraw/zinc/37/11/76/509371176.db2.gz	YQOAMOVMTJQYCW-SSDOTTSWSA-N	-1	0	372.855	2.547	50	0		FFAARM
CCC[C@H](NC(=O)C[C@H](NC(=O)c1ccccc1)c1ccccc1)C(=O)[O-]	ZINC000225484609	509374664	/nfs/dbraw/zinc/37/46/64/509374664.db2.gz	IJWNUFTYMLJFEL-ROUUACIJSA-N	-1	0	368.433	2.917	50	0		FFAARM
CC[C@]1(c2ccc(NC(=O)[C@H]3[C@@H](C(=O)[O-])C3(C)C)cc2)CCC(=O)NC1=O	ZINC000227300315	509408381	/nfs/dbraw/zinc/40/83/81/509408381.db2.gz	WVPFXTRAQOLAMI-QEEYODRMSA-N	-1	0	372.421	2.907	50	0		FFAARM
CC(C)[C@H]1CC[C@H](C)CCN1C(=O)Cc1csc([N-]S(C)(=O)=O)n1	ZINC000170629878	509686870	/nfs/dbraw/zinc/68/68/70/509686870.db2.gz	SDNVLKRQEPLOKI-GXTWGEPZSA-N	-1	0	373.544	2.730	50	0		FFAARM
C[C@H]1CC[C@H](CCC(=O)[N-]S(=O)(=O)c2ccc(F)c3ncccc23)O1	ZINC000170645639	509695108	/nfs/dbraw/zinc/69/51/08/509695108.db2.gz	IUXIAFDJLXYMDI-NWDGAFQWSA-N	-1	0	366.414	2.527	50	0		FFAARM
Cc1nc(C)c(S(=O)(=O)[N-]C(=O)c2ccccc2OC2CCC2)s1	ZINC000170650484	509698477	/nfs/dbraw/zinc/69/84/77/509698477.db2.gz	PQLUBBYXAGOZHJ-UHFFFAOYSA-N	-1	0	366.464	2.810	50	0		FFAARM
Cn1c(C(=O)N2CCO[C@@H](CC(=O)[O-])C2)cc2cc(C(F)(F)F)ccc21	ZINC000237713519	509717444	/nfs/dbraw/zinc/71/74/44/509717444.db2.gz	MKNHQFOOJRVUND-LBPRGKRZSA-N	-1	0	370.327	2.513	50	0		FFAARM
CC(=O)Nc1cc(C(=O)NC[C@](C)(C(=O)[O-])c2ccccc2)ccc1C	ZINC000193091435	509775903	/nfs/dbraw/zinc/77/59/03/509775903.db2.gz	ROVCOWJZPZEFLO-FQEVSTJZSA-N	-1	0	354.406	2.726	50	0		FFAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)c2cn(-c3ccccc3Cl)nn2)C1	ZINC000237973607	509789888	/nfs/dbraw/zinc/78/98/88/509789888.db2.gz	HVNLDDNQGQBZAO-LBPRGKRZSA-N	-1	0	362.817	2.638	50	0		FFAARM
COc1cc(C(C)=NNc2cccc(C(=O)[O-])c2)ccc1S(C)(=O)=O	ZINC000252474553	509837395	/nfs/dbraw/zinc/83/73/95/509837395.db2.gz	HMOHESLFDMQMMB-UHFFFAOYSA-N	-1	0	362.407	2.633	50	0		FFAARM
Cc1noc([C@H]2CCCCN2CCC(=O)Nc2ccsc2C(=O)[O-])n1	ZINC000244787997	509872085	/nfs/dbraw/zinc/87/20/85/509872085.db2.gz	QHLXRJDBPWPTFC-GFCCVEGCSA-N	-1	0	364.427	2.694	50	0		FFAARM
O=S(=O)([N-][C@H](Cc1ccccc1)[C@H]1C[C@H](O)C1)c1c(F)cccc1F	ZINC000244898798	509876324	/nfs/dbraw/zinc/87/63/24/509876324.db2.gz	ZBUOVPSCLAJZKS-CKEIUWERSA-N	-1	0	367.417	2.625	50	0		FFAARM
O=C([O-])[C@H]1CCN(C(=O)/C=C\c2ccc(OCc3cccnc3)cc2)C1	ZINC000255031646	509916724	/nfs/dbraw/zinc/91/67/24/509916724.db2.gz	VKWYOBJJOGBOIO-AFCDSYGPSA-N	-1	0	352.390	2.607	50	0		FFAARM
O=C([O-])[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc(CN2CCCC2=O)cc1	ZINC000265534065	510103937	/nfs/dbraw/zinc/10/39/37/510103937.db2.gz	BREKUPJPNOEFLC-KSZLIROESA-N	-1	0	370.449	2.667	50	0		FFAARM
CCOc1cc(C(=O)N(C)C2Cc3ccccc3C2)ccc1OCC(=O)[O-]	ZINC000268884061	510118454	/nfs/dbraw/zinc/11/84/54/510118454.db2.gz	FMVNXAYXWSCMGJ-UHFFFAOYSA-N	-1	0	369.417	2.788	50	0		FFAARM
C[C@H](CN(Cc1ccccc1)C(=O)c1ccc2c(c1)CCC(=O)N2)C(=O)[O-]	ZINC000178017109	510378561	/nfs/dbraw/zinc/37/85/61/510378561.db2.gz	SVXXCXUKJMUSSP-CQSZACIVSA-N	-1	0	366.417	2.934	50	0		FFAARM
O=C([O-])C[C@H]1CCCN1C(=O)c1ccc(CNC(=O)C2CCCC2)cc1	ZINC000262849263	510439748	/nfs/dbraw/zinc/43/97/48/510439748.db2.gz	CYFYECTWJGTZLP-QGZVFWFLSA-N	-1	0	358.438	2.572	50	0		FFAARM
O=C([O-])C1(CNC(=O)c2cc(C3CC3)nc3ccccc32)CCOCC1	ZINC000191459473	510670219	/nfs/dbraw/zinc/67/02/19/510670219.db2.gz	OCLKBEMFIKHABY-UHFFFAOYSA-N	-1	0	354.406	2.723	50	0		FFAARM
O=C([O-])[C@H]1CCN(C(=O)Nc2ccc(C(=O)NCc3ccccc3)cc2)C1	ZINC000263488856	510723726	/nfs/dbraw/zinc/72/37/26/510723726.db2.gz	NUYNHCDTTRMPIC-INIZCTEOSA-N	-1	0	367.405	2.555	50	0		FFAARM
O=C(NC[C@@H]1CCN(c2ccccc2F)C1)c1s[n-]c(=O)c1Cl	ZINC000292396007	511581635	/nfs/dbraw/zinc/58/16/35/511581635.db2.gz	IVVWCYMOVCARIL-VIFPVBQESA-N	-1	0	355.822	2.898	50	0		FFAARM
CN(Cc1n[nH]c(=O)[n-]1)C(=O)c1cc(-c2ccccc2)nn1-c1ccccc1	ZINC000426412753	513932894	/nfs/dbraw/zinc/93/28/94/513932894.db2.gz	KIXZKKNYDBLZKB-UHFFFAOYSA-N	-1	0	374.404	2.635	50	0		FFAARM
Cc1nc2ccc(C(=O)Nc3cnn(C(C)(C)C(=O)[O-])c3)cc2nc1C	ZINC000579190789	518561566	/nfs/dbraw/zinc/56/15/66/518561566.db2.gz	KDBDUMDBSBXYHZ-UHFFFAOYSA-N	-1	0	353.382	2.515	50	0		FFAARM
CN(C[C@@H]1OCCN(C)[C@H]1c1ccccc1)C(=O)c1cccc(C(=O)[O-])c1	ZINC000567862462	518755415	/nfs/dbraw/zinc/75/54/15/518755415.db2.gz	CUDVPUJRQRMYBQ-OALUTQOASA-N	-1	0	368.433	2.529	50	0		FFAARM
CC(=O)N[C@@H](CC(=O)N1CCC[C@@H](CCC(=O)[O-])C1)c1ccc(C)cc1	ZINC000236685958	519682887	/nfs/dbraw/zinc/68/28/87/519682887.db2.gz	KYGPMXZNLGZWOR-WMZOPIPTSA-N	-1	0	360.454	2.666	50	0		FFAARM
O=C([O-])C[C@@H]1CN(C(=O)/C=C\c2cccc(OC3CCCC3)c2)CCO1	ZINC000606441107	521069382	/nfs/dbraw/zinc/06/93/82/521069382.db2.gz	FNINPSQRHZXSBJ-CNZFZVQHSA-N	-1	0	359.422	2.723	50	0		FFAARM
C[C@H](NC(=O)Nc1ccccc1C[S@](C)=O)[C@@H]1C[C@H](C(=O)[O-])C1(C)C	ZINC000593963191	521318661	/nfs/dbraw/zinc/31/86/61/521318661.db2.gz	ZBZOVJHDYMQMPT-PUIDTHFKSA-N	-1	0	366.483	2.822	50	0		FFAARM
Cc1cccc(C[C@@H](CNC(=O)c2ncoc2[C@H]2CCCO2)C(=O)[O-])c1	ZINC000237676015	524466919	/nfs/dbraw/zinc/46/69/19/524466919.db2.gz	FYUJPMMLFWZRQH-LSDHHAIUSA-N	-1	0	358.394	2.508	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)c2cc(C3CC3)nc3ccc(Cl)cc32)CCO1	ZINC000178279556	526287028	/nfs/dbraw/zinc/28/70/28/526287028.db2.gz	PJENCWHHYFURCE-INIZCTEOSA-N	-1	0	360.797	2.691	50	0		FFAARM
O=C([O-])[C@H]1[C@H](c2ccccc2)[C@@H](C(=O)N2CCOCC2)[C@@H]1c1ccccc1	ZINC000247364334	526336711	/nfs/dbraw/zinc/33/67/11/526336711.db2.gz	FMUMEDHFYUKQRJ-FGYAAKKASA-N	-1	0	365.429	2.743	50	0		FFAARM
O=C([O-])COc1cccc(CNC(=O)[C@H]2C[C@H]2c2cc(F)ccc2F)c1	ZINC000238021245	527619153	/nfs/dbraw/zinc/61/91/53/527619153.db2.gz	HUGGUINYSXVEFB-HOCLYGCPSA-N	-1	0	361.344	2.848	50	0		FFAARM
COc1cccc(-c2cc3c(N4CCC(C(=O)[O-])CC4)nccn3n2)c1	ZINC000057509271	537064409	/nfs/dbraw/zinc/06/44/09/537064409.db2.gz	SBPVHUOUYWWPBP-UHFFFAOYSA-N	-1	0	352.394	2.706	50	0		FFAARM
C[C@H](NC(=O)CSc1nc(=O)cc([O-])n1C1CCCC1)c1ccco1	ZINC000102288766	570830276	/nfs/dbraw/zinc/83/02/76/570830276.db2.gz	WLRPVJWSCJXXLC-NSHDSACASA-N	-1	0	363.439	2.627	50	0		FFAARM
O=C(/N=c1\[n-]nc2ccccn21)c1ccccc1SC[C@H]1CCCO1	ZINC000046083037	570924371	/nfs/dbraw/zinc/92/43/71/570924371.db2.gz	BUDRDISMYHVILD-CYBMUJFWSA-N	-1	0	354.435	2.675	50	0		FFAARM
O=C([O-])[C@H]1CCCN(C(=O)C2(c3cccc(Cl)c3)CCOCC2)C1	ZINC000109621843	570928910	/nfs/dbraw/zinc/92/89/10/570928910.db2.gz	OPQICHDTIGXYKW-ZDUSSCGKSA-N	-1	0	351.830	2.711	50	0		FFAARM
COC(=O)c1ccc(CNC(=O)c2ccc3c(c2)[n-]c(=S)[nH]c3=O)cc1	ZINC000048324613	570946123	/nfs/dbraw/zinc/94/61/23/570946123.db2.gz	ABXWZEXGTFONMN-UHFFFAOYSA-N	-1	0	369.402	2.715	50	0		FFAARM
CCc1n[nH]c(=S)n1CCNC(=O)[C@@H]1CCCC[C@@H]1C(F)(F)F	ZINC000073997819	571139021	/nfs/dbraw/zinc/13/90/21/571139021.db2.gz	JBKQPBQXCPWDAS-ZJUUUORDSA-N	-1	0	350.410	2.988	50	0		FFAARM
Cc1ccc(S(=O)(=O)[N-]C(=O)C(C)(C)c2ccc(Cl)cc2F)cn1	ZINC000252492907	571280949	/nfs/dbraw/zinc/28/09/49/571280949.db2.gz	MXDCMVLTAQBMKQ-UHFFFAOYSA-N	-1	0	370.833	2.965	50	0		FFAARM
COc1cc(C(C)=NNC(=O)c2ccc(C)s2)ccc1OCC(=O)[O-]	ZINC000252672250	571292422	/nfs/dbraw/zinc/29/24/22/571292422.db2.gz	PRSHXCXLDSLOPK-UHFFFAOYSA-N	-1	0	362.407	2.683	50	0		FFAARM
Cc1nc(CNC(=O)c2ccc([C@H]3CCCN3CC(=O)[O-])s2)cs1	ZINC000020512405	727832393	/nfs/dbraw/zinc/83/23/93/727832393.db2.gz	NAWQYPHVXVEQDN-GFCCVEGCSA-N	-1	0	365.480	2.665	50	0		FFAARM
COc1cc(NS(=O)(=O)/C=C\c2ccccc2)c(C(=O)[O-])cc1OC	ZINC000047214459	728027995	/nfs/dbraw/zinc/02/79/95/728027995.db2.gz	JGUYDNYAQLAFIQ-HJWRWDBZSA-N	-1	0	363.391	2.815	50	0		FFAARM
CC(C)Oc1nn(C)c2ccc(NC(=O)[C@@H]3CC=CC[C@@H]3C(=O)[O-])cc12	ZINC000675028337	971521084	/nfs/dbraw/zinc/52/10/84/971521084.db2.gz	PQMPRBTYZUIJHX-KGLIPLIRSA-N	-1	0	357.410	2.966	50	0		FFAARM
COC(=O)CCCCC([O-])=C1C(=O)CC(C)(C)[C@@H](c2cc(C)no2)C1=O	ZINC000105304178	975847908	/nfs/dbraw/zinc/84/79/08/975847908.db2.gz	UYYRYVLWZLNLTI-SJORKVTESA-N	-1	0	363.410	2.553	50	0		FFAARM
O=C(NCc1ccc2[nH]c(=O)[nH]c2c1)c1cc(=O)c2cccc(F)c2[n-]1	ZINC000828139629	999556050	/nfs/dbraw/zinc/55/60/50/999556050.db2.gz	ACCQXJIUOSPCAX-UHFFFAOYSA-N	-1	0	352.325	2.591	50	0		FFAARM
O=C([O-])c1cccc(CN2CCC[C@H](S(=O)(=O)Nc3ccccc3)C2)c1	ZINC000666576136	1027131443	/nfs/dbraw/zinc/13/14/43/1027131443.db2.gz	SULYLFCVHABENB-SFHVURJKSA-N	-1	0	374.462	2.791	50	0		FFAARM
COc1ccc(/C=C/C(=O)Nc2cccc(OCC(=O)[O-])c2)cc1OC	ZINC000095389868	1028573529	/nfs/dbraw/zinc/57/35/29/1028573529.db2.gz	OTJPYCAJEHGUOD-VQHVLOKHSA-N	-1	0	357.362	2.819	50	0		FFAARM
Cc1cccc([C@@H](C(=O)[O-])N2CCN(CCc3ccccc3)C(=O)C2)c1	ZINC001506422620	1059512827	/nfs/dbraw/zinc/51/28/27/1059512827.db2.gz	ACXQNMKRXBKLBP-FQEVSTJZSA-N	-1	0	352.434	2.508	50	0		FFAARM
O=C([O-])[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(Br)o1	ZINC000020082166	209612810	/nfs/dbraw/zinc/61/28/10/209612810.db2.gz	BBSWJIHVUGIOOG-NSHDSACASA-N	-1	0	350.168	2.694	50	0		FFAARM
CNC(=O)c1ccccc1[N-]S(=O)(=O)c1cccc(C(F)(F)F)c1	ZINC000014869431	209593735	/nfs/dbraw/zinc/59/37/35/209593735.db2.gz	FIEKIQLVLKLKJV-UHFFFAOYSA-N	-1	0	358.341	2.866	50	0		FFAARM
C[S@@](=O)C[C@@H](NC(=O)c1ccc2[n-]c(=S)oc2c1)c1ccccc1	ZINC000170649105	209550980	/nfs/dbraw/zinc/55/09/80/209550980.db2.gz	KWDZMZFXSKQPSO-JBEBIEQOSA-N	-1	0	360.460	2.966	50	0		FFAARM
O=C([O-])CN(Cc1ccc(C(F)(F)F)cc1)C(=O)[C@H]1CC12CCOCC2	ZINC000238133058	209359498	/nfs/dbraw/zinc/35/94/98/209359498.db2.gz	VUTAVUHDOZHDFJ-CQSZACIVSA-N	-1	0	371.355	2.935	50	0		FFAARM
O=C([O-])c1ccc(C(=O)N2CCO[C@@H](c3ccc(F)c(F)c3)C2)s1	ZINC000237997181	209358745	/nfs/dbraw/zinc/35/87/45/209358745.db2.gz	WEXTVJFMNUVCRW-GFCCVEGCSA-N	-1	0	353.346	2.938	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)[C@@H]1CCCOC1)c1cccc(Br)c1	ZINC000237953884	209356451	/nfs/dbraw/zinc/35/64/51/209356451.db2.gz	LITPEXUALWNLBW-YPMHNXCESA-N	-1	0	356.216	2.508	50	0		FFAARM
Cc1nc(COc2ccc(/C=C/C(=O)N3CC[C@H](C(=O)[O-])C3)cc2)cs1	ZINC000237743212	209354903	/nfs/dbraw/zinc/35/49/03/209354903.db2.gz	PDKXSKGBKVXXAB-SZTZYQKNSA-N	-1	0	372.446	2.977	50	0		FFAARM
Cn1c2ccccc2c(Cl)c1C(=O)N(CCC(=O)[O-])C[C@H]1CCCO1	ZINC000237709884	209352307	/nfs/dbraw/zinc/35/23/07/209352307.db2.gz	ITTZBPUVEQNPLE-GFCCVEGCSA-N	-1	0	364.829	2.928	50	0		FFAARM
Cc1cc(C)n(Cc2cccc(C(=O)N(C[C@H](C)C(=O)[O-])C3CC3)c2)n1	ZINC000237473376	209350918	/nfs/dbraw/zinc/35/09/18/209350918.db2.gz	UTKUZYXQXHNGJG-ZDUSSCGKSA-N	-1	0	355.438	2.874	50	0		FFAARM
CN(Cc1ccc(C(=O)[O-])cc1)C(=O)c1cc(N2CCCC2=O)ccc1F	ZINC000237064594	209332513	/nfs/dbraw/zinc/33/25/13/209332513.db2.gz	VXOIFNWHGLGNLU-UHFFFAOYSA-N	-1	0	370.380	2.923	50	0		FFAARM
Cc1cc(C)n(Cc2ccc(C(=O)N(C[C@@H](C)C(=O)[O-])C3CC3)cc2)n1	ZINC000237380999	209346336	/nfs/dbraw/zinc/34/63/36/209346336.db2.gz	KHEWCNYLVJCASD-CYBMUJFWSA-N	-1	0	355.438	2.874	50	0		FFAARM
CN(Cc1ccc(C(=O)[O-])cc1)C(=O)CC[C@@H]1Cc2ccccc2NC1=O	ZINC000237024231	209324360	/nfs/dbraw/zinc/32/43/60/209324360.db2.gz	YFHASXORNJPLPH-QGZVFWFLSA-N	-1	0	366.417	2.934	50	0		FFAARM
Cc1ccc(N2C(=O)[C@H]3C(C(=O)c4ccc(Cl)cc4)=NOC3=C2[O-])cc1	ZINC000103118662	209247256	/nfs/dbraw/zinc/24/72/56/209247256.db2.gz	LJWXLMOQRWMLFW-YOEHRIQHSA-N	-1	0	368.776	2.776	50	0		FFAARM
COc1ccc(-n2c(=O)c3[n-][nH]n(-c4ccc(C)cc4)c=3c2=O)cc1OC	ZINC000102819029	209242231	/nfs/dbraw/zinc/24/22/31/209242231.db2.gz	HEMYIGNNRKIKML-IAGOWNOFSA-N	-1	0	366.377	2.510	50	0		FFAARM
CCn1c(=O)c2ccc(C(=O)NCCOc3ccccc3)cc2[n-]c1=S	ZINC000102166882	209233914	/nfs/dbraw/zinc/23/39/14/209233914.db2.gz	CFGUDLLRVVIPAD-UHFFFAOYSA-N	-1	0	369.446	2.514	50	0		FFAARM
CCc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccc(OC)cc4)c=3c2=O)cc1	ZINC000101418396	209225654	/nfs/dbraw/zinc/22/56/54/209225654.db2.gz	JUQCWCDCPQFJKA-MSOLQXFVSA-N	-1	0	364.405	2.751	50	0		FFAARM
Cc1ccc(-n2c(=O)c3[n-][nH]n(Cc4cccc(F)c4)c=3c2=O)cc1C	ZINC000101418503	209224773	/nfs/dbraw/zinc/22/47/73/209224773.db2.gz	NMASCJJRCPNVDC-DLBZAZTESA-N	-1	0	352.369	2.936	50	0		FFAARM
O=c1c2[n-][nH]n(Cc3ccc(Cl)cc3)c=2c(=O)n1-c1ccc(F)cc1	ZINC000101272083	209223075	/nfs/dbraw/zinc/22/30/75/209223075.db2.gz	HBRFSERQPLYUFB-GJZGRUSLSA-N	-1	0	358.760	2.973	50	0		FFAARM
O=c1c2[n-][nH]n(Cc3ccccc3Cl)c=2c(=O)n1-c1ccc(F)cc1	ZINC000101167818	209221666	/nfs/dbraw/zinc/22/16/66/209221666.db2.gz	RAELTFMPEFUALW-LSDHHAIUSA-N	-1	0	358.760	2.973	50	0		FFAARM
CC(=O)c1[n-]n(-c2ccccc2C)c2c(O)n(-c3ccc(C)cc3)c(=O)c1-2	ZINC000100741960	209218170	/nfs/dbraw/zinc/21/81/70/209218170.db2.gz	QFZJMGYATJXYAD-HKUYNNGSSA-N	-1	0	361.401	2.627	50	0		FFAARM
CCn1c2ccccc2c([O-])c(C(=O)Nc2ccc(C(=O)OC)cc2)c1=O	ZINC000100543100	209215227	/nfs/dbraw/zinc/21/52/27/209215227.db2.gz	YYXDFIGVAHFAKG-UHFFFAOYSA-N	-1	0	366.373	2.766	50	0		FFAARM
CC(C)(C)n1nc(C(=O)N(CCC(=O)[O-])C2CCOCC2)cc1C1CC1	ZINC000236769476	209198215	/nfs/dbraw/zinc/19/82/15/209198215.db2.gz	WADAOTMERRRCJA-UHFFFAOYSA-N	-1	0	363.458	2.611	50	0		FFAARM
C/C(=C/C(=O)N1CCO[C@H](CC(=O)[O-])C1)c1ccccc1C(F)(F)F	ZINC000236628730	209192050	/nfs/dbraw/zinc/19/20/50/209192050.db2.gz	SXSNEJGJITZUHH-NXIHDVOMSA-N	-1	0	357.328	2.811	50	0		FFAARM
CCCc1ncncc1-c1nc(C2(c3ccccc3)CC2)nn1CC(=O)[O-]	ZINC000097655381	209191181	/nfs/dbraw/zinc/19/11/81/209191181.db2.gz	ZFRAHBURKOULTP-UHFFFAOYSA-N	-1	0	363.421	2.852	50	0		FFAARM
CC(=O)c1cccc([N-]S(=O)(=O)c2c(C)[nH]c(-c3nnc(C)o3)c2C)c1	ZINC000096379407	209152006	/nfs/dbraw/zinc/15/20/06/209152006.db2.gz	UBYQFXDEIDDUCE-UHFFFAOYSA-N	-1	0	374.422	2.993	50	0		FFAARM
O=C1N[C@H](c2ccccc2)C(=C([O-])c2cccs2)[C@](O)(C(F)(F)F)N1	ZINC000004163464	207004803	/nfs/dbraw/zinc/00/48/03/207004803.db2.gz	OXRRYKXYECAQSB-JMSVASOKSA-N	-1	0	370.352	2.852	50	0		FFAARM
COc1ccc([C@@H](CC(=O)Nc2cc(C)on2)[N-]C(=O)C(F)(F)F)cc1	ZINC000004474830	207021476	/nfs/dbraw/zinc/02/14/76/207021476.db2.gz	ZMEBXPWSGRFBFW-GFCCVEGCSA-N	-1	0	371.315	2.740	50	0		FFAARM
CCCCC[C@H](O)/C=C/[C@H]1O[C@@H](O)C[C@H](O)[C@@H]1C/C=C\CCCC(=O)[O-]	ZINC000004521870	207025607	/nfs/dbraw/zinc/02/56/07/207025607.db2.gz	XNRNNGPBEPRNAR-XGZCXCQCSA-N	-1	0	370.486	2.769	50	0	endogenous,in-man	FFAARM
Cc1ccc(S(=O)(=O)[N-]NC(=S)Nc2cccc(Cl)c2)cc1	ZINC000004550997	207027521	/nfs/dbraw/zinc/02/75/21/207027521.db2.gz	PXSXTJVMSCJXLE-UHFFFAOYSA-N	-1	0	355.872	2.828	50	0		FFAARM
CCOc1ccc([C@@H](CC(=O)[O-])NS(=O)(=O)Cc2ccccc2)cc1	ZINC000004581522	207029312	/nfs/dbraw/zinc/02/93/12/207029312.db2.gz	IIEIWLRWUKJECW-QGZVFWFLSA-N	-1	0	363.435	2.721	50	0		FFAARM
O=C([O-])[C@H](Cc1ccc(F)cc1)NS(=O)(=O)c1ccc(Cl)s1	ZINC000004718039	207041285	/nfs/dbraw/zinc/04/12/85/207041285.db2.gz	CJPHWVSMONIVLR-JTQLQIEISA-N	-1	0	363.819	2.515	50	0		FFAARM
O=C([O-])CCCNC(=O)/C(=C/c1ccc(F)cc1)NC(=O)c1ccccc1	ZINC000004844065	207054307	/nfs/dbraw/zinc/05/43/07/207054307.db2.gz	OYDVXKVGBUCVMZ-LGMDPLHJSA-N	-1	0	370.380	2.578	50	0		FFAARM
COc1ccccc1C[C@H](C(=O)Nc1cc(C)ccc1C)c1nnn[n-]1	ZINC000005489215	207103067	/nfs/dbraw/zinc/10/30/67/207103067.db2.gz	VBHBDJYYPSIFOM-HNNXBMFYSA-N	-1	0	351.410	2.790	50	0		FFAARM
CCN(CC)S(=O)(=O)c1cccc([N-]S(=O)(=O)c2cccs2)c1	ZINC000005881829	207120797	/nfs/dbraw/zinc/12/07/97/207120797.db2.gz	HFJZDNRPMKUJSR-UHFFFAOYSA-N	-1	0	374.509	2.579	50	0		FFAARM
CNC(=S)Nc1ccc(C)c(S(=O)(=O)[N-]c2ccccc2OC)c1	ZINC000006332217	207137319	/nfs/dbraw/zinc/13/73/19/207137319.db2.gz	WOGYWHCBUOYNMA-UHFFFAOYSA-N	-1	0	365.480	2.721	50	0		FFAARM
Cc1ccc(Cn2[nH][n-]c3c(=O)n(-c4ccc(F)c(F)c4)c(=O)c2=3)cc1	ZINC000006770604	207162165	/nfs/dbraw/zinc/16/21/65/207162165.db2.gz	GIVYTRMNKCEZMN-HOTGVXAUSA-N	-1	0	356.332	2.767	50	0		FFAARM
Cc1nn(C)c(C)c1[N-]S(=O)(=O)c1ccc(Br)s1	ZINC000006975321	207181642	/nfs/dbraw/zinc/18/16/42/207181642.db2.gz	GEQCZVAFXVVGRX-UHFFFAOYSA-N	-1	0	350.263	2.662	50	0		FFAARM
O=C(C[C@H]1SC(=O)[N-]C1=O)N1CCC[C@H]1c1nc2ccccc2s1	ZINC000008749600	207246909	/nfs/dbraw/zinc/24/69/09/207246909.db2.gz	NSPAHKJXFDMAOC-CMPLNLGQSA-N	-1	0	361.448	2.702	50	0		FFAARM
CCCCCC(=O)Nc1cc(=O)nc2[n-]c(COc3ccccc3)nn21	ZINC000009011726	207255625	/nfs/dbraw/zinc/25/56/25/207255625.db2.gz	DQKLORFGCSWFEG-UHFFFAOYSA-N	-1	0	355.398	2.928	50	0		FFAARM
CCC(=O)Nc1cc(S(=O)(=O)[N-]c2ccccc2OC)ccc1O	ZINC000012532487	207387632	/nfs/dbraw/zinc/38/76/32/207387632.db2.gz	DTTJJTQQWMEGRX-UHFFFAOYSA-N	-1	0	350.396	2.550	50	0		FFAARM
CC(=O)[N-]S(=O)(=O)c1ccc(NC(=O)c2cc3ccccc3o2)cc1	ZINC000012581238	207398450	/nfs/dbraw/zinc/39/84/50/207398450.db2.gz	FUMRFLCZZOYWRY-UHFFFAOYSA-N	-1	0	358.375	2.510	50	0		FFAARM
COC(=O)c1sccc1NC(=O)C[C@H](C(=O)[O-])c1ccc(F)cc1	ZINC000012929375	207438835	/nfs/dbraw/zinc/43/88/35/207438835.db2.gz	LCOQHMUONUCMAP-NSHDSACASA-N	-1	0	351.355	2.871	50	0		FFAARM
Cc1ccc(S(C)(=O)=O)cc1NC(=O)C[C@@H](C(=O)[O-])c1ccccc1	ZINC000013468202	207461621	/nfs/dbraw/zinc/46/16/21/207461621.db2.gz	UFPBHUBMKYEURH-OAHLLOKOSA-N	-1	0	361.419	2.596	50	0		FFAARM
O=C([O-])[C@@H]1C2CCC(CC2)[C@H]1C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000017075899	207610439	/nfs/dbraw/zinc/61/04/39/207610439.db2.gz	QJYMVHPWVBCBQO-VKYMVXLJSA-N	-1	0	370.449	2.998	50	0		FFAARM
Cc1nc2[n-]c(SCc3ccccc3Cl)nn2c(=O)c1CCO	ZINC000018029804	207625374	/nfs/dbraw/zinc/62/53/74/207625374.db2.gz	OYNSIQCIQNHTKZ-UHFFFAOYSA-N	-1	0	350.831	2.619	50	0		FFAARM
CC[C@H](NC(=O)/C(=C\c1ccccc1)NC(=O)c1ccc(C)cc1)C(=O)[O-]	ZINC000020035194	207722611	/nfs/dbraw/zinc/72/26/11/207722611.db2.gz	DSXAAJBATHCENR-NAVNFMRLSA-N	-1	0	366.417	2.745	50	0		FFAARM
CC(C)[C@H](NC(=O)Cn1ccc2cc(Br)ccc21)C(=O)[O-]	ZINC000032071485	208023494	/nfs/dbraw/zinc/02/34/94/208023494.db2.gz	LTNMIUMXDDLLJW-AWEZNQCLSA-N	-1	0	353.216	2.629	50	0		FFAARM
Cc1[nH]c2ccccc2c1[C@@H](C(=O)[O-])N1CCN(C(=O)c2ccco2)CC1	ZINC000032105935	208025659	/nfs/dbraw/zinc/02/56/59/208025659.db2.gz	NGHNOPXXPHQVTE-SFHVURJKSA-N	-1	0	367.405	2.653	50	0		FFAARM
O=C([O-])CCCNC(=O)CCn1ccc2cc(Br)ccc21	ZINC000032105840	208026042	/nfs/dbraw/zinc/02/60/42/208026042.db2.gz	PLPDDQKQHAGLEV-UHFFFAOYSA-N	-1	0	353.216	2.775	50	0		FFAARM
COc1cccc(-n2[nH][n-]c3c(=O)n(-c4ccc(C)c(C)c4)c(=O)c2=3)c1	ZINC000033274053	208081132	/nfs/dbraw/zinc/08/11/32/208081132.db2.gz	GLQNSHWKFXFICN-IAGOWNOFSA-N	-1	0	350.378	2.810	50	0		FFAARM
CN1OC[C@@H](S(=O)(=O)NC2CCCCC2)[C@H]1c1cccc(F)c1F	ZINC000034739464	208107469	/nfs/dbraw/zinc/10/74/69/208107469.db2.gz	QVZMMGOIBNMXQW-GDBMZVCRSA-N	-1	0	360.426	2.504	50	0		FFAARM
O=C(CCc1nnc(-c2cccc(Cl)c2)[n-]c1=O)NCc1ccccn1	ZINC000034767943	208109063	/nfs/dbraw/zinc/10/90/63/208109063.db2.gz	CZRBRMPGFXIHBW-UHFFFAOYSA-N	-1	0	369.812	2.542	50	0		FFAARM
CC[C@H](C)NC(=O)CCc1nnc(-c2cccc(OCC3CC3)c2)[n-]c1=O	ZINC000034765418	208109710	/nfs/dbraw/zinc/10/97/10/208109710.db2.gz	CXWJBJABXBDYNL-ZDUSSCGKSA-N	-1	0	370.453	2.880	50	0		FFAARM
C[C@@H]1CCCN(S(=O)(=O)Nc2cc(C(=O)[O-])cc(C(F)(F)F)c2)C1	ZINC000072015908	208186032	/nfs/dbraw/zinc/18/60/32/208186032.db2.gz	XQKXOEUANONMPO-SECBINFHSA-N	-1	0	366.361	2.792	50	0		FFAARM
CCOC(=O)c1[nH]c(C)c(S(=O)(=O)[N-]c2cccc(OC)c2)c1C	ZINC000075347989	208194728	/nfs/dbraw/zinc/19/47/28/208194728.db2.gz	PAXJVPLMRQLKLE-UHFFFAOYSA-N	-1	0	352.412	2.618	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)C1CCOCC1)c1ccc(OC(F)(F)F)cc1	ZINC000299343407	208285333	/nfs/dbraw/zinc/28/53/33/208285333.db2.gz	HMBVWJHADDDDHB-CYBMUJFWSA-N	-1	0	361.316	2.644	50	0		FFAARM
Cc1cc(C)n(-c2ccc(C(=O)N3[C@@H]4CCCC[C@@H]4C[C@H]3C(=O)[O-])cn2)n1	ZINC000299742338	208337672	/nfs/dbraw/zinc/33/76/72/208337672.db2.gz	BFRDHTVWBXNBED-OIISXLGYSA-N	-1	0	368.437	2.742	50	0		FFAARM
O=C([O-])[C@@H]1Cc2ccccc2CN1C(=O)Cc1coc(-c2ccccc2)n1	ZINC000299747010	208339234	/nfs/dbraw/zinc/33/92/34/208339234.db2.gz	BUOHDJLWJZATGM-SFHVURJKSA-N	-1	0	362.385	2.922	50	0		FFAARM
O=C([O-])c1ccc(CCNC(=O)C[C@H]2Sc3ccccc3NC2=O)cc1	ZINC000299745892	208342547	/nfs/dbraw/zinc/34/25/47/208342547.db2.gz	TWCFLHRZVZQJEK-MRXNPFEDSA-N	-1	0	370.430	2.547	50	0		FFAARM
COc1ccccc1[N-]S(=O)(=O)c1cc(C(=O)N2CCCC2)cs1	ZINC000046049811	208357251	/nfs/dbraw/zinc/35/72/51/208357251.db2.gz	NJCGSCYKRITGJX-UHFFFAOYSA-N	-1	0	366.464	2.794	50	0		FFAARM
O=C([O-])CCN(C[C@@H]1CCCO1)C(=O)c1ccc(OC(F)(F)F)cc1	ZINC000299753698	208362831	/nfs/dbraw/zinc/36/28/31/208362831.db2.gz	YZKWKGUCBHPUDZ-ZDUSSCGKSA-N	-1	0	361.316	2.681	50	0		FFAARM
Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)[C@H]1CC=CC[C@H]1C(=O)[O-]	ZINC000051186002	208431824	/nfs/dbraw/zinc/43/18/24/208431824.db2.gz	CHMPNBBRLRVAKS-JKSUJKDBSA-N	-1	0	358.438	2.986	50	0		FFAARM
Cc1nc(COc2ccccc2/C=C/C(=O)NC2(C(=O)[O-])CC2)cs1	ZINC000095989649	209094059	/nfs/dbraw/zinc/09/40/59/209094059.db2.gz	XRAJFIGMOZIXTA-VOTSOKGWSA-N	-1	0	358.419	2.777	50	0		FFAARM
CC(=O)c1cccc([C@@H](C(=O)[O-])N2CCN(Cc3cccc(F)c3)CC2)c1	ZINC000095356044	209026407	/nfs/dbraw/zinc/02/64/07/209026407.db2.gz	IBVPSXAMPRJRJJ-FQEVSTJZSA-N	-1	0	370.424	2.972	50	0		FFAARM
Cc1cc(C(=O)N2C[C@H]3COc4ccccc4C[C@@]3(C(=O)[O-])C2)c(C)o1	ZINC000095359342	209027960	/nfs/dbraw/zinc/02/79/60/209027960.db2.gz	ZEEVVMKSDLKJRF-MGPUTAFESA-N	-1	0	355.390	2.675	50	0		FFAARM
CCCCOc1cc(F)ccc1[C@@H](C(=O)[O-])N1CCCN(C(C)=O)CC1	ZINC000095366686	209031460	/nfs/dbraw/zinc/03/14/60/209031460.db2.gz	GHAUNGCAEOPBIK-SFHVURJKSA-N	-1	0	366.433	2.685	50	0		FFAARM
O=C([O-])c1ccc([C@H]2CCCN(C(=O)CCCN3CCCCC3=O)C2)cc1	ZINC000095391142	209047587	/nfs/dbraw/zinc/04/75/87/209047587.db2.gz	LNFAFNYJMJSDMB-SFHVURJKSA-N	-1	0	372.465	2.884	50	0		FFAARM
CC(=O)c1ccc(N2CCC(Oc3cccc(F)c3)(C(=O)[O-])CC2)nc1	ZINC000082120254	132195926	/nfs/dbraw/zinc/19/59/26/132195926.db2.gz	FPHVLRMXCXCPQX-UHFFFAOYSA-N	-1	0	358.369	2.926	50	0		FFAARM
COc1ccc(CN2CC(=O)N(c3cccc(C)c3)C[C@@H]2C)cc1C(=O)[O-]	ZINC000082133509	132196794	/nfs/dbraw/zinc/19/67/94/132196794.db2.gz	YKSHNXGTBQCHGD-HNNXBMFYSA-N	-1	0	368.433	2.939	50	0		FFAARM
CN(C)c1cccc(C(=O)n2cc(C(=O)c3cc(F)ccc3[O-])cn2)c1	ZINC000004057899	263331222	/nfs/dbraw/zinc/33/12/22/263331222.db2.gz	TVYLKCWJJZHCMH-UHFFFAOYSA-N	-1	0	353.353	2.713	50	0		FFAARM
O=C([O-])Cn1nccc1[C@@H]1CCCN(c2nnc(-c3ccccc3)s2)C1	ZINC000426691303	263658651	/nfs/dbraw/zinc/65/86/51/263658651.db2.gz	OHGJMNFVCBUGIO-CQSZACIVSA-N	-1	0	369.450	2.870	50	0		FFAARM
COc1ccc([C@H]2N[C@@H](C(=O)[O-])Cc3c4ccccc4[nH]c32)c(OC)c1	ZINC000000754342	506232383	/nfs/dbraw/zinc/23/23/83/506232383.db2.gz	TWSTVZBEFBQGQE-SJLPKXTDSA-N	-1	0	352.390	2.873	50	0	biogenic	FFAARM
COc1ccc(C)cc1[N-]S(=O)(=O)c1ccc2[nH]c(=O)sc2c1	ZINC000064947076	506242361	/nfs/dbraw/zinc/24/23/61/506242361.db2.gz	GUSCOMCVQICITJ-UHFFFAOYSA-N	-1	0	350.421	2.707	50	0		FFAARM
CCOC(=O)c1cc(S(=O)(=O)[N-]c2ccccc2OCC)c(C)n1C	ZINC000064923340	506242409	/nfs/dbraw/zinc/24/24/09/506242409.db2.gz	ZAXZBSCDCJBHEL-UHFFFAOYSA-N	-1	0	366.439	2.710	50	0		FFAARM
Cc1csc(-c2cc(S(=O)(=O)[N-]c3cc(C)ccn3)c(C)n2C)n1	ZINC000065009020	506249655	/nfs/dbraw/zinc/24/96/55/506249655.db2.gz	UUCKUKZXAVONSZ-UHFFFAOYSA-N	-1	0	362.480	3.270	50	0		FFAARM
CCOc1cc(/C=C2/NC(=O)[N-]C2=O)cc(Br)c1OC(C)C	ZINC000001166442	506251295	/nfs/dbraw/zinc/25/12/95/506251295.db2.gz	RLUFACGSGWUELS-IZZDOVSWSA-N	-1	0	369.215	2.815	50	0		FFAARM
COc1cc(/C=C2/N=C(c3ccccc3)OC2=O)ccc1OCC(=O)[O-]	ZINC000001439694	506261613	/nfs/dbraw/zinc/26/16/13/506261613.db2.gz	IEZGRTNVIQKOBB-NTEUORMPSA-N	-1	0	353.330	2.503	50	0		FFAARM
CCc1nc2sc3c(c2c(-n2[n-]c(=O)c4ccccc4c2=O)n1)CCC3	ZINC000001514381	506264216	/nfs/dbraw/zinc/26/42/16/506264216.db2.gz	IGLDUMGEWMMNEJ-UHFFFAOYSA-N	-1	0	364.430	2.735	50	0		FFAARM
O=C([O-])C[C@@H](NCc1ccco1)C(=O)Nc1ccccc1Br	ZINC000002254324	506275781	/nfs/dbraw/zinc/27/57/81/506275781.db2.gz	ZKHOKALYEIGHCA-CYBMUJFWSA-N	-1	0	367.199	2.614	50	0		FFAARM
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(Br)c(C(=O)[O-])c1	ZINC000002656174	506287067	/nfs/dbraw/zinc/28/70/67/506287067.db2.gz	RWQJTRRJITWTHF-SECBINFHSA-N	-1	0	362.245	2.710	50	0		FFAARM
O=C([O-])CCc1nc2sc3c(c2c(=O)n1C[C@H]1CCCO1)CCCC3	ZINC000003298751	506320336	/nfs/dbraw/zinc/32/03/36/506320336.db2.gz	FBCSJIXZJOBCJM-LLVKDONJSA-N	-1	0	362.451	2.533	50	0		FFAARM
Cc1ccc(S(=O)(=O)N[C@@H](C(=O)[O-])C23CC4CC(CC(C4)C2)C3)cc1	ZINC000003897567	506351505	/nfs/dbraw/zinc/35/15/05/506351505.db2.gz	RLSJDLXNDXUIDC-QBNKABOXSA-N	-1	0	363.479	2.943	50	0		FFAARM
O=C([O-])CCCCCNC(=O)/C(=C\c1ccco1)NC(=O)c1ccccc1	ZINC000004093769	506358811	/nfs/dbraw/zinc/35/88/11/506358811.db2.gz	WDOCAZSGXBOAKQ-SAPNQHFASA-N	-1	0	370.405	2.812	50	0		FFAARM
O=C([O-])c1ccc(NC(=O)c2ccc(C=C3SC(=O)NC3=O)cc2)cc1	ZINC000004291612	506369797	/nfs/dbraw/zinc/36/97/97/506369797.db2.gz	SWSNMDDYXJWEKF-ZROIWOOFSA-N	-1	0	368.370	2.961	50	0		FFAARM
COc1cccc(-c2nnc(SCc3ccc(C(=O)[O-])cc3)n2N)c1	ZINC000005092083	506420505	/nfs/dbraw/zinc/42/05/05/506420505.db2.gz	XLFYQRRVBLSGHQ-UHFFFAOYSA-N	-1	0	356.407	2.658	50	0		FFAARM
O=C1CCCN1c1cccc([N-]S(=O)(=O)c2c(F)cccc2F)c1	ZINC000007726750	506586182	/nfs/dbraw/zinc/58/61/82/506586182.db2.gz	URBCFGISMUKQSQ-UHFFFAOYSA-N	-1	0	352.362	2.892	50	0		FFAARM
Cn1cc(S(=O)(=O)[N-]c2ccccc2C(=O)Nc2ccc(F)cc2)cn1	ZINC000055560928	506778982	/nfs/dbraw/zinc/77/89/82/506778982.db2.gz	OKOOHGQOOLFTMZ-UHFFFAOYSA-N	-1	0	374.397	2.612	50	0		FFAARM
COc1ccc(CC(=O)N[C@@H](CC(=O)[O-])c2ccc(F)cc2)cc1OC	ZINC000013176211	506930310	/nfs/dbraw/zinc/93/03/10/506930310.db2.gz	VNBOMOSOFVGQSM-HNNXBMFYSA-N	-1	0	361.369	2.718	50	0		FFAARM
CC(=O)c1cccc(NC(=O)c2ccsc2NC(=O)C=CC(=O)[O-])c1	ZINC000013324001	506937736	/nfs/dbraw/zinc/93/77/36/506937736.db2.gz	PJLHMQACODTMOY-AATRIKPKSA-N	-1	0	358.375	2.782	50	0		FFAARM
Cc1n[nH]c(C)c1[C@@H](NC(=O)c1c(C)c2cccc(C)c2n1C)C(=O)[O-]	ZINC000067690752	506977903	/nfs/dbraw/zinc/97/79/03/506977903.db2.gz	FVLQAIKEMUYCDQ-OAHLLOKOSA-N	-1	0	354.410	2.691	50	0		FFAARM
CCCCn1c(=O)c(C2=NN[C@H](c3ccccc3OC)C2)c([O-])[nH]c1=S	ZINC000015834798	507063193	/nfs/dbraw/zinc/06/31/93/507063193.db2.gz	BCFUEFMBHPGZGP-LBPRGKRZSA-N	-1	0	374.466	2.859	50	0		FFAARM
CCCc1cc(C(N)=O)c(NC(=O)[C@H]2C3CCC(CC3)[C@@H]2C(=O)[O-])s1	ZINC000017074934	507114634	/nfs/dbraw/zinc/11/46/34/507114634.db2.gz	FXFNZVXJGPCMNV-FMPDERDJSA-N	-1	0	364.467	2.875	50	0		FFAARM
CC1=C(C)C[C@H](C(=O)[O-])[C@H](C(=O)Nc2ccc(N3CCOCC3)cc2)C1	ZINC000017073966	507115241	/nfs/dbraw/zinc/11/52/41/507115241.db2.gz	KYZBFBFWBZDZAH-MSOLQXFVSA-N	-1	0	358.438	2.909	50	0		FFAARM
O=c1[nH]c(=S)[nH]c([O-])c1[C@@H]1c2ccccc2Oc2[nH]c(=S)[nH]c(=O)c21	ZINC000017246384	507119406	/nfs/dbraw/zinc/11/94/06/507119406.db2.gz	ADQXQWAHYSOCCX-ZETCQYMHSA-N	-1	0	374.403	2.582	50	0		FFAARM
Cc1nc2[n-]c(C(=O)N3CCC(C)CC3)nn2c(=O)c1Cc1ccccc1	ZINC000018221994	507146864	/nfs/dbraw/zinc/14/68/64/507146864.db2.gz	BZFLTLUFZBXPOQ-UHFFFAOYSA-N	-1	0	365.437	2.601	50	0		FFAARM
Cc1cn2c(nc(C)c(S(=O)(=O)[N-]c3ccc(C)c(F)c3)c2=O)s1	ZINC000020921762	507236739	/nfs/dbraw/zinc/23/67/39/507236739.db2.gz	CTPUWJYYKCNPGL-UHFFFAOYSA-N	-1	0	367.427	2.621	50	0		FFAARM
CCc1nc2sc([C@@H](c3cccc(C)c3)N3CCN(C)CC3)c([O-])n2n1	ZINC000022577867	507300462	/nfs/dbraw/zinc/30/04/62/507300462.db2.gz	QPJCJGFEYPFEEU-MRXNPFEDSA-N	-1	0	371.510	2.704	50	0		FFAARM
CC(=O)NCCc1ccc(S(=O)(=O)[N-]c2cccc(Cl)c2)s1	ZINC000058169148	507378673	/nfs/dbraw/zinc/37/86/73/507378673.db2.gz	NAJLTRGYGRKNKB-UHFFFAOYSA-N	-1	0	358.872	2.881	50	0		FFAARM
CN(Cc1ccsc1)c1ccc(S(=O)(=O)[N-]c2ccccn2)cn1	ZINC000024528458	507417519	/nfs/dbraw/zinc/41/75/19/507417519.db2.gz	SAKANWUABOTEHX-UHFFFAOYSA-N	-1	0	360.464	2.975	50	0		FFAARM
COC(=O)c1sccc1S(=O)(=O)[N-]c1ccc(-n2cccn2)cc1	ZINC000024577595	507420925	/nfs/dbraw/zinc/42/09/25/507420925.db2.gz	HBQIQJCQHISYDW-UHFFFAOYSA-N	-1	0	363.420	2.521	50	0		FFAARM
O=C1OCCN1c1ccccc1[N-]S(=O)(=O)c1ccc(F)cc1F	ZINC000060341755	507526523	/nfs/dbraw/zinc/52/65/23/507526523.db2.gz	NTYBMMSCLZCEJB-UHFFFAOYSA-N	-1	0	354.334	2.722	50	0		FFAARM
O=C(c1ccc([O-])c(Cl)c1)N1CCN(C(=O)c2ccccc2F)CC1	ZINC000026210643	507568579	/nfs/dbraw/zinc/56/85/79/507568579.db2.gz	UASQOQWSGJCRPP-UHFFFAOYSA-N	-1	0	362.788	2.783	50	0		FFAARM
Cc1nnc(-c2cc(NC(=O)Cc3ccccc3C(=O)[O-])ccc2O)o1	ZINC000071286375	507700679	/nfs/dbraw/zinc/70/06/79/507700679.db2.gz	NHIVCZDVLDJGLW-UHFFFAOYSA-N	-1	0	353.334	2.630	50	0		FFAARM
COC(=O)c1ccc(C)c(S(=O)(=O)Nc2cc(C(=O)[O-])ccc2C)c1	ZINC000028196979	507712308	/nfs/dbraw/zinc/71/23/08/507712308.db2.gz	ZJKUNFAPDPICOF-UHFFFAOYSA-N	-1	0	363.391	2.589	50	0		FFAARM
O=C([O-])C1(n2cccn2)CCN(C(=O)c2scc3c2CCCC3)CC1	ZINC000072409588	507784930	/nfs/dbraw/zinc/78/49/30/507784930.db2.gz	PYOLYUALHJMITJ-UHFFFAOYSA-N	-1	0	359.451	2.540	50	0		FFAARM
Cc1oc(C(C)C)cc1C(=O)N1CCC(C(=O)[O-])(n2ccnc2C)CC1	ZINC000072423776	507787919	/nfs/dbraw/zinc/78/79/19/507787919.db2.gz	WSNAXHQJDVYYRZ-UHFFFAOYSA-N	-1	0	359.426	2.932	50	0		FFAARM
O=C([O-])[C@@H]1c2[nH]cnc2CCN1Cc1nc(-c2ccc(F)cc2)cs1	ZINC000072426280	507788230	/nfs/dbraw/zinc/78/82/30/507788230.db2.gz	FXOAFIRWMVUKEI-INIZCTEOSA-N	-1	0	358.398	2.856	50	0		FFAARM
CCC[C@H](Nc1nccc(-c2cc(C(=O)[O-])ccn2)n1)c1nccn1C	ZINC000072428123	507788913	/nfs/dbraw/zinc/78/89/13/507788913.db2.gz	RHXDETSCJQDERM-AWEZNQCLSA-N	-1	0	352.398	2.924	50	0		FFAARM
CC(C)c1ccc(CC(=O)N2CCn3nc(CCC(=O)[O-])cc3C2)cc1	ZINC000072432075	507790209	/nfs/dbraw/zinc/79/02/09/507790209.db2.gz	KZJBPGJPYPMGJH-UHFFFAOYSA-N	-1	0	355.438	2.609	50	0		FFAARM
Cc1cc(S(=O)(=O)Nc2cccc(-c3nc[nH]n3)c2)cc(C(=O)[O-])c1C	ZINC000079107651	507933834	/nfs/dbraw/zinc/93/38/34/507933834.db2.gz	YMKMOEKQDKEULW-UHFFFAOYSA-N	-1	0	372.406	2.588	50	0		FFAARM
CC(C)=CC[C@]1(C(=O)[O-])CCCN(C(=O)c2nn(C)c3c2CCCC3)C1	ZINC000091382114	507983112	/nfs/dbraw/zinc/98/31/12/507983112.db2.gz	CUSCMQLARIATRF-HXUWFJFHSA-N	-1	0	359.470	2.962	50	0		FFAARM
CCc1nnc(-c2cc(S(=O)(=O)[N-]c3cc(C)ccc3OC)c[nH]2)o1	ZINC000075428083	508106589	/nfs/dbraw/zinc/10/65/89/508106589.db2.gz	BBCBYHZCAVNGTR-UHFFFAOYSA-N	-1	0	362.411	2.745	50	0		FFAARM
COc1cc(/C=C\C(=O)N2CCC[C@@H](C(=O)[O-])C2)ccc1OC(F)F	ZINC000096305166	508213457	/nfs/dbraw/zinc/21/34/57/508213457.db2.gz	FNCKKTNWWUAGMW-SMYYYNMVSA-N	-1	0	355.337	2.633	50	0		FFAARM
COC(=O)c1ccc2c(c1)[n-]c(=S)n(Cc1ccc3c(c1)OCO3)c2=O	ZINC000100101950	508238007	/nfs/dbraw/zinc/23/80/07/508238007.db2.gz	DOPPUDKQAQOHLY-UHFFFAOYSA-N	-1	0	370.386	2.623	50	0		FFAARM
COc1ccc(CNC(=O)c2c([O-])c3cccc4c3n(c2=O)CCC4)cc1	ZINC000100613724	508239524	/nfs/dbraw/zinc/23/95/24/508239524.db2.gz	SFTZIJQGQNTMBK-UHFFFAOYSA-N	-1	0	364.401	2.592	50	0	biogenic	FFAARM
CCCCn1c(=O)c(C2=NN[C@H](c3ccc(OC)cc3)C2)c([O-])[nH]c1=S	ZINC000101763461	508256606	/nfs/dbraw/zinc/25/66/06/508256606.db2.gz	GGRURZNAGAYFSP-ZDUSSCGKSA-N	-1	0	374.466	2.859	50	0		FFAARM
CCOc1ccc(-c2ccnc(NCc3cnc(C)cn3)n2)cc1C(=O)[O-]	ZINC000077424393	508315021	/nfs/dbraw/zinc/31/50/21/508315021.db2.gz	ABSLZJXOTWAJOL-UHFFFAOYSA-N	-1	0	365.393	2.951	50	0		FFAARM
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)c1c([O-])cc(F)cc1F	ZINC000130286389	508809814	/nfs/dbraw/zinc/80/98/14/508809814.db2.gz	RRXNIXLDIWOAOM-HNNXBMFYSA-N	-1	0	360.360	2.591	50	0		FFAARM
COc1cccc(CN(C)Cc2ccc3nonc3c2)c1O[C@@H](C)C(=O)[O-]	ZINC000215196718	509243299	/nfs/dbraw/zinc/24/32/99/509243299.db2.gz	DFJHYMBYHIQWKF-LBPRGKRZSA-N	-1	0	371.393	2.715	50	0		FFAARM
CCn1cc(S(=O)(=O)N[C@H]2CCC[C@@H](C(F)(F)F)C2)cc1C(=O)[O-]	ZINC000236957731	509541600	/nfs/dbraw/zinc/54/16/00/509541600.db2.gz	MYPVEBJGBHGHMN-ZJUUUORDSA-N	-1	0	368.377	2.606	50	0		FFAARM
Cc1cc(Br)ccc1C(=O)N(CCC(=O)[O-])C1CCOCC1	ZINC000237544492	509674973	/nfs/dbraw/zinc/67/49/73/509674973.db2.gz	IVOWTADNIQVHLG-UHFFFAOYSA-N	-1	0	370.243	2.853	50	0		FFAARM
Cc1nn(C)c2nc(-c3ccccc3)cc(C(=O)N3CCC[C@H]3C(=O)[O-])c12	ZINC000237878292	509760956	/nfs/dbraw/zinc/76/09/56/509760956.db2.gz	SXKMPBYRIQXYAH-INIZCTEOSA-N	-1	0	364.405	2.633	50	0		FFAARM
CCOc1ccc(C(=O)[N-]S(=O)(=O)Cc2ccc(Cl)c(F)c2)cn1	ZINC000252549758	509852445	/nfs/dbraw/zinc/85/24/45/509852445.db2.gz	RUSAOYQKKNFFHL-UHFFFAOYSA-N	-1	0	372.805	2.533	50	0		FFAARM
Cc1ncsc1CN(C)S(=O)(=O)c1cc(C(F)(F)F)ccc1[O-]	ZINC000253426861	509881122	/nfs/dbraw/zinc/88/11/22/509881122.db2.gz	BGTIVWSTXYVREJ-UHFFFAOYSA-N	-1	0	366.386	2.997	50	0		FFAARM
Cc1nc2ccc([N-]S(=O)(=O)c3cccc4cc(C)cnc43)cn2n1	ZINC000253429702	509882670	/nfs/dbraw/zinc/88/26/70/509882670.db2.gz	DEXIMXGFPIBNTB-UHFFFAOYSA-N	-1	0	353.407	2.695	50	0		FFAARM
CN(C(=O)c1cc(C(=O)[O-])co1)[C@@H]1CCN(c2ccccc2Cl)C1=O	ZINC000183789618	509975996	/nfs/dbraw/zinc/97/59/96/509975996.db2.gz	UQUMCQTXHARKOI-CYBMUJFWSA-N	-1	0	362.769	2.509	50	0		FFAARM
C[C@H](Oc1ccccc1Cl)C(=O)N(CCC(=O)[O-])C1CCOCC1	ZINC000328595352	511889295	/nfs/dbraw/zinc/88/92/95/511889295.db2.gz	SBGZNUGIWAUACL-LBPRGKRZSA-N	-1	0	355.818	2.590	50	0		FFAARM
Cc1nn(C(C)C)c(C)c1S(=O)(=O)Nc1c(F)cccc1C(=O)[O-]	ZINC000547923375	516635161	/nfs/dbraw/zinc/63/51/61/516635161.db2.gz	AAHFDAHSKXXMIU-UHFFFAOYSA-N	-1	0	355.391	2.719	50	0		FFAARM
COc1cc(C(=O)N2CCC[C@H]2C(=O)[O-])ccc1OCc1c(C)noc1C	ZINC000583652230	519360177	/nfs/dbraw/zinc/36/01/77/519360177.db2.gz	UPFLWXKBIVZVRF-HNNXBMFYSA-N	-1	0	374.393	2.568	50	0		FFAARM
CCOc1cc(C(=O)N2CC[C@@H](C(=O)[O-])C2)ccc1OCc1cccnc1	ZINC000269181948	520660493	/nfs/dbraw/zinc/66/04/93/520660493.db2.gz	LNRWJMMDKNYWSN-MRXNPFEDSA-N	-1	0	370.405	2.606	50	0		FFAARM
O=C([O-])[C@H]1CCCN1C(=O)/C=C\c1ccc(OCc2cccnc2)cc1	ZINC000606441098	521068712	/nfs/dbraw/zinc/06/87/12/521068712.db2.gz	GMKRLBXAPQTTLA-IEODJVTJSA-N	-1	0	352.390	2.749	50	0		FFAARM
Cc1nn(CC(C)C)c(Cl)c1/C=C\C(=O)N1CCC[C@H](C(=O)[O-])C1	ZINC000606441290	521068935	/nfs/dbraw/zinc/06/89/35/521068935.db2.gz	PZDYYVKDECBORB-FWWRYZNZSA-N	-1	0	353.850	2.837	50	0		FFAARM
CCOC(=O)c1c(CC)[nH]nc1S(=O)(=O)[N-]c1ccc(SC)cc1	ZINC000085602226	521404103	/nfs/dbraw/zinc/40/41/03/521404103.db2.gz	ZAKGFHIQYZZREW-UHFFFAOYSA-N	-1	0	369.468	2.672	50	0		FFAARM
COc1cc(CCC(=O)N2Cc3ccccc3C[C@H]2C(=O)[O-])cc(OC)c1	ZINC000268961964	522323599	/nfs/dbraw/zinc/32/35/99/522323599.db2.gz	ZSCFRKYUDBYXQH-IBGZPJMESA-N	-1	0	369.417	2.675	50	0		FFAARM
COc1cc([N-]S(=O)(=O)c2ccc(-c3cc[nH]n3)s2)cc(OC)c1	ZINC000085664831	522753360	/nfs/dbraw/zinc/75/33/60/522753360.db2.gz	HUPGHBNMECIYGC-UHFFFAOYSA-N	-1	0	365.436	2.956	50	0		FFAARM
COc1ccccc1-c1nc(CC(=O)N2CCC(C(=O)[O-])CC2)cs1	ZINC000020744466	524279596	/nfs/dbraw/zinc/27/95/96/524279596.db2.gz	ZBCXZHFTBNJUMT-UHFFFAOYSA-N	-1	0	360.435	2.684	50	0		FFAARM
O=C([O-])[C@@H]1CN(S(=O)(=O)c2cc(F)ccc2Cl)c2ccccc21	ZINC000078824155	526286599	/nfs/dbraw/zinc/28/65/99/526286599.db2.gz	MSONNDUZJAZXIC-LLVKDONJSA-N	-1	0	355.774	2.856	50	0		FFAARM
O=C([O-])C1CCC(NC(=O)COc2ccc(Br)cc2F)CC1	ZINC000268944013	527560432	/nfs/dbraw/zinc/56/04/32/527560432.db2.gz	UQXIUGSNKDDXHV-UHFFFAOYSA-N	-1	0	374.206	2.727	50	0		FFAARM
Cc1cc(Cl)ccc1NC(=O)N1CCc2c(nc3cc[n-]n3c2=O)C1	ZINC000102990191	570860853	/nfs/dbraw/zinc/86/08/53/570860853.db2.gz	HLKPGBQHOYVQRG-UHFFFAOYSA-N	-1	0	357.801	2.575	50	0		FFAARM
N#C/C(=C/c1ccc(O)cc1)C(=O)Nc1sc2c(c1C(N)=O)CCCC2	ZINC000000941911	570878368	/nfs/dbraw/zinc/87/83/68/570878368.db2.gz	FKYAMPRFDCKJCH-XFXZXTDPSA-N	-1	0	367.430	2.977	50	0		FFAARM
O=C([O-])[C@@H]1CCN(C(=O)NCCOCc2ccc(Cl)cc2Cl)C1	ZINC000263145018	729681028	/nfs/dbraw/zinc/68/10/28/729681028.db2.gz	AOMXHFQIOVSTEC-SNVBAGLBSA-N	-1	0	361.225	2.626	50	0		FFAARM
CN(C)C(=O)c1ccc([N-]S(=O)(=O)c2ccc(C(F)F)cc2)nc1	ZINC000585083522	845948275	/nfs/dbraw/zinc/94/82/75/845948275.db2.gz	PHCOWDNSTZDFBR-UHFFFAOYSA-N	-1	0	355.366	2.522	50	0		FFAARM
C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)N1CC[C@@H](C(=O)[O-])c2ccccc21	ZINC000669436707	984588701	/nfs/dbraw/zinc/58/87/01/984588701.db2.gz	COBKYMWYZQRLAE-WRSAYESZSA-N	-1	0	353.374	2.820	50	0		FFAARM
Cc1nn(C)c2[n-]c(C(=O)N[C@@H]3CCCc4cnn(C(C)C)c43)cc(=O)c12	ZINC000952874964	1011005136	/nfs/dbraw/zinc/00/51/36/1011005136.db2.gz	LWCZOXXGXNIQEQ-CYBMUJFWSA-N	-1	0	368.441	2.567	50	0		FFAARM
C[C@@H]1OCCC[C@@H]1C(=O)Nc1cccc(C(=O)N2CCCC[C@@H]2C(=O)[O-])c1	ZINC000668274522	1027582408	/nfs/dbraw/zinc/58/24/08/1027582408.db2.gz	FQQAYIWKXPVUTG-RRQGHBQHSA-N	-1	0	374.437	2.520	50	0		FFAARM
CSc1ncc(C(=O)[O-])c(N2CCC(c3nc(C(C)C)no3)CC2)n1	ZINC001529188740	1062213503	/nfs/dbraw/zinc/21/35/03/1062213503.db2.gz	AYAMWXUMLHVVDH-UHFFFAOYSA-N	-1	0	363.443	2.787	50	0		FFAARM
Cc1coc2c1cc1c(C)c(CCC(=O)NCC(=O)[O-])c(=O)oc1c2C	ZINC000002107701	209394329	/nfs/dbraw/zinc/39/43/29/209394329.db2.gz	QBTUPRMJUKJSCJ-UHFFFAOYSA-N	-1	0	357.362	2.598	50	0	biogenic	FFAARM
O=C([O-])CC[C@H]1CCCN(C(=O)c2ccc(CN3CCCC3=O)cc2)C1	ZINC000238018994	209358538	/nfs/dbraw/zinc/35/85/38/209358538.db2.gz	OJHGFFISJIBAOD-OAHLLOKOSA-N	-1	0	358.438	2.526	50	0		FFAARM
O=C([O-])C1CCN(C(=O)C2(c3cccc(Cl)c3)CCOCC2)CC1	ZINC000238021030	209357930	/nfs/dbraw/zinc/35/79/30/209357930.db2.gz	LVSOYIUSQFGDOK-UHFFFAOYSA-N	-1	0	351.830	2.711	50	0		FFAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)C2(c3cccc(F)c3)CCOCC2)C1	ZINC000237955726	209356771	/nfs/dbraw/zinc/35/67/71/209356771.db2.gz	LGZSRFPPFHXXLG-HNNXBMFYSA-N	-1	0	363.429	2.977	50	0		FFAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)c2cccc(Nc3cnccn3)c2)C1	ZINC000237972361	209356156	/nfs/dbraw/zinc/35/61/56/209356156.db2.gz	SKAYXALSMLAHFA-AWEZNQCLSA-N	-1	0	354.410	2.937	50	0		FFAARM
Cc1ccccc1-n1ncc(C(=O)N2CC[C@H](C(=O)[O-])C2)c1C(F)(F)F	ZINC000237737921	209354696	/nfs/dbraw/zinc/35/46/96/209354696.db2.gz	XNVIEYLLYFXPIT-NSHDSACASA-N	-1	0	367.327	2.746	50	0		FFAARM
Cc1cccc(C[C@H](CNC(=O)c2ncoc2[C@@H]2CCCO2)C(=O)[O-])c1	ZINC000237698436	209352805	/nfs/dbraw/zinc/35/28/05/209352805.db2.gz	FYUJPMMLFWZRQH-CABCVRRESA-N	-1	0	358.394	2.508	50	0		FFAARM
Cc1ccccc1[C@H](CC(=O)[O-])NC(=O)[C@@H]1CC(=O)Nc2ccccc21	ZINC000237655613	209352187	/nfs/dbraw/zinc/35/21/87/209352187.db2.gz	UACSJFQMNOEEFZ-WBVHZDCISA-N	-1	0	352.390	2.753	50	0		FFAARM
COc1c(Br)c(C)sc1C(=O)N1CC[C@@](C)(C(=O)[O-])C1	ZINC000237277382	209342859	/nfs/dbraw/zinc/34/28/59/209342859.db2.gz	YZSFIPOQLJBLIY-CYBMUJFWSA-N	-1	0	362.245	2.764	50	0		FFAARM
COc1ccc(CCC(=O)N2CC[C@@](C)(C(=O)[O-])C2)cc1Br	ZINC000237189400	209336231	/nfs/dbraw/zinc/33/62/31/209336231.db2.gz	QGOGIKWPHSNQBY-MRXNPFEDSA-N	-1	0	370.243	2.714	50	0		FFAARM
CN(CC(=O)[O-])C(=O)c1cnn(-c2cccc(C(F)(F)F)c2)c1C1CC1	ZINC000237177121	209335675	/nfs/dbraw/zinc/33/56/75/209335675.db2.gz	JSWXAONTMVZXQW-UHFFFAOYSA-N	-1	0	367.327	2.925	50	0		FFAARM
COc1cc(S(=O)(=O)Nc2cc(F)ccc2C)cc(C(=O)[O-])c1OC	ZINC000045946225	209328791	/nfs/dbraw/zinc/32/87/91/209328791.db2.gz	BUSZDOGMDNZGJA-UHFFFAOYSA-N	-1	0	369.370	2.650	50	0		FFAARM
CC(C)n1cc(Br)cc1C(=O)N[C@]1(C(=O)[O-])CCSC1	ZINC000043511062	209302412	/nfs/dbraw/zinc/30/24/12/209302412.db2.gz	BFAYBRFQUFRWIY-CYBMUJFWSA-N	-1	0	361.261	2.522	50	0		FFAARM
COc1c(Cl)cc(C(=O)N[C@]2(C(=O)[O-])CCSC2)cc1Cl	ZINC000043509898	209302099	/nfs/dbraw/zinc/30/20/99/209302099.db2.gz	APYIOHQVRCABIO-CYBMUJFWSA-N	-1	0	350.223	2.692	50	0		FFAARM
CCCO[C@H]1CCCN(C(=O)c2ccc3c(c2)[n-]c(=S)[nH]c3=O)CC1	ZINC000108461508	209286915	/nfs/dbraw/zinc/28/69/15/209286915.db2.gz	FRTFQRIKMYQWEA-ZDUSSCGKSA-N	-1	0	361.467	2.633	50	0		FFAARM
CCOc1ccc(NC(=O)c2ccc3c(c2)[n-]c(=S)n(C)c3=O)cc1	ZINC000102333717	209234816	/nfs/dbraw/zinc/23/48/16/209234816.db2.gz	ZSYMHSVAYDNJEA-UHFFFAOYSA-N	-1	0	355.419	2.873	50	0		FFAARM
Cn1c(=O)c2ccc(C(=O)Nc3ccnn3C3CCCC3)cc2[n-]c1=S	ZINC000102172956	209233034	/nfs/dbraw/zinc/23/30/34/209233034.db2.gz	BOEIGMNPLACRCC-UHFFFAOYSA-N	-1	0	369.450	2.786	50	0		FFAARM
CCN(Cc1ccccc1)C(=O)c1ccc2c(c1)[n-]c(=S)n(C)c2=O	ZINC000102177656	209232994	/nfs/dbraw/zinc/23/29/94/209232994.db2.gz	LIFCNJWWGVAAKD-UHFFFAOYSA-N	-1	0	353.447	2.885	50	0		FFAARM
CCOc1ccc(-n2c(=O)c3[n-][nH]n(Cc4cccc(F)c4)c=3c2=O)cc1	ZINC000101417804	209225449	/nfs/dbraw/zinc/22/54/49/209225449.db2.gz	HJYJMWWTZMIHLW-SJORKVTESA-N	-1	0	368.368	2.718	50	0		FFAARM
O=c1c2[n-][nH]n(Cc3cccc(F)c3)c=2c(=O)n1-c1ccc(Cl)cc1	ZINC000101167785	209221542	/nfs/dbraw/zinc/22/15/42/209221542.db2.gz	BMFSPEGDPKKYKV-HUUCEWRRSA-N	-1	0	358.760	2.973	50	0		FFAARM
CC[C@@H]1C(=O)N(C)CCN1Cc1ccc(OCc2ccc(C(=O)[O-])o2)cc1	ZINC000097745120	209194568	/nfs/dbraw/zinc/19/45/68/209194568.db2.gz	QEJRHDUPHCQILK-QGZVFWFLSA-N	-1	0	372.421	2.609	50	0		FFAARM
CCOC(=O)/C=C\c1ccc(NS(=O)(=O)c2ccc3c(c2)CCO3)cc1	ZINC000096930715	209162649	/nfs/dbraw/zinc/16/26/49/209162649.db2.gz	PNFSFXZWNOENJG-YHYXMXQVSA-N	-1	0	373.430	2.999	50	0		FFAARM
C[C@@H](Oc1ccccc1Cl)C(=O)N(CCC(=O)[O-])C1CCOCC1	ZINC000328595351	206711182	/nfs/dbraw/zinc/71/11/82/206711182.db2.gz	SBGZNUGIWAUACL-GFCCVEGCSA-N	-1	0	355.818	2.590	50	0		FFAARM
COc1cc(/C=C2/N=C(c3ccc(F)cc3)OC2=O)ccc1OCC(=O)[O-]	ZINC000006441242	206802784	/nfs/dbraw/zinc/80/27/84/206802784.db2.gz	MEYBUCHCWLMCJN-RIYZIHGNSA-N	-1	0	371.320	2.642	50	0		FFAARM
O=C([O-])CCC(=O)N1N=C(c2ccccc2)C[C@@H]1c1ccc2c(c1)OCO2	ZINC000000798803	206831810	/nfs/dbraw/zinc/83/18/10/206831810.db2.gz	VRLZWWXKIBUPQC-MRXNPFEDSA-N	-1	0	366.373	2.958	50	0		FFAARM
COc1ccccc1N(C)S(=O)(=O)c1ccc(Cl)c(C(=O)[O-])c1	ZINC000003884867	206991843	/nfs/dbraw/zinc/99/18/43/206991843.db2.gz	UNBLJHPTUZXJRD-UHFFFAOYSA-N	-1	0	355.799	2.872	50	0		FFAARM
COc1ccc2[nH]c(SCC(=O)Nc3ccc(CC(=O)[O-])cc3)nc2c1	ZINC000004626598	207034268	/nfs/dbraw/zinc/03/42/68/207034268.db2.gz	SBCCFNCGTMMLTL-UHFFFAOYSA-N	-1	0	371.418	2.929	50	0		FFAARM
Cc1nnc(S[C@@H](C)C(=O)Nc2nc(-c3ccccc3)cs2)[n-]c1=O	ZINC000004911683	207061665	/nfs/dbraw/zinc/06/16/65/207061665.db2.gz	FLELWOIMNWMAEJ-JTQLQIEISA-N	-1	0	373.463	2.716	50	0		FFAARM
CCc1ccc(NC(=O)[C@H](Cc2cccc(OC)c2)c2nnn[n-]2)cc1	ZINC000005444927	207100951	/nfs/dbraw/zinc/10/09/51/207100951.db2.gz	HQFKHCPNNQLYMT-QGZVFWFLSA-N	-1	0	351.410	2.736	50	0		FFAARM
CCOc1ccc(NC(=O)[C@H](Cc2cccc(OC)c2)c2nnn[n-]2)cc1	ZINC000005444541	207100112	/nfs/dbraw/zinc/10/01/12/207100112.db2.gz	VSCXAMVUCTZLEB-QGZVFWFLSA-N	-1	0	367.409	2.572	50	0		FFAARM
COc1ccccc1C[C@@H](C(=O)Nc1ccc(C)c(C)c1)c1nnn[n-]1	ZINC000005518448	207104264	/nfs/dbraw/zinc/10/42/64/207104264.db2.gz	DGYKVRZAZLCJDU-MRXNPFEDSA-N	-1	0	351.410	2.790	50	0		FFAARM
Cc1ccc(C)c(C(=O)COC(=O)c2ccccc2[N-]S(C)(=O)=O)c1	ZINC000005573609	207107104	/nfs/dbraw/zinc/10/71/04/207107104.db2.gz	USJNEXHUNKNGKS-UHFFFAOYSA-N	-1	0	361.419	2.715	50	0		FFAARM
CCOc1ccc(NC(=O)[C@H](Cc2ccccc2OC)c2nnn[n-]2)cc1	ZINC000005593070	207107600	/nfs/dbraw/zinc/10/76/00/207107600.db2.gz	APMISVWZPHDGTC-MRXNPFEDSA-N	-1	0	367.409	2.572	50	0		FFAARM
Cc1ccc(CN2CCN(C(=O)[C@@H]3C4CCC(CC4)[C@H]3C(=O)[O-])CC2)cc1	ZINC000006741076	207158516	/nfs/dbraw/zinc/15/85/16/207158516.db2.gz	KVZDBJRDXYZGOE-NTFDOXNWSA-N	-1	0	370.493	2.776	50	0		FFAARM
COc1ccc(-c2cn3nc(N4CCC[C@H](C(=O)[O-])C4)sc3n2)cc1	ZINC000006750923	207160509	/nfs/dbraw/zinc/16/05/09/207160509.db2.gz	SJWSVKJRBJJLTA-LBPRGKRZSA-N	-1	0	358.423	2.767	50	0		FFAARM
Cc1nc2sccn2c(=O)c1S(=O)(=O)[N-]c1ccc(F)cc1Cl	ZINC000006859782	207173004	/nfs/dbraw/zinc/17/30/04/207173004.db2.gz	VHAIRFOUEMKZPT-UHFFFAOYSA-N	-1	0	373.818	2.658	50	0		FFAARM
Cn1cc(C(=O)c2ccccc2[O-])cc1-c1nc(=O)c2sccc2[nH]1	ZINC000009458515	207272896	/nfs/dbraw/zinc/27/28/96/207272896.db2.gz	WCDXKFMSDSNNOQ-UHFFFAOYSA-N	-1	0	351.387	2.927	50	0		FFAARM
COc1cc2[nH]c(=O)c(C(=O)Nc3cccc(F)c3)c([O-])c2cc1OC	ZINC000009329572	207265540	/nfs/dbraw/zinc/26/55/40/207265540.db2.gz	PCKGCUPVVXXRMV-UHFFFAOYSA-N	-1	0	358.325	2.642	50	0		FFAARM
CC(C)C[C@@H](NS(=O)(=O)c1cccc2c1cccc2N(C)C)C(=O)[O-]	ZINC000030836184	208006627	/nfs/dbraw/zinc/00/66/27/208006627.db2.gz	XBMQRPDOXIPUFG-OAHLLOKOSA-N	-1	0	364.467	2.683	50	0		FFAARM
CCCc1nc2[n-]c(C)nn2c(=O)c1NC(=O)Nc1cccc(C(C)=O)c1	ZINC000033048568	208068965	/nfs/dbraw/zinc/06/89/65/208068965.db2.gz	RDYPTNMKTHTWKJ-UHFFFAOYSA-N	-1	0	368.397	2.937	50	0		FFAARM
CC[C@H](C)Oc1cccc(-c2nnc(CCC(=O)NC(C)C)c(=O)[n-]2)c1	ZINC000034764925	208109377	/nfs/dbraw/zinc/10/93/77/208109377.db2.gz	BDLGZYBSFQUNHN-ZDUSSCGKSA-N	-1	0	358.442	2.879	50	0		FFAARM
CO[N-]C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccccc1Cl	ZINC000037127650	208175594	/nfs/dbraw/zinc/17/55/94/208175594.db2.gz	OUXVCEVOAUPPGL-QGZVFWFLSA-N	-1	0	371.824	2.840	50	0		FFAARM
CC(C)=C[C@@H]1[C@H](C(=O)[N-]S(=O)(=O)c2ccc3c(c2)OCCO3)C1(C)C	ZINC000042267853	208290785	/nfs/dbraw/zinc/29/07/85/208290785.db2.gz	ZVTAAJWGRPQSJT-CZUORRHYSA-N	-1	0	365.451	2.501	50	0		FFAARM
Cc1oc(CNC(=O)c2ccccc2OC[C@@H]2CCCO2)cc1C(=O)[O-]	ZINC000299747420	208342725	/nfs/dbraw/zinc/34/27/25/208342725.db2.gz	CYGLMFUZZPSQMN-ZDUSSCGKSA-N	-1	0	359.378	2.774	50	0		FFAARM
O=C([O-])c1ccc(CCNC(=O)[C@@H]2C[C@H]2c2ccc3c(c2)OCCO3)cc1	ZINC000299748761	208344068	/nfs/dbraw/zinc/34/40/68/208344068.db2.gz	ICEBUTZXBQDAQE-DLBZAZTESA-N	-1	0	367.401	2.618	50	0		FFAARM
CNC(=O)c1ccc(NC(=O)c2ccc3c(c2)[n-]c(=S)[nH]c3=O)cc1	ZINC000047933152	208385553	/nfs/dbraw/zinc/38/55/53/208385553.db2.gz	GWURYNHMOPUBOY-UHFFFAOYSA-N	-1	0	354.391	2.610	50	0		FFAARM
CC1(C)[C@@H](C(=O)[O-])[C@@H]1C(=O)Nc1nc(-c2nc3ccccc3[nH]2)cs1	ZINC000071282987	208759845	/nfs/dbraw/zinc/75/98/45/208759845.db2.gz	HKTAXUCDVCQXCX-VXGBXAGGSA-N	-1	0	356.407	2.982	50	0		FFAARM
C[C@@H](CN(C(=O)c1cccc(OCc2cccnc2)c1)C1CC1)C(=O)[O-]	ZINC000095991925	209093709	/nfs/dbraw/zinc/09/37/09/209093709.db2.gz	LDMNUJZMEPSPLH-AWEZNQCLSA-N	-1	0	354.406	2.986	50	0		FFAARM
Cc1cc(C(=O)N(CCc2ccc(Cl)cc2Cl)CC(=O)[O-])ncn1	ZINC000095989444	209093374	/nfs/dbraw/zinc/09/33/74/209093374.db2.gz	VMYSZYSNJQHRDD-UHFFFAOYSA-N	-1	0	368.220	2.861	50	0		FFAARM
CCOCCN(Cc1ccc(C(=O)[O-])o1)C(=O)Cc1cc(F)ccc1F	ZINC000095969998	209091125	/nfs/dbraw/zinc/09/11/25/209091125.db2.gz	MOHXTXYSKQFGLL-UHFFFAOYSA-N	-1	0	367.348	2.864	50	0		FFAARM
O=C([O-])c1ccc([C@@H]2CCCN(S(=O)(=O)N3CCCCCC3)C2)cc1	ZINC000095366803	209031659	/nfs/dbraw/zinc/03/16/59/209031659.db2.gz	IPCDBDORDKYXOV-QGZVFWFLSA-N	-1	0	366.483	2.685	50	0		FFAARM
Cc1ccc(C)c(CC(=O)N2C[C@@H]3c4ccccc4OC[C@]3(C(=O)[O-])C2)c1	ZINC000095372871	209035414	/nfs/dbraw/zinc/03/54/14/209035414.db2.gz	JWGRZDCLJYQCPE-XMSQKQJNSA-N	-1	0	365.429	2.935	50	0		FFAARM
Cc1nn(C(F)F)c(C)c1CC(=O)N[C@@H](CC(=O)[O-])c1cccs1	ZINC000095377502	209039242	/nfs/dbraw/zinc/03/92/42/209039242.db2.gz	VMJWLAIWSFCOPX-NSHDSACASA-N	-1	0	357.382	2.831	50	0		FFAARM
Nc1ccnc(N2CCC(Oc3ccc4ccccc4c3)(C(=O)[O-])CC2)n1	ZINC000082146721	132197337	/nfs/dbraw/zinc/19/73/37/132197337.db2.gz	QHHHNNMYOHKWSI-UHFFFAOYSA-N	-1	0	364.405	2.715	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)C2(c3ccc(F)cc3)CC2)CCN1c1ccccc1	ZINC000095522668	132214348	/nfs/dbraw/zinc/21/43/48/132214348.db2.gz	WMBOXUASLUDUAN-SFHVURJKSA-N	-1	0	368.408	2.659	50	0		FFAARM
Cc1nccn1C1(C(=O)[O-])CCN(c2cccc(C(F)(F)F)n2)CC1	ZINC000072419778	132302962	/nfs/dbraw/zinc/30/29/62/132302962.db2.gz	MLHAENQUFZBKMP-UHFFFAOYSA-N	-1	0	354.332	2.686	50	0		FFAARM
CN1C[C@@]2(CCCN(c3nc(-c4ccccc4)ccc3C(=O)[O-])C2)OC1=O	ZINC000072407850	136145180	/nfs/dbraw/zinc/14/51/80/136145180.db2.gz	GWUDTPHUMYJEHC-HXUWFJFHSA-N	-1	0	367.405	2.868	50	0		FFAARM
Cc1ccnc(N2CCC(Oc3ccc4c(c3)OCO4)(C(=O)[O-])CC2)c1	ZINC000072428197	136146719	/nfs/dbraw/zinc/14/67/19/136146719.db2.gz	JLCLZUSJZKSLOU-UHFFFAOYSA-N	-1	0	356.378	2.621	50	0		FFAARM
Cc1n[nH]c(C)c1[C@@H](NC(=O)c1csc(Cc2ccccc2)n1)C(=O)[O-]	ZINC000095523890	209073927	/nfs/dbraw/zinc/07/39/27/209073927.db2.gz	LBRBSUFZFLAYMT-MRXNPFEDSA-N	-1	0	370.434	2.630	50	0		FFAARM
CCCNC(=O)[N-]S(=O)(=O)c1ccc(Nc2cccc(Cl)c2)nc1	ZINC000006184425	506471255	/nfs/dbraw/zinc/47/12/55/506471255.db2.gz	PYJICIRONUXOPA-UHFFFAOYSA-N	-1	0	368.846	2.877	50	0		FFAARM
COC(=O)c1scc(C)c1[N-]S(=O)(=O)c1ccc2c(c1)CCO2	ZINC000001030200	506243666	/nfs/dbraw/zinc/24/36/66/506243666.db2.gz	PJIMZCLGHDAJBY-UHFFFAOYSA-N	-1	0	353.421	2.579	50	0		FFAARM
COC(=O)c1scc(C)c1[N-]S(=O)(=O)c1ccc(NC(C)=O)cc1	ZINC000001027092	506244205	/nfs/dbraw/zinc/24/42/05/506244205.db2.gz	BUESFBAONSVXBM-UHFFFAOYSA-N	-1	0	368.436	2.602	50	0		FFAARM
Cc1ccc(OCC(=O)NC(=S)Nc2ccc(C(=O)[O-])cc2)cc1C	ZINC000001159194	506252246	/nfs/dbraw/zinc/25/22/46/506252246.db2.gz	UQWLUEIFFAEANO-UHFFFAOYSA-N	-1	0	358.419	2.894	50	0		FFAARM
CCOc1ccc(NC(=O)c2c([O-])c3cccc4c3n(c2=O)CC4)cc1	ZINC000001242090	506255998	/nfs/dbraw/zinc/25/59/98/506255998.db2.gz	HTXUSJXMKNYUAH-UHFFFAOYSA-N	-1	0	350.374	2.914	50	0		FFAARM
CC(C)=C(NC(=O)c1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)[O-]	ZINC000002099840	506271872	/nfs/dbraw/zinc/27/18/72/506271872.db2.gz	OCLPLEFZHZVIIQ-KRWDZBQOSA-N	-1	0	366.417	2.522	50	0	biogenic	FFAARM
Cc1cccc(-n2ncc3c2[nH]c(=O)c(C(=O)Nc2ccccc2)c3[O-])c1	ZINC000065250021	506275398	/nfs/dbraw/zinc/27/53/98/506275398.db2.gz	CRUYEWIGQQKVOA-UHFFFAOYSA-N	-1	0	360.373	2.980	50	0		FFAARM
O=C1NC[C@H](c2ccccc2)Cc2[n-]c(-c3nc(-c4cccnc4)no3)nc21	ZINC000065372182	506291386	/nfs/dbraw/zinc/29/13/86/506291386.db2.gz	GRXXBMZVTAPDRF-CQSZACIVSA-N	-1	0	372.388	2.591	50	0		FFAARM
Cn1cc(S(=O)(=O)[N-]c2cnn(Cc3cccc4ccccc43)c2)cn1	ZINC000002803860	506294762	/nfs/dbraw/zinc/29/47/62/506294762.db2.gz	NXULLKAJYZRMNT-UHFFFAOYSA-N	-1	0	367.434	2.619	50	0		FFAARM
O=C([O-])C1CCN(S(=O)(=O)c2cc(C(F)(F)F)ccc2Cl)CC1	ZINC000003369802	506325584	/nfs/dbraw/zinc/32/55/84/506325584.db2.gz	AMHMAMYBIAAUJE-UHFFFAOYSA-N	-1	0	371.764	2.844	50	0		FFAARM
O=C([O-])c1cccc(NC(=O)Cc2sc(Nc3ccccc3)nc2O)c1	ZINC000003423987	506328891	/nfs/dbraw/zinc/32/88/91/506328891.db2.gz	XUQMMNGYEROGAT-AWEZNQCLSA-N	-1	0	369.402	2.824	50	0		FFAARM
COc1ccc([C@H](CC(=O)NCc2ccco2)[N-]C(=O)C(F)(F)F)cc1	ZINC000003663528	506349568	/nfs/dbraw/zinc/34/95/68/506349568.db2.gz	RHSZNHSUYQVKLR-AWEZNQCLSA-N	-1	0	370.327	2.714	50	0		FFAARM
COc1ccc(C(N)=O)cc1[N-]S(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000003876830	506351389	/nfs/dbraw/zinc/35/13/89/506351389.db2.gz	DRJXCHZSJXONIG-UHFFFAOYSA-N	-1	0	362.451	2.892	50	0		FFAARM
O=C(/C=C\c1ccco1)Nc1ccc(S(=O)(=O)[N-]c2ncccn2)cc1	ZINC000033291078	506353246	/nfs/dbraw/zinc/35/32/46/506353246.db2.gz	PAWRMAUOBDTSLI-TWGQIWQCSA-N	-1	0	370.390	2.522	50	0		FFAARM
CC[C@@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C(=O)[O-])C(C)C	ZINC000004760124	506393066	/nfs/dbraw/zinc/39/30/66/506393066.db2.gz	XISNUVNLGJKNIK-VNQPRFMTSA-N	-1	0	364.442	2.553	50	0		FFAARM
COc1cc(NC(=O)c2c([O-])cc(F)cc2F)ccc1N1CCOC1=O	ZINC000066054047	506419676	/nfs/dbraw/zinc/41/96/76/506419676.db2.gz	NMUYVIZUVFXWQE-UHFFFAOYSA-N	-1	0	364.304	2.888	50	0		FFAARM
NC(=O)NCc1ccc([N-]S(=O)(=O)c2ccccc2C(F)(F)F)cc1	ZINC000067124155	506763883	/nfs/dbraw/zinc/76/38/83/506763883.db2.gz	FVONALBCUCBRAZ-UHFFFAOYSA-N	-1	0	373.356	2.675	50	0		FFAARM
Cc1ccc(S(=O)(=O)[N-]c2cccc(CN3CCOC3=O)c2)s1	ZINC000055609518	506797152	/nfs/dbraw/zinc/79/71/52/506797152.db2.gz	DLAPDHLZMIZIJD-UHFFFAOYSA-N	-1	0	352.437	2.810	50	0		FFAARM
Cc1n[nH]c(C)c1[C@H](NC(=O)c1cc2cccc(Cl)c2n1C)C(=O)[O-]	ZINC000067446935	506884943	/nfs/dbraw/zinc/88/49/43/506884943.db2.gz	AITLLACKSUKRLS-AWEZNQCLSA-N	-1	0	360.801	2.727	50	0		FFAARM
COc1ccc(OCCCC(=O)NCc2ccc(OC)c(C(=O)[O-])c2)cc1	ZINC000012775473	506899862	/nfs/dbraw/zinc/89/98/62/506899862.db2.gz	NTIWPKVSWZDOMV-UHFFFAOYSA-N	-1	0	373.405	2.877	50	0		FFAARM
C[C@@H](Sc1ccccc1C(=O)[O-])C(=O)N1CC(=O)Nc2ccccc21	ZINC000012858485	506909788	/nfs/dbraw/zinc/90/97/88/506909788.db2.gz	KAOTWCSCIBLWOQ-LLVKDONJSA-N	-1	0	356.403	2.851	50	0		FFAARM
CC[C@H](C(=O)OCC(=O)[N-]C(=O)c1ccccc1OC)c1ccccc1	ZINC000012980062	506920194	/nfs/dbraw/zinc/92/01/94/506920194.db2.gz	MXOURERVUZSPPZ-HNNXBMFYSA-N	-1	0	355.390	2.689	50	0		FFAARM
CS(=O)(=O)c1ccc(NC(=O)CSc2ccccc2C(=O)[O-])cc1	ZINC000012983546	506921845	/nfs/dbraw/zinc/92/18/45/506921845.db2.gz	RAJDJMVHLPZMLH-UHFFFAOYSA-N	-1	0	365.432	2.519	50	0		FFAARM
Cc1ccc(S(=O)(=O)Nc2cccc(N3CCCC3=O)c2)cc1C(=O)[O-]	ZINC000013032212	506925125	/nfs/dbraw/zinc/92/51/25/506925125.db2.gz	NSAYDVQWACUUJM-UHFFFAOYSA-N	-1	0	374.418	2.621	50	0		FFAARM
O=C([O-])[C@@H]1CC=CC[C@@H]1C(=O)Nc1cccc(I)c1	ZINC000013012562	506925662	/nfs/dbraw/zinc/92/56/62/506925662.db2.gz	HUTIEOAQYBWKQB-NWDGAFQWSA-N	-1	0	371.174	2.897	50	0		FFAARM
Cc1cccc(CNC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)[O-])c1	ZINC000013235640	506934189	/nfs/dbraw/zinc/93/41/89/506934189.db2.gz	YMEUYQJZIHEZAA-SFHVURJKSA-N	-1	0	351.406	2.971	50	0		FFAARM
CCn1nc(C(=O)[O-])c2c1CC[C@@H](N1CC(OCc3ccccc3C)C1)C2	ZINC000067770616	507004471	/nfs/dbraw/zinc/00/44/71/507004471.db2.gz	QVVNYIYIBSDKQC-MRXNPFEDSA-N	-1	0	369.465	2.668	50	0		FFAARM
CCCn1nc(C(=O)[O-])c2c1CC[C@@H](N1CC(Oc3cccc(C)c3)C1)C2	ZINC000067966901	507070971	/nfs/dbraw/zinc/07/09/71/507070971.db2.gz	PNOHVFGTBYQBFE-OAHLLOKOSA-N	-1	0	369.465	2.920	50	0		FFAARM
COc1cc2nc(O)c(C(=O)N[C@@H](C)c3ccccc3)c([O-])c2cc1OC	ZINC000017029090	507113815	/nfs/dbraw/zinc/11/38/15/507113815.db2.gz	YDSSPXRGUGAOQG-NSHDSACASA-N	-1	0	368.389	2.742	50	0	biogenic	FFAARM
CCCOC(=O)c1c(NC(=O)COCC(=O)[O-])sc2c1CCCCC2	ZINC000017075720	507114569	/nfs/dbraw/zinc/11/45/69/507114569.db2.gz	JKHSIZHIURGRGL-UHFFFAOYSA-N	-1	0	369.439	2.624	50	0		FFAARM
[O-]c1nnn(-c2ccccc2)c1CN1CCO[C@H](c2ccc(F)cc2)C1	ZINC000057086077	507170835	/nfs/dbraw/zinc/17/08/35/507170835.db2.gz	FSDGHRAZIDGUFS-SFHVURJKSA-N	-1	0	354.385	2.686	50	0		FFAARM
CCc1ccccc1NS(=O)(=O)c1cc2c(c(C(=O)[O-])c1)OCCO2	ZINC000057116213	507174417	/nfs/dbraw/zinc/17/44/17/507174417.db2.gz	PMFLTYDFPVDBHZ-UHFFFAOYSA-N	-1	0	363.391	2.519	50	0		FFAARM
CCc1ccc([N-]S(=O)(=O)c2cc(Br)cnc2N)cc1	ZINC000020467577	507223153	/nfs/dbraw/zinc/22/31/53/507223153.db2.gz	CQKZYUFUGRJXEV-UHFFFAOYSA-N	-1	0	356.245	2.790	50	0		FFAARM
Cc1cn2c(nc(C)c(S(=O)(=O)[N-]c3cc(C)cc(C)c3)c2=O)s1	ZINC000020921876	507237049	/nfs/dbraw/zinc/23/70/49/507237049.db2.gz	OFSPEAPEQKUFFU-UHFFFAOYSA-N	-1	0	363.464	2.790	50	0		FFAARM
O=C(CSc1nc(=O)c2sccc2[n-]1)Nc1ccc2c(c1)OCO2	ZINC000057477624	507275554	/nfs/dbraw/zinc/27/55/54/507275554.db2.gz	OGCMJJOYERQWBZ-UHFFFAOYSA-N	-1	0	361.404	2.856	50	0		FFAARM
CCc1nc2sc([C@H](c3cccc(C)c3)N3CCOCC3)c([O-])n2n1	ZINC000022854229	507315594	/nfs/dbraw/zinc/31/55/94/507315594.db2.gz	AQAJEQIPKXXNLO-HNNXBMFYSA-N	-1	0	358.467	2.789	50	0		FFAARM
CCS(=O)(=O)c1ccc([O-])c(NC(=O)Cc2c[nH]c3ccccc23)c1	ZINC000024152991	507394854	/nfs/dbraw/zinc/39/48/54/507394854.db2.gz	ZQKYQRARXYBGOY-UHFFFAOYSA-N	-1	0	358.419	2.848	50	0		FFAARM
CCOc1ccccc1CN(C)C(=O)c1ccc2c(c1)[n-]c(=S)[nH]c2=O	ZINC000069484642	507499618	/nfs/dbraw/zinc/49/96/18/507499618.db2.gz	AFLHRXCKSWHNHJ-UHFFFAOYSA-N	-1	0	369.446	2.883	50	0		FFAARM
COc1cc(C)c(S(=O)(=O)Nc2ccc(C(=O)[O-])cc2C)cc1OC	ZINC000026536731	507596582	/nfs/dbraw/zinc/59/65/82/507596582.db2.gz	UBFWRNGPDXUXMS-UHFFFAOYSA-N	-1	0	365.407	2.820	50	0		FFAARM
O=C([O-])c1ccccc1CC(=O)Nc1ccc(-n2cncn2)c(Cl)c1	ZINC000071279822	507699056	/nfs/dbraw/zinc/69/90/56/507699056.db2.gz	XOLGTJJVEKDXLC-UHFFFAOYSA-N	-1	0	356.769	2.800	50	0		FFAARM
COc1cc(OC)c(-n2nnc(C(=O)[O-])c2-c2ccncc2)cc1Cl	ZINC000071327486	507702695	/nfs/dbraw/zinc/70/26/95/507702695.db2.gz	ZHKLRTFFDOEMAI-UHFFFAOYSA-N	-1	0	360.757	2.698	50	0		FFAARM
O=C([O-])c1cc(C2=CCCCC2)cc(S(=O)(=O)NC[C@@H]2CCCO2)c1	ZINC000071770975	507714214	/nfs/dbraw/zinc/71/42/14/507714214.db2.gz	NJKSDPKTGPPKAD-INIZCTEOSA-N	-1	0	365.451	2.800	50	0		FFAARM
O=C([O-])[C@H]1CC=CC[C@@H]1C(=O)Nc1cccc(CN2CCCCC2=O)c1	ZINC000051186054	507748770	/nfs/dbraw/zinc/74/87/70/507748770.db2.gz	VNUPHNBKQPRWKO-IRXDYDNUSA-N	-1	0	356.422	2.805	50	0		FFAARM
COc1cc(NC(=O)CC2(C(=O)[O-])CCCC2)ccc1N1CCOC1=O	ZINC000063640243	507755106	/nfs/dbraw/zinc/75/51/06/507755106.db2.gz	FNVKYYUAPCIWIL-UHFFFAOYSA-N	-1	0	362.382	2.625	50	0		FFAARM
O=C([O-])[C@H]1c2nc[nH]c2CCN1C(=O)CCc1ccc(-c2cccs2)o1	ZINC000072424861	507788464	/nfs/dbraw/zinc/78/84/64/507788464.db2.gz	WUYVVYCYXFZFNT-QGZVFWFLSA-N	-1	0	371.418	2.874	50	0		FFAARM
COc1ccc(C(=O)N2CCC(Oc3ccc(C)cc3)(C(=O)[O-])CC2)o1	ZINC000072428775	507788983	/nfs/dbraw/zinc/78/89/83/507788983.db2.gz	YRXOTSMZCIZYOL-UHFFFAOYSA-N	-1	0	359.378	2.735	50	0		FFAARM
Cc1nnc(-c2cc(S(=O)(=O)[N-]c3ccc(F)c(Cl)c3)c[nH]2)o1	ZINC000075427939	508106538	/nfs/dbraw/zinc/10/65/38/508106538.db2.gz	BIRQWPKFXFHTIA-UHFFFAOYSA-N	-1	0	356.766	2.966	50	0		FFAARM
CCOc1ccc(-c2ccnc(N(C)Cc3cc(C)n[nH]3)n2)cc1C(=O)[O-]	ZINC000077438126	508315420	/nfs/dbraw/zinc/31/54/20/508315420.db2.gz	ROUIJYTWYJBEBC-UHFFFAOYSA-N	-1	0	367.409	2.908	50	0		FFAARM
CCCCC(=O)N1CCc2ccc(S(=O)(=O)[N-]c3cccnc3)cc2C1	ZINC000077469777	508320017	/nfs/dbraw/zinc/32/00/17/508320017.db2.gz	RKORGXBVKCTMTQ-UHFFFAOYSA-N	-1	0	373.478	2.957	50	0		FFAARM
O=C(c1ccc2[n-]c(=S)oc2c1)N1CCOC[C@H]1[C@H]1CCCCC1=O	ZINC000160522704	508998559	/nfs/dbraw/zinc/99/85/59/508998559.db2.gz	CMYIKAVMSGHPPK-OCCSQVGLSA-N	-1	0	360.435	2.717	50	0		FFAARM
CO[C@H](CNS(=O)(=O)C[C@@]12CC[C@@H](CC1=O)C2(C)C)c1ccsc1	ZINC000227663968	509412215	/nfs/dbraw/zinc/41/22/15/509412215.db2.gz	IKNYLXHDQBVQAF-VBQJREDUSA-N	-1	0	371.524	2.750	50	0		FFAARM
O=C([O-])[C@H]1CCCN(C(=O)C2CCN(c3nc4ccccc4s3)CC2)C1	ZINC000165380358	509569195	/nfs/dbraw/zinc/56/91/95/509569195.db2.gz	OCSFIRVUOAKSQQ-AWEZNQCLSA-N	-1	0	373.478	2.836	50	0		FFAARM
COc1cc(C)c(NS(=O)(=O)c2cc(F)ccc2C)c(C(=O)[O-])c1	ZINC000170078770	509666612	/nfs/dbraw/zinc/66/66/12/509666612.db2.gz	KRGVIBRYYABQIZ-UHFFFAOYSA-N	-1	0	353.371	2.950	50	0		FFAARM
Cc1noc(C)c1COc1ccccc1C(=O)N1CC[C@](C)(C(=O)[O-])C1	ZINC000237630561	509696440	/nfs/dbraw/zinc/69/64/40/509696440.db2.gz	HLSNRYXVVJQENQ-IBGZPJMESA-N	-1	0	358.394	2.807	50	0		FFAARM
O=C([O-])CCN(C(=O)Cc1cccc(C(F)(F)F)c1)C1CCOCC1	ZINC000238065755	509812223	/nfs/dbraw/zinc/81/22/23/509812223.db2.gz	NOIFGARMPQMNKA-UHFFFAOYSA-N	-1	0	359.344	2.730	50	0		FFAARM
CCOc1ccc(Cl)cc1S(=O)(=O)[N-]c1ccccc1C(N)=O	ZINC000252484754	509840885	/nfs/dbraw/zinc/84/08/85/509840885.db2.gz	GGSIWCNMHNTEMT-UHFFFAOYSA-N	-1	0	354.815	2.638	50	0		FFAARM
O=C([O-])c1cccc(-c2nc3c([nH]2)CCN(C(=O)Cc2ccccc2)C3)c1	ZINC000244707824	509865526	/nfs/dbraw/zinc/86/55/26/509865526.db2.gz	KIHOMIQOMXXIFV-UHFFFAOYSA-N	-1	0	361.401	2.902	50	0		FFAARM
COc1ccc(Cl)cc1NN=C(C#N)C(=O)Nc1ccc(C(=O)[O-])cc1	ZINC000254843094	509910242	/nfs/dbraw/zinc/91/02/42/509910242.db2.gz	YANWWKONPMFHPL-UHFFFAOYSA-N	-1	0	372.768	2.977	50	0		FFAARM
O=C([O-])[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)CCc1nnc(-c2ccccc2)o1	ZINC000265544331	510108701	/nfs/dbraw/zinc/10/87/01/510108701.db2.gz	FIRVKGSYFSHPBG-OAGGEKHMSA-N	-1	0	369.421	2.914	50	0		FFAARM
Cc1cc(C(=O)N2CC[C@H](C(=O)[O-])C2)c2ccc(Br)cc2n1	ZINC000178259001	510513612	/nfs/dbraw/zinc/51/36/12/510513612.db2.gz	XSUNORDWGRYGHI-JTQLQIEISA-N	-1	0	363.211	2.852	50	0		FFAARM
CC(C)n1c2ccccc2nc1[C@@H](C)NC(=O)c1cnc(C(=O)[O-])cn1	ZINC000263297945	510650587	/nfs/dbraw/zinc/65/05/87/510650587.db2.gz	SYFNLYYYGUMXQI-LLVKDONJSA-N	-1	0	353.382	2.596	50	0		FFAARM
COCC(=O)Nc1cc(C(=O)[O-])cc2ncn(CCc3ccccc3)c21	ZINC000299758298	511669654	/nfs/dbraw/zinc/66/96/54/511669654.db2.gz	OAURRSBMVUDANU-UHFFFAOYSA-N	-1	0	353.378	2.562	50	0		FFAARM
COc1ccc(COCCCC(=O)N2CCCC[C@@H]2c2n[nH]c(=O)[n-]2)cc1	ZINC000408518109	513084324	/nfs/dbraw/zinc/08/43/24/513084324.db2.gz	UPRLSHJASGGTQK-MRXNPFEDSA-N	-1	0	374.441	2.570	50	0		FFAARM
O=C([O-])CN(C(=O)/C=C\c1ccccc1OC(F)(F)F)C1CCOCC1	ZINC000606441077	521068433	/nfs/dbraw/zinc/06/84/33/521068433.db2.gz	CONYHIPARYZPBB-WAYWQWQTSA-N	-1	0	373.327	2.691	50	0		FFAARM
O=C([O-])c1ccc(/C=C\C(=O)N2CCC(OC3CCOCC3)CC2)cc1	ZINC000606441962	521068662	/nfs/dbraw/zinc/06/86/62/521068662.db2.gz	HKZRPEQZAJHKFM-UTCJRWHESA-N	-1	0	359.422	2.585	50	0		FFAARM
O=C([O-])c1ccccc1C1CCN(C(=O)NCc2ccc[nH]c2=O)CC1	ZINC000626778730	522440593	/nfs/dbraw/zinc/44/05/93/522440593.db2.gz	XSNRAWYJHYJEOZ-UHFFFAOYSA-N	-1	0	355.394	2.575	50	0		FFAARM
COc1ccc(-c2nc(CC(=O)N3CCC(C(=O)[O-])CC3)cs2)cc1	ZINC000020739431	523195287	/nfs/dbraw/zinc/19/52/87/523195287.db2.gz	NQXZTPIEIWSWPJ-UHFFFAOYSA-N	-1	0	360.435	2.684	50	0		FFAARM
CN1C(=O)C[C@@H](C(=O)N[C@@H](CC(=O)[O-])c2cccs2)c2ccccc21	ZINC000299746323	523699861	/nfs/dbraw/zinc/69/98/61/523699861.db2.gz	WQUOUMIJEYJKJL-OLZOCXBDSA-N	-1	0	358.419	2.530	50	0		FFAARM
COc1cccc([C@@H]2CN(C(=O)CSc3ccncc3)C[C@H]2C(=O)[O-])c1	ZINC000091535339	524120577	/nfs/dbraw/zinc/12/05/77/524120577.db2.gz	SUBJWNVVSZCICX-DLBZAZTESA-N	-1	0	372.446	2.509	50	0		FFAARM
Cc1ccccc1[C@@H](CC(=O)[O-])NC(=O)[C@@H]1CC(=O)Nc2cc(F)ccc21	ZINC000237596294	525364047	/nfs/dbraw/zinc/36/40/47/525364047.db2.gz	FGHCEKCYERRBTO-NVXWUHKLSA-N	-1	0	370.380	2.892	50	0		FFAARM
O=C([O-])[C@]1(NC(=O)OCC2c3ccccc3-c3ccccc32)CCOC1	ZINC000078679997	526338835	/nfs/dbraw/zinc/33/88/35/526338835.db2.gz	SRLUOBNBKTVLPZ-FQEVSTJZSA-N	-1	0	353.374	2.769	50	0		FFAARM
Cn1c(=O)c2ccc(C(=O)N[C@H]3CCCc4occc43)cc2[n-]c1=S	ZINC000102181463	570828183	/nfs/dbraw/zinc/82/81/83/570828183.db2.gz	HYBFHQHFTIKTNB-ZDUSSCGKSA-N	-1	0	355.419	2.623	50	0		FFAARM
COc1ccc(OC)c([N-]S(=O)(=O)c2ccc(-c3cc[nH]n3)s2)c1	ZINC000085664839	571124072	/nfs/dbraw/zinc/12/40/72/571124072.db2.gz	NKURLBFBKZLHQB-UHFFFAOYSA-N	-1	0	365.436	2.956	50	0		FFAARM
Cc1cc(C)c(S(=O)(=O)[N-]c2ncccc2C)cc1Br	ZINC000048044584	571129857	/nfs/dbraw/zinc/12/98/57/571129857.db2.gz	FRGCHJQORMCCCD-UHFFFAOYSA-N	-1	0	355.257	3.570	50	0		FFAARM
O=S(=O)([N-]c1cccc2ncccc12)c1cnn(C2CCOCC2)c1	ZINC000135729618	728738906	/nfs/dbraw/zinc/73/89/06/728738906.db2.gz	LQVRNGHVYDHECJ-UHFFFAOYSA-N	-1	0	358.423	2.584	50	0		FFAARM
O=C([O-])c1cn2c(n1)[C@H](c1ccccc1)N(C(=O)Cc1ccccc1)CC2	ZINC000675015157	971492468	/nfs/dbraw/zinc/49/24/68/971492468.db2.gz	MGVQXOXFEBWYTH-IBGZPJMESA-N	-1	0	361.401	2.756	50	0		FFAARM
COC(=O)CCCCC([O-])=C1C(=O)CC(C)(C)[C@H](c2cc(C)no2)C1=O	ZINC000105304182	975849187	/nfs/dbraw/zinc/84/91/87/975849187.db2.gz	UYYRYVLWZLNLTI-DLBZAZTESA-N	-1	0	363.410	2.553	50	0		FFAARM
Cc1ccc(-n2[n-]c(C(=O)N[C@@H]3CCC[C@@H](OC(F)F)C3)cc2=O)cc1	ZINC000888092759	976545963	/nfs/dbraw/zinc/54/59/63/976545963.db2.gz	ZIKCQLJSMSFYDV-TZMCWYRMSA-N	-1	0	365.380	2.754	50	0		FFAARM
COc1ccc(C(=O)/C=C/c2ccc3c(c2)NC(=O)CO3)cc1CC(=O)[O-]	ZINC000170610382	985093758	/nfs/dbraw/zinc/09/37/58/985093758.db2.gz	HEOORCZZWODKAA-GORDUTHDSA-N	-1	0	367.357	2.549	50	0		FFAARM
O=C([O-])COc1cccc(NC(=O)/C=C/c2ccc(-n3ccnc3)cc2)c1	ZINC000170592063	995110417	/nfs/dbraw/zinc/11/04/17/995110417.db2.gz	NJBHYPPJOKWDSJ-RMKNXTFCSA-N	-1	0	363.373	2.988	50	0		FFAARM
Cc1cc(C(=O)NCC2CCN(c3ccnc(C(=O)[O-])c3)CC2)c(C)o1	ZINC000952970364	1011016744	/nfs/dbraw/zinc/01/67/44/1011016744.db2.gz	RKRDDXGCUHUBFH-UHFFFAOYSA-N	-1	0	357.410	2.636	50	0		FFAARM
CN(C[C@H]1CCN(c2ccccc2)C1)C(=O)c1[n-]c(=O)nc2ccccc21	ZINC001506427365	1059514463	/nfs/dbraw/zinc/51/44/63/1059514463.db2.gz	XTKPMVMRDWDIQS-OAHLLOKOSA-N	-1	0	362.433	2.934	50	0		FFAARM
CCOc1ccc(Cc2c([O-])n(Cc3ccccc3)c(=O)[nH]c2=O)cc1	ZINC000001083568	219366094	/nfs/dbraw/zinc/36/60/94/219366094.db2.gz	AKJKGCHTRNXGLK-QGZVFWFLSA-N	-1	0	352.390	2.523	50	0		FFAARM
CC[C@H](C)Oc1c(Br)cc(/C=C2/NC(=O)[N-]C2=O)cc1OC	ZINC000001149235	219381332	/nfs/dbraw/zinc/38/13/32/219381332.db2.gz	MSLTUFNTPJJNDR-KIFNTFBYSA-N	-1	0	369.215	2.815	50	0		FFAARM
C[C@@H]1CN([C@H](c2sc3ncnn3c2[O-])c2cccc(F)c2)C[C@@H](C)O1	ZINC000022609558	209686633	/nfs/dbraw/zinc/68/66/33/209686633.db2.gz	VCWKKHRFLOLDAF-GYSYKLTISA-N	-1	0	362.430	2.834	50	0		FFAARM
CC1(C)CC[C@@H](CC(=O)[N-]S(=O)(=O)c2cnccn2)c2ccccc21	ZINC000152508695	209437496	/nfs/dbraw/zinc/43/74/96/209437496.db2.gz	JAHYJQWVXFFAMS-ZDUSSCGKSA-N	-1	0	359.451	2.527	50	0		FFAARM
COCCC1(CNC(=O)c2ccc3c(c2)[n-]c(=S)[nH]c3=O)CCCC1	ZINC000134301648	209373135	/nfs/dbraw/zinc/37/31/35/209373135.db2.gz	DLSSZZULDCTUIG-UHFFFAOYSA-N	-1	0	361.467	2.539	50	0		FFAARM
O=C([O-])CCN(C[C@@H]1CCCO1)C(=O)c1cc(F)ccc1Br	ZINC000238093187	209359523	/nfs/dbraw/zinc/35/95/23/209359523.db2.gz	UYGDYWVDJFACCI-NSHDSACASA-N	-1	0	374.206	2.684	50	0		FFAARM
O=C([O-])C1CCN(C(=O)CCc2ccc(Br)cc2F)CC1	ZINC000238102231	209359334	/nfs/dbraw/zinc/35/93/34/209359334.db2.gz	OPVYMWZODUIHFH-UHFFFAOYSA-N	-1	0	358.207	2.844	50	0		FFAARM
Cc1c(C(=O)N2CCC[C@H](CCC(=O)[O-])C2)cnn1Cc1ccccc1	ZINC000237752782	209354182	/nfs/dbraw/zinc/35/41/82/209354182.db2.gz	QCJYBBVNZKBWPB-QGZVFWFLSA-N	-1	0	355.438	2.957	50	0		FFAARM
C[C@H](CCc1ccccc1F)C(=O)N(CCC(=O)[O-])C1CCOCC1	ZINC000237520809	209350500	/nfs/dbraw/zinc/35/05/00/209350500.db2.gz	VYLVMIPSDYNUHG-CQSZACIVSA-N	-1	0	351.418	2.877	50	0		FFAARM
C[C@H](CC(=O)N1CCO[C@@H](CC(=O)[O-])C1)c1cccc(C(F)(F)F)c1	ZINC000237538447	209349936	/nfs/dbraw/zinc/34/99/36/209349936.db2.gz	MACDDXVAEUBKRQ-RISCZKNCSA-N	-1	0	359.344	2.901	50	0		FFAARM
C[C@H](CC(=O)N1CCO[C@H](CC(=O)[O-])C1)c1cccc(C(F)(F)F)c1	ZINC000237539029	209349861	/nfs/dbraw/zinc/34/98/61/209349861.db2.gz	MACDDXVAEUBKRQ-BXUZGUMPSA-N	-1	0	359.344	2.901	50	0		FFAARM
Cc1csc(C(=O)Nc2nnc(SCCN3CCOCC3)s2)c1	ZINC000042379274	209257208	/nfs/dbraw/zinc/25/72/08/209257208.db2.gz	MSLSGWIVXXQZGG-UHFFFAOYSA-N	-1	0	370.525	2.585	50	0		FFAARM
Cn1c(=O)c2ccc(C(=O)N[C@@H]3CCc4ccccc43)cc2[n-]c1=S	ZINC000102262585	209232970	/nfs/dbraw/zinc/23/29/70/209232970.db2.gz	AQORZMVEYBEGGM-OAHLLOKOSA-N	-1	0	351.431	2.640	50	0		FFAARM
Cc1ccc(Cc2c(C)nc3[n-]c(CNCc4ccccc4)nn3c2=O)cc1	ZINC000101802943	209231451	/nfs/dbraw/zinc/23/14/51/209231451.db2.gz	AWFWJKCVBUMUQV-UHFFFAOYSA-N	-1	0	373.460	2.915	50	0		FFAARM
COc1ccc(-n2c(=O)c3[n-][nH]n(Cc4cc(C)ccc4C)c=3c2=O)cc1	ZINC000101167330	209221817	/nfs/dbraw/zinc/22/18/17/209221817.db2.gz	NCBVPFXHKRDSBD-ROUUACIJSA-N	-1	0	364.405	2.805	50	0		FFAARM
COc1cccc([C@@H](C2=C([O-])COC2=O)c2cc3c(cc2O)OCO3)c1	ZINC000100695830	209216574	/nfs/dbraw/zinc/21/65/74/209216574.db2.gz	PVYFFSQPIZEDHW-QGZVFWFLSA-N	-1	0	356.330	2.630	50	0		FFAARM
CC[C@@H]1CN(Cc2cc(-c3cccnc3)ccc2OCC(=O)[O-])CCO1	ZINC000097655517	209192073	/nfs/dbraw/zinc/19/20/73/209192073.db2.gz	NCNUHLXTMHEUKW-GOSISDBHSA-N	-1	0	356.422	2.823	50	0		FFAARM
O=C([O-])c1cc2c(cc1NS(=O)(=O)/C=C\c1ccccc1)OCCO2	ZINC000096852305	209159164	/nfs/dbraw/zinc/15/91/64/209159164.db2.gz	VBYRKRQKRUXMFC-TWGQIWQCSA-N	-1	0	361.375	2.569	50	0		FFAARM
Cc1ccc(NC(=O)c2c[nH]nc2S(=O)(=O)[N-]c2ccccc2)c(F)c1	ZINC000096361070	209151271	/nfs/dbraw/zinc/15/12/71/209151271.db2.gz	JNJJVADIYPBQEB-UHFFFAOYSA-N	-1	0	374.397	2.910	50	0		FFAARM
CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@H]1CC[C@H](C(=O)[O-])CC1	ZINC000245328559	206787684	/nfs/dbraw/zinc/78/76/84/206787684.db2.gz	VEJRBKPBIUXEBF-KKUMJFAQSA-N	-1	0	370.490	2.933	50	0		FFAARM
Cc1ccc(-c2csc(NC(=O)CSc3nncc(=O)[n-]3)n2)cc1	ZINC000004317424	207012544	/nfs/dbraw/zinc/01/25/44/207012544.db2.gz	MHCUEBOTMVOQNG-UHFFFAOYSA-N	-1	0	359.436	2.740	50	0		FFAARM
CCc1ccc(Cn2[nH][n-]c3c(=O)n(-c4ccc(F)cc4)c(=O)c2=3)cc1	ZINC000004483496	207021440	/nfs/dbraw/zinc/02/14/40/207021440.db2.gz	UUMNYXAVKLUMKN-SJORKVTESA-N	-1	0	352.369	2.882	50	0		FFAARM
COc1ccccc1C[C@@H](C(=O)Nc1cc(C)ccc1C)c1nnn[n-]1	ZINC000005489230	207103029	/nfs/dbraw/zinc/10/30/29/207103029.db2.gz	VBHBDJYYPSIFOM-OAHLLOKOSA-N	-1	0	351.410	2.790	50	0		FFAARM
CC[C@]1(C)NC(=O)N([N-]C(=O)c2ccccc2Oc2ccccc2)C1=O	ZINC000006589018	207147286	/nfs/dbraw/zinc/14/72/86/207147286.db2.gz	ZSOHCMPJGHSAPM-IBGZPJMESA-N	-1	0	353.378	2.844	50	0		FFAARM
CC(=O)c1cccc(S(=O)(=O)[N-]c2cc3c(cc2C(C)=O)OCO3)c1	ZINC000006623297	207150137	/nfs/dbraw/zinc/15/01/37/207150137.db2.gz	UNNBKDPHYQBTGD-UHFFFAOYSA-N	-1	0	361.375	2.621	50	0		FFAARM
O=C([O-])[C@H]1CC=CC[C@H]1C(=O)Nc1sccc1C(=O)N1CCCCC1	ZINC000006741066	207159308	/nfs/dbraw/zinc/15/93/08/207159308.db2.gz	JCPCOLWZLFRBDB-OLZOCXBDSA-N	-1	0	362.451	2.980	50	0		FFAARM
O=C([O-])[C@@H]1CCCC[C@@H]1C(=O)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000006742288	207160079	/nfs/dbraw/zinc/16/00/79/207160079.db2.gz	BBIVYBWGMMORSX-DLBZAZTESA-N	-1	0	364.873	2.875	50	0		FFAARM
Cc1csc2nc(C)c(S(=O)(=O)[N-]CCC3=CCCCC3)c(=O)n12	ZINC000006823671	207169973	/nfs/dbraw/zinc/16/99/73/207169973.db2.gz	XILCLOZQPTWARP-UHFFFAOYSA-N	-1	0	367.496	2.542	50	0		FFAARM
Cc1cnc(C(=O)[N-]n2c(C)nc3sc4c(c3c2=O)CCCCC4)cn1	ZINC000007979127	207213272	/nfs/dbraw/zinc/21/32/72/207213272.db2.gz	WURBMPDZTWQCCP-UHFFFAOYSA-N	-1	0	369.450	2.518	50	0		FFAARM
O=C1Cc2cc(S(=O)(=O)[N-]c3ccccc3OC(F)(F)F)ccc2N1	ZINC000008778938	207248956	/nfs/dbraw/zinc/24/89/56/207248956.db2.gz	OKNLXRCWJHDHHD-UHFFFAOYSA-N	-1	0	372.324	2.881	50	0		FFAARM
O=C(Cn1cnc2ccccc21)n1cc(C(=O)c2cc(F)ccc2[O-])cn1	ZINC000012548359	207392143	/nfs/dbraw/zinc/39/21/43/207392143.db2.gz	LSXDHZMNUSKIQE-UHFFFAOYSA-N	-1	0	364.336	2.649	50	0		FFAARM
C/C=C/CC(=O)N1CCC(n2cc(-c3cccc(C(=O)[O-])c3)nn2)CC1	ZINC000020911388	207756815	/nfs/dbraw/zinc/75/68/15/207756815.db2.gz	CPXKPDUTJCZWFB-NSCUHMNNSA-N	-1	0	354.410	2.773	50	0		FFAARM
CNC(=O)c1cccc(NC(=O)C[C@@](C)(C(=O)[O-])c2ccccc2)c1C	ZINC000030522269	208002272	/nfs/dbraw/zinc/00/22/72/208002272.db2.gz	OGMOVJBDMFBDDC-HXUWFJFHSA-N	-1	0	354.406	2.726	50	0		FFAARM
Cc1n[nH]c(C)c1[C@H](NC(=O)c1c(C)c2cc(F)ccc2n1C)C(=O)[O-]	ZINC000067650053	208015986	/nfs/dbraw/zinc/01/59/86/208015986.db2.gz	PGIHWRJMPHTUAF-HNNXBMFYSA-N	-1	0	358.373	2.521	50	0		FFAARM
COc1cc2c(cc1OC)[C@H](C(=O)[O-])[C@H]1c3ccccc3CCN1C2=O	ZINC000032916815	208055941	/nfs/dbraw/zinc/05/59/41/208055941.db2.gz	XWMZLQGDUVBINT-ZWKOTPCHSA-N	-1	0	353.374	2.625	50	0		FFAARM
COc1ccc([N-]S(=O)(=O)c2cc(C(=O)N(C)C)ccc2Cl)cc1	ZINC000033026278	208066195	/nfs/dbraw/zinc/06/61/95/208066195.db2.gz	WPEPKHPATVMASC-UHFFFAOYSA-N	-1	0	368.842	2.851	50	0		FFAARM
CC(=O)Nc1nc2cc([N-]S(=O)(=O)c3c(C)noc3C)ccc2s1	ZINC000033116457	208073042	/nfs/dbraw/zinc/07/30/42/208073042.db2.gz	RJGKFQYHSGINHI-UHFFFAOYSA-N	-1	0	366.424	2.660	50	0		FFAARM
O=C([O-])Cn1cc([C@@H](C(=O)[O-])[NH+]2CCCCC2)c2ccc(Cl)cc21	ZINC000036365414	208159678	/nfs/dbraw/zinc/15/96/78/208159678.db2.gz	NBZDNITZYAJBEV-INIZCTEOSA-N	-1	0	350.802	2.991	50	0		FFAARM
C[C@@H]1C[C@H](C)C[N@H+]([C@H](C(=O)[O-])c2cn(CC(=O)[O-])c3cc(F)ccc23)C1	ZINC000036358520	208156893	/nfs/dbraw/zinc/15/68/93/208156893.db2.gz	POUAEAIOQXDTMT-IUUKEHGRSA-N	-1	0	362.401	2.969	50	0		FFAARM
COCc1ccccc1NS(=O)(=O)c1cc(C(=O)[O-])cc(F)c1C	ZINC000071798581	208185346	/nfs/dbraw/zinc/18/53/46/208185346.db2.gz	ZHPYDEBUOLYJAZ-UHFFFAOYSA-N	-1	0	353.371	2.780	50	0		FFAARM
COc1cc(NC(=O)CCc2nc3ccccc3[nH]2)c(C(=O)[O-])cc1OC	ZINC000072325313	208186504	/nfs/dbraw/zinc/18/65/04/208186504.db2.gz	PNHMZXAUEXYJGL-UHFFFAOYSA-N	-1	0	369.377	2.850	50	0	biogenic	FFAARM
CCOC(=O)c1[nH]c(C)c(S(=O)(=O)[N-]c2ccccc2OC)c1C	ZINC000075348060	208194294	/nfs/dbraw/zinc/19/42/94/208194294.db2.gz	TUIVXPXQRGZHSS-UHFFFAOYSA-N	-1	0	352.412	2.618	50	0		FFAARM
O=C([O-])[C@H]1CN(S(=O)(=O)c2cc(F)ccc2Cl)c2ccccc21	ZINC000078824171	208202619	/nfs/dbraw/zinc/20/26/19/208202619.db2.gz	MSONNDUZJAZXIC-NSHDSACASA-N	-1	0	355.774	2.856	50	0		FFAARM
COc1ccc(Oc2cc(NC(=O)COCC(=O)[O-])ccc2OC)cc1	ZINC000040040192	208219836	/nfs/dbraw/zinc/21/98/36/208219836.db2.gz	ISKWJACXNDXZPX-UHFFFAOYSA-N	-1	0	361.350	2.536	50	0		FFAARM
COc1cccc2c1ccn2CCC(=O)N[C@@H](C(=O)[O-])c1ccccc1	ZINC000040287300	208244774	/nfs/dbraw/zinc/24/47/74/208244774.db2.gz	NMJGGWUTYZPAAJ-LJQANCHMSA-N	-1	0	352.390	2.982	50	0		FFAARM
CC[C@@H](C)N(C(=O)CS(=O)(=O)c1nc2ccccc2[n-]1)[C@H](C)CC	ZINC000040152115	208235419	/nfs/dbraw/zinc/23/54/19/208235419.db2.gz	AQDJYRVBSYEDHY-CHWSQXEVSA-N	-1	0	351.472	2.762	50	0		FFAARM
COc1ccc(S(=O)(=O)[N-]C(=O)[C@H]2[C@H](C=C(C)C)C2(C)C)cc1OC	ZINC000042295057	208290202	/nfs/dbraw/zinc/29/02/02/208290202.db2.gz	WVMXLKXRMGDETI-XJKSGUPXSA-N	-1	0	367.467	2.747	50	0		FFAARM
CCOc1cc(C(=O)N2CCC[C@H]2C(=O)[O-])ccc1OCc1ccncc1	ZINC000299743348	208337850	/nfs/dbraw/zinc/33/78/50/208337850.db2.gz	KLGMPOIUOKVIQH-INIZCTEOSA-N	-1	0	370.405	2.749	50	0		FFAARM
O=C([O-])c1cccc(CNC(=O)C[C@@H]2Sc3ccccc3NC2=O)c1	ZINC000299744964	208339437	/nfs/dbraw/zinc/33/94/37/208339437.db2.gz	QHOUFIFPINEDFV-HNNXBMFYSA-N	-1	0	356.403	2.504	50	0		FFAARM
O=C([O-])[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1OCCc2ccccc21	ZINC000299743745	208339781	/nfs/dbraw/zinc/33/97/81/208339781.db2.gz	LZMGZBQTOBXXPZ-RBUKOAKNSA-N	-1	0	364.401	2.594	50	0		FFAARM
O=C([O-])CCN(C[C@@H]1CCCO1)C(=O)[C@H]1C[C@H]1c1c(F)cccc1F	ZINC000299747143	208340373	/nfs/dbraw/zinc/34/03/73/208340373.db2.gz	CCHKOIYYXZQFDD-XQQFMLRXSA-N	-1	0	353.365	2.551	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)c1ccc2c(c1)NC(=O)CS2)c1ccc(F)cc1	ZINC000299744943	208340833	/nfs/dbraw/zinc/34/08/33/208340833.db2.gz	QEQCAASFIFATNC-ZDUSSCGKSA-N	-1	0	374.393	2.816	50	0		FFAARM
O=C([O-])[C@H]1CCCN1CC(=O)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000299738574	208325029	/nfs/dbraw/zinc/32/50/29/208325029.db2.gz	CGYIKPPFNADDOF-RTBURBONSA-N	-1	0	352.434	2.636	50	0		FFAARM
COc1cccc2c(C)c(C(=O)N(CCC(=O)[O-])C[C@H]3CCCO3)oc21	ZINC000299749003	208354800	/nfs/dbraw/zinc/35/48/00/208354800.db2.gz	IWDYYSLBLNBRBQ-CYBMUJFWSA-N	-1	0	361.394	2.846	50	0		FFAARM
O=C([O-])CN(CCc1ccc(Cl)cc1Cl)C(=O)C[C@@H]1CCOC1	ZINC000299751677	208358226	/nfs/dbraw/zinc/35/82/26/208358226.db2.gz	RGNRQOFYGHKXQZ-NSHDSACASA-N	-1	0	360.237	2.876	50	0		FFAARM
CN(CCC(=O)[O-])C(=O)[C@@H](c1cccc(Br)c1)N1CCCC1	ZINC000299750614	208359356	/nfs/dbraw/zinc/35/93/56/208359356.db2.gz	OBUGRWSHDXYJNH-OAHLLOKOSA-N	-1	0	369.259	2.519	50	0		FFAARM
O=C(NC[C@H]1COc2ccccc2C1)c1ccc2c(c1)[n-]c(=S)[nH]c2=O	ZINC000047060440	208372031	/nfs/dbraw/zinc/37/20/31/208372031.db2.gz	JTAQMVJKWIMXDV-NSHDSACASA-N	-1	0	367.430	2.979	50	0		FFAARM
O=C([O-])c1ccccc1CC(=O)Nc1nnc(-c2ccc(O)cc2)s1	ZINC000071287657	208761759	/nfs/dbraw/zinc/76/17/59/208761759.db2.gz	HWQFFXLBYFDRBV-UHFFFAOYSA-N	-1	0	355.375	2.790	50	0		FFAARM
COc1cc(CN2CC[C@](C)(O)C(C)(C)C2)cc(Cl)c1OCC(=O)[O-]	ZINC000091907815	209004601	/nfs/dbraw/zinc/00/46/01/209004601.db2.gz	KXTYSSSQEKBRJW-SFHVURJKSA-N	-1	0	371.861	2.795	50	0		FFAARM
COCCN(CCC(=O)[O-])C(=O)c1cc(Br)ccc1Cl	ZINC000095970048	209092009	/nfs/dbraw/zinc/09/20/09/209092009.db2.gz	NBWBORBYOQSTJW-UHFFFAOYSA-N	-1	0	364.623	2.666	50	0		FFAARM
Cc1c(C(=O)N2CC[C@](F)(C(=O)[O-])C2)sc2nc(C3CC3)nc(C)c12	ZINC000095970843	209091816	/nfs/dbraw/zinc/09/18/16/209091816.db2.gz	YTZOYWKWOYUHAI-QGZVFWFLSA-N	-1	0	363.414	2.824	50	0		FFAARM
Cc1nn(C)c2nc(C(C)C)cc(C(=O)NC3(C(=O)[O-])CCCCC3)c12	ZINC000095349566	209022319	/nfs/dbraw/zinc/02/23/19/209022319.db2.gz	MWYSOFOTWQVSSL-UHFFFAOYSA-N	-1	0	358.442	2.917	50	0		FFAARM
Cc1nc(N(C)C)ncc1C(=O)N1CCC[C@@H](c2ccc(C(=O)[O-])cc2)C1	ZINC000095354662	209024252	/nfs/dbraw/zinc/02/42/52/209024252.db2.gz	IDWGXVFZRIBFJZ-MRXNPFEDSA-N	-1	0	368.437	2.569	50	0		FFAARM
O=C([O-])c1cccc([C@H]2CCCN(C(=O)c3nnc4n3CCCCC4)C2)c1	ZINC000095362463	209029500	/nfs/dbraw/zinc/02/95/00/209029500.db2.gz	ASYZCHGBYDFVIZ-INIZCTEOSA-N	-1	0	368.437	2.723	50	0		FFAARM
Cc1cc(C(=O)N2CCc3[nH]cnc3[C@@H]2C(=O)[O-])c(-c2ccccc2)o1	ZINC000095387004	209044869	/nfs/dbraw/zinc/04/48/69/209044869.db2.gz	PQNCINHJDVPKQX-MRXNPFEDSA-N	-1	0	351.362	2.802	50	0		FFAARM
CCOc1cc(F)cc([C@H](C(=O)[O-])N2CCN(Cc3ccccn3)CC2)c1	ZINC000095386921	209043317	/nfs/dbraw/zinc/04/33/17/209043317.db2.gz	MPKMOVUJYAMYGV-LJQANCHMSA-N	-1	0	373.428	2.563	50	0		FFAARM
O=C([O-])c1cccc(C[C@H]2CCN(C(=O)CCCN3CCCCC3=O)C2)c1	ZINC000095386707	209043659	/nfs/dbraw/zinc/04/36/59/209043659.db2.gz	CYFYBCHGUHYCRK-QGZVFWFLSA-N	-1	0	372.465	2.569	50	0		FFAARM
CN(CCOc1cccc(F)c1)C(=O)c1cc(C(=O)[O-])cc([N+](=O)[O-])c1	ZINC000095424314	209049126	/nfs/dbraw/zinc/04/91/26/209049126.db2.gz	JTZQCWFLCIVUFE-UHFFFAOYSA-N	-1	0	362.313	2.583	50	0		FFAARM
COc1cc(C(=O)N[C@H](CC(=O)[O-])c2cccs2)ccc1[N+](=O)[O-]	ZINC000095424197	209049723	/nfs/dbraw/zinc/04/97/23/209049723.db2.gz	MSVYTNVIHXLZGW-SNVBAGLBSA-N	-1	0	350.352	2.611	50	0		FFAARM
C[C@H](C(=O)N(C)C)S(=O)(=O)[N-]c1ccc(Cl)cc1C(F)(F)F	ZINC000278624544	256332577	/nfs/dbraw/zinc/33/25/77/256332577.db2.gz	SSNOIPKGWIZGKH-SSDOTTSWSA-N	-1	0	358.769	2.577	50	0		FFAARM
Cc1ccc2nc(C(=O)N3Cc4[nH]c5ccccc5c4C[C@H]3C(=O)[O-])cn2c1	ZINC000095517196	209070568	/nfs/dbraw/zinc/07/05/68/209070568.db2.gz	MBQHRGAYRVIQQU-SFHVURJKSA-N	-1	0	374.400	2.776	50	0		FFAARM
CN1c2ccccc2C([O-])=C(C(=O)Nc2ccc(Cl)cc2)S1(=O)=O	ZINC000006002620	132831200	/nfs/dbraw/zinc/83/12/00/132831200.db2.gz	PFZUWXMAFYYNNC-UHFFFAOYSA-N	-1	0	364.810	2.985	50	0		FFAARM
Cc1ccccc1N1CCN(c2ccccc2NC(=O)/C=C\C(=O)[O-])CC1	ZINC000033294738	132931639	/nfs/dbraw/zinc/93/16/39/132931639.db2.gz	BDQAIZFJKVJOKE-KHPPLWFESA-N	-1	0	365.433	2.901	50	0		FFAARM
CCOc1ccc([N-]S(=O)(=O)c2ccccc2C(=O)OC)cc1OC	ZINC000007109350	263349310	/nfs/dbraw/zinc/34/93/10/263349310.db2.gz	DUKNIAPNOLFTLZ-UHFFFAOYSA-N	-1	0	365.407	2.681	50	0		FFAARM
O=C(N=C([O-])C(F)(F)F)Nc1ccc(I)cc1	ZINC000000646534	506226502	/nfs/dbraw/zinc/22/65/02/506226502.db2.gz	SBRVDRBRKYBORK-UHFFFAOYSA-N	-1	0	358.057	2.502	50	0		FFAARM
C[C@@H]1CCc2c(sc(NC(=O)c3cccc(C(=O)[O-])c3)c2C(N)=O)C1	ZINC000001190434	506254717	/nfs/dbraw/zinc/25/47/17/506254717.db2.gz	YWNPSMVMVWEYHX-SECBINFHSA-N	-1	0	358.419	2.922	50	0		FFAARM
CCCC[C@H](NS(=O)(=O)c1cccc2c1cccc2N(C)C)C(=O)[O-]	ZINC000002545086	506282130	/nfs/dbraw/zinc/28/21/30/506282130.db2.gz	OGHUUPAEGJCGAK-HNNXBMFYSA-N	-1	0	364.467	2.828	50	0		FFAARM
CC[C@@H](C(=O)Nc1cc(S(=O)(=O)CC)ccc1[O-])n1cc(Cl)cn1	ZINC000002804785	506294470	/nfs/dbraw/zinc/29/44/70/506294470.db2.gz	HPMPNRPKEJYKAM-ZDUSSCGKSA-N	-1	0	371.846	2.626	50	0		FFAARM
O=C(CCn1c(=O)c2ccccc2[n-]c1=S)NCc1ccc(F)cc1	ZINC000003043466	506307258	/nfs/dbraw/zinc/30/72/58/506307258.db2.gz	OIKYTOJKMSIFRP-UHFFFAOYSA-N	-1	0	357.410	2.905	50	0		FFAARM
C[C@H](COc1cccc(F)c1)NC(=O)c1ccc2c(c1)[n-]c(=S)[nH]c2=O	ZINC000065478665	506307336	/nfs/dbraw/zinc/30/73/36/506307336.db2.gz	RVPQKCDYCVFVDW-SNVBAGLBSA-N	-1	0	373.409	2.548	50	0		FFAARM
Cc1ccc(S(=O)(=O)[N-]C(=O)Nc2nc3c(s2)CCCC3)cc1	ZINC000003169860	506311257	/nfs/dbraw/zinc/31/12/57/506311257.db2.gz	RSVUOZQJFPHHEA-UHFFFAOYSA-N	-1	0	351.453	2.841	50	0		FFAARM
CC(=O)N1CCSc2ccc(S(=O)(=O)[N-]c3cccc(C)n3)cc21	ZINC000032943680	506316769	/nfs/dbraw/zinc/31/67/69/506316769.db2.gz	RYDOCXFZCMEBDC-UHFFFAOYSA-N	-1	0	363.464	2.649	50	0		FFAARM
COc1ccc([C@@H](CC(=O)[O-])NC(=O)COc2ccc(C)cc2)cc1OC	ZINC000003626939	506347591	/nfs/dbraw/zinc/34/75/91/506347591.db2.gz	JQCVNOVDPXPNES-MRXNPFEDSA-N	-1	0	373.405	2.723	50	0		FFAARM
COc1ccc(N2C(=O)[N-]C(=O)C(=C(C)Nc3ccc(F)cc3)C2=O)cc1	ZINC000005070610	506419015	/nfs/dbraw/zinc/41/90/15/506419015.db2.gz	NOAKOJQXUMVANS-WJDWOHSUSA-N	-1	0	369.352	2.803	50	0		FFAARM
COC([O-])=NC(=O)c1c(C)c(C)sc1NC(=O)COc1ccccc1	ZINC000005145084	506424759	/nfs/dbraw/zinc/42/47/59/506424759.db2.gz	IQOMOPABPKFVKS-UHFFFAOYSA-N	-1	0	362.407	2.879	50	0		FFAARM
Cc1oc2c(c1C)c(C)cc1oc(=O)c(CC(=O)NCC(=O)[O-])c(C)c21	ZINC000006624258	506492318	/nfs/dbraw/zinc/49/23/18/506492318.db2.gz	IQRXYUFMGJRXPC-UHFFFAOYSA-N	-1	0	357.362	2.516	50	0	biogenic	FFAARM
Cc1ccccc1-n1nnnc1SCc1nc(=O)c2sccc2[n-]1	ZINC000006619275	506492612	/nfs/dbraw/zinc/49/26/12/506492612.db2.gz	UZTRVOBOLORVRQ-UHFFFAOYSA-N	-1	0	356.436	2.561	50	0		FFAARM
COc1cc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2C)cc(OC)c1	ZINC000007708399	506584053	/nfs/dbraw/zinc/58/40/53/506584053.db2.gz	BFUASUBQFCCDDH-UHFFFAOYSA-N	-1	0	351.380	2.511	50	0		FFAARM
O=S(=O)([N-]c1cc(Cl)ccc1-n1cncn1)c1ccc(F)cc1	ZINC000008053024	506617368	/nfs/dbraw/zinc/61/73/68/506617368.db2.gz	MSIPWVKVSZYKSV-UHFFFAOYSA-N	-1	0	352.778	2.861	50	0		FFAARM
Cc1ccc(N[C@](C)(C(=O)NCCCc2nnn[n-]2)c2ccccc2)cc1	ZINC000055211541	506699113	/nfs/dbraw/zinc/69/91/13/506699113.db2.gz	SPWSZQIHGQAESV-FQEVSTJZSA-N	-1	0	364.453	2.584	50	0		FFAARM
COc1ccc(Cl)cc1S(=O)(=O)[N-]c1ccc2c(c1)CC(=O)N2C	ZINC000009572750	506703556	/nfs/dbraw/zinc/70/35/56/506703556.db2.gz	ZMFRCSIKOAFANX-UHFFFAOYSA-N	-1	0	366.826	2.668	50	0		FFAARM
Cc1cc(C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)[O-])c2cccc(C)c2n1	ZINC000055244506	506706815	/nfs/dbraw/zinc/70/68/15/506706815.db2.gz	CMEVLLVSJUPRFD-SFHVURJKSA-N	-1	0	364.401	2.983	50	0		FFAARM
COc1cc([N-]S(=O)(=O)c2cc(F)ccc2F)ccc1NC(C)=O	ZINC000055616105	506798514	/nfs/dbraw/zinc/79/85/14/506798514.db2.gz	VHJBZFPCBOXFSF-UHFFFAOYSA-N	-1	0	356.350	2.733	50	0		FFAARM
CCOC(=O)[C@@H](CC)SC1=Nc2ccc(Cl)cc2S(=O)(=O)[N-]1	ZINC000012361137	506853271	/nfs/dbraw/zinc/85/32/71/506853271.db2.gz	LMJOMRZLWWGNNV-SNVBAGLBSA-N	-1	0	362.860	2.885	50	0		FFAARM
CCn1cc(-c2nnc(SCC(=O)[O-])n2[C@H](C)c2ccccc2)cn1	ZINC000067433548	506878313	/nfs/dbraw/zinc/87/83/13/506878313.db2.gz	ZUYRSZJEXVCMRZ-GFCCVEGCSA-N	-1	0	357.439	2.948	50	0		FFAARM
C[C@H](Sc1ccccc1C(=O)[O-])C(=O)N1CC(=O)Nc2ccccc21	ZINC000012858496	506909613	/nfs/dbraw/zinc/90/96/13/506909613.db2.gz	KAOTWCSCIBLWOQ-NSHDSACASA-N	-1	0	356.403	2.851	50	0		FFAARM
C[C@H](Sc1ccccc1C(=O)[O-])C(=O)NCc1ccc2c(c1)OCO2	ZINC000012978261	506919932	/nfs/dbraw/zinc/91/99/32/506919932.db2.gz	XXWQWDLPKIVLLR-NSHDSACASA-N	-1	0	359.403	2.911	50	0		FFAARM
Cc1ccsc1CN(C)S(=O)(=O)c1ccc(CCC(=O)[O-])cc1	ZINC000013088994	506928336	/nfs/dbraw/zinc/92/83/36/506928336.db2.gz	TXUJXFHWEFSYBV-UHFFFAOYSA-N	-1	0	353.465	2.894	50	0		FFAARM
COc1ccc(C(=O)N2CCC(C(=O)[O-])(c3ccccc3)CC2)c(OC)c1	ZINC000013185361	506932443	/nfs/dbraw/zinc/93/24/43/506932443.db2.gz	JPTYJJDWZAGACL-UHFFFAOYSA-N	-1	0	369.417	2.962	50	0		FFAARM
O=C([O-])c1cc(Br)ccc1NS(=O)(=O)c1ccccc1	ZINC000013342845	506939687	/nfs/dbraw/zinc/93/96/87/506939687.db2.gz	RGDKWVPDVVMICI-UHFFFAOYSA-N	-1	0	356.197	2.948	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)Cc1ccc(N2CCCC2=O)cc1)c1cccs1	ZINC000013389955	506941557	/nfs/dbraw/zinc/94/15/57/506941557.db2.gz	MVKKZUXRPFXZHV-HNNXBMFYSA-N	-1	0	372.446	2.750	50	0		FFAARM
COc1ccc(CCC(=O)N2CCc3cc(C(=O)[O-])ccc32)cc1OC	ZINC000013447813	506941890	/nfs/dbraw/zinc/94/18/90/506941890.db2.gz	FMPXMXZZGRDVIV-UHFFFAOYSA-N	-1	0	355.390	2.924	50	0		FFAARM
Cn1cnnc1Sc1ccccc1[N-]S(=O)(=O)c1cccc(F)c1	ZINC000014095982	506965512	/nfs/dbraw/zinc/96/55/12/506965512.db2.gz	GMPRAQJISQCALX-UHFFFAOYSA-N	-1	0	364.427	2.906	50	0		FFAARM
O=C(c1cnn(C(=O)c2cccnc2)c1)c1cc(Br)ccc1[O-]	ZINC000014200172	506978867	/nfs/dbraw/zinc/97/88/67/506978867.db2.gz	LLWNOTQORPMQTP-UHFFFAOYSA-N	-1	0	372.178	2.666	50	0		FFAARM
Cn1nc(C(=O)[O-])c2c1CCN(C(=O)[C@@H](c1ccccc1)C1CCCC1)C2	ZINC000067788782	507009501	/nfs/dbraw/zinc/00/95/01/507009501.db2.gz	CKXGOHUEGCBNQB-SFHVURJKSA-N	-1	0	367.449	2.977	50	0		FFAARM
C[C@H](CC(=O)N1CCC(c2cc(CC(=O)[O-])n[nH]2)CC1)c1ccccc1	ZINC000067790223	507009779	/nfs/dbraw/zinc/00/97/79/507009779.db2.gz	RZBBHGIJLGJWSK-CQSZACIVSA-N	-1	0	355.438	2.937	50	0		FFAARM
C[C@@H](c1nnc(SCC(=O)[O-])n1-c1ccccc1Cl)n1cccn1	ZINC000067834139	507021982	/nfs/dbraw/zinc/02/19/82/507021982.db2.gz	QVKJYHYDDCRXEZ-JTQLQIEISA-N	-1	0	363.830	2.903	50	0		FFAARM
Cn1nc(C(=O)[O-])c2c1CCN(C(=O)CCCc1c[nH]c3ccccc13)C2	ZINC000067854693	507026277	/nfs/dbraw/zinc/02/62/77/507026277.db2.gz	FBWLJKTWTQOKMX-UHFFFAOYSA-N	-1	0	366.421	2.507	50	0		FFAARM
Cc1ccc(O)c(S(=O)(=O)[N-]c2ccc(CC(=O)NC(C)C)cc2)c1	ZINC000057117531	507174775	/nfs/dbraw/zinc/17/47/75/507174775.db2.gz	DXBDZIHCACDCHE-UHFFFAOYSA-N	-1	0	362.451	2.569	50	0		FFAARM
COC(=O)N(C)c1ccc([N-]S(=O)(=O)c2cc(C)ccc2O)cc1	ZINC000057125399	507178865	/nfs/dbraw/zinc/17/88/65/507178865.db2.gz	LGLQUYCKJROGCI-UHFFFAOYSA-N	-1	0	350.396	2.704	50	0		FFAARM
O=c1[nH]c2ccc(S(=O)(=O)[N-]c3ccccc3C(F)(F)F)cc2o1	ZINC000019936381	507206394	/nfs/dbraw/zinc/20/63/94/507206394.db2.gz	XNIBHCGLDDOZNA-UHFFFAOYSA-N	-1	0	358.297	2.941	50	0		FFAARM
CCc1ccc([N-]S(=O)(=O)c2ccc(-c3ccc(=O)[nH]n3)s2)cc1	ZINC000020574716	507226388	/nfs/dbraw/zinc/22/63/88/507226388.db2.gz	ZAZGZHXNGIJKCI-UHFFFAOYSA-N	-1	0	361.448	2.862	50	0		FFAARM
CC[C@@H](C)[C@H](NC(=O)Cc1csc(-c2ccc(OC)cc2)n1)C(=O)[O-]	ZINC000020737616	507233063	/nfs/dbraw/zinc/23/30/63/507233063.db2.gz	DAHZAIMJTUPCLN-BZNIZROVSA-N	-1	0	362.451	2.977	50	0		FFAARM
C[C@@H]1CN([C@H](c2cccs2)c2sc3ncnn3c2[O-])C[C@H](C)O1	ZINC000022610180	507301320	/nfs/dbraw/zinc/30/13/20/507301320.db2.gz	QTDKDDVKZDKMQU-JFGNBEQYSA-N	-1	0	350.469	2.757	50	0		FFAARM
CC(=O)Nc1cccc(CNC(=O)Nc2ccc(-c3nc(=O)o[n-]3)cc2)c1	ZINC000058391727	507410369	/nfs/dbraw/zinc/41/03/69/507410369.db2.gz	XSQVEMGKSIPJMY-UHFFFAOYSA-N	-1	0	367.365	2.722	50	0		FFAARM
Cc1ccc([N-]S(C)(=O)=O)c(C(=O)NCCc2ccc(Cl)cc2)c1	ZINC000024965561	507453594	/nfs/dbraw/zinc/45/35/94/507453594.db2.gz	QHDJCTZMJBNLTG-UHFFFAOYSA-N	-1	0	366.870	2.992	50	0		FFAARM
C[C@@](CC(=O)Nc1ccc2c(c1)CCC(=O)N2)(C(=O)[O-])c1ccccc1	ZINC000027057448	507628942	/nfs/dbraw/zinc/62/89/42/507628942.db2.gz	PLFKIVGHLRAYEH-FQEVSTJZSA-N	-1	0	352.390	2.942	50	0		FFAARM
O=C([O-])c1cc(-c2ccc(O)cc2)cc(S(=O)(=O)NC2CCCC2)c1	ZINC000071752728	507710683	/nfs/dbraw/zinc/71/06/83/507710683.db2.gz	MGNJNDQPJUXHCQ-UHFFFAOYSA-N	-1	0	361.419	2.978	50	0		FFAARM
COc1ccc(CC(=O)[O-])cc1S(=O)(=O)N1C[C@@H](C)c2ccccc21	ZINC000071824017	507719247	/nfs/dbraw/zinc/71/92/47/507719247.db2.gz	PXCJBRKWCNYBCU-GFCCVEGCSA-N	-1	0	361.419	2.635	50	0		FFAARM
Cc1ccc([N-]S(C)(=O)=O)c(C(=O)N2CCO[C@H](c3ccccc3)C2)c1	ZINC000063723089	507763632	/nfs/dbraw/zinc/76/36/32/507763632.db2.gz	HQVOTIMPDSFIKF-SFHVURJKSA-N	-1	0	374.462	2.580	50	0		FFAARM
CS(=O)(=O)c1ccc(CN2CC[C@@H](c3ccccc3C(=O)[O-])C2)cc1	ZINC000072163446	507766508	/nfs/dbraw/zinc/76/65/08/507766508.db2.gz	BNBPOGXQZKRCJX-OAHLLOKOSA-N	-1	0	359.447	2.778	50	0		FFAARM
O=C([O-])CCC(=O)N1N=C(c2ccco2)C[C@H]1c1cccc2nccnc21	ZINC000072314724	507776217	/nfs/dbraw/zinc/77/62/17/507776217.db2.gz	XDJDNYNZDMUPSX-HNNXBMFYSA-N	-1	0	364.361	2.765	50	0		FFAARM
O=C([O-])[C@]1(O)[C@@H](c2ccccc2)[C@@H](c2ccc(Cl)cc2)Nc2ncnn21	ZINC000072332372	507777396	/nfs/dbraw/zinc/77/73/96/507777396.db2.gz	HIQAZQFVSMOXKR-HDMKZQKVSA-N	-1	0	370.796	2.612	50	0		FFAARM
O=C([O-])C1(n2cnc3ccccc32)CCN(C(=O)c2cccs2)CC1	ZINC000072428019	507789222	/nfs/dbraw/zinc/78/92/22/507789222.db2.gz	VHMJULXYAYXWGP-UHFFFAOYSA-N	-1	0	355.419	2.814	50	0		FFAARM
Cc1cc(C)c(C)c2occ(CC(=O)N3CCc4[nH]cnc4[C@H]3C(=O)[O-])c21	ZINC000072428283	507789405	/nfs/dbraw/zinc/78/94/05/507789405.db2.gz	BGNQWBJQVFVSPK-SFHVURJKSA-N	-1	0	367.405	2.834	50	0		FFAARM
Cc1cc(C)n(-c2ccc(F)cc2CN2CCc3nc[nH]c3[C@H]2C(=O)[O-])n1	ZINC000072432940	507790677	/nfs/dbraw/zinc/79/06/77/507790677.db2.gz	PSBJASUXAHJILI-SFHVURJKSA-N	-1	0	369.400	2.535	50	0		FFAARM
Cc1cc2nc(CN3CCC[C@@H]3c3nc4ccccc4n3C)cc(=O)n2[n-]1	ZINC000077420728	508314455	/nfs/dbraw/zinc/31/44/55/508314455.db2.gz	ZUUPYBVQSPUBKX-QGZVFWFLSA-N	-1	0	362.437	2.555	50	0		FFAARM
CCc1nc(C(=O)N2CCCC[C@@H]2C(=O)[O-])nn1-c1ccccc1Cl	ZINC000136503548	508697866	/nfs/dbraw/zinc/69/78/66/508697866.db2.gz	FZTJDHHSXJFJIJ-CYBMUJFWSA-N	-1	0	362.817	2.562	50	0		FFAARM
Cc1cc(S(=O)(=O)[N-]C(=O)c2ccnc(C3CCCC3)n2)c(C)s1	ZINC000162106497	509172456	/nfs/dbraw/zinc/17/24/56/509172456.db2.gz	OJBJROOMCLUEIK-UHFFFAOYSA-N	-1	0	365.480	2.931	50	0		FFAARM
COc1ccccc1OC1(C(=O)[O-])CCN(C(=O)OC(C)(C)C)CC1	ZINC000205360688	509235497	/nfs/dbraw/zinc/23/54/97/509235497.db2.gz	UKMWTNLJBQVZRN-UHFFFAOYSA-N	-1	0	351.399	2.928	50	0		FFAARM
COc1cc(O)cc([N-]S(=O)(=O)c2cnn(-c3ccccc3F)c2)c1	ZINC000225564588	509376478	/nfs/dbraw/zinc/37/64/78/509376478.db2.gz	VKKCMAZUMTYGOZ-UHFFFAOYSA-N	-1	0	363.370	2.526	50	0		FFAARM
CCn1cc(S(=O)(=O)N[C@H]2CCC[C@H](C(F)(F)F)C2)cc1C(=O)[O-]	ZINC000236957796	509542419	/nfs/dbraw/zinc/54/24/19/509542419.db2.gz	MYPVEBJGBHGHMN-UWVGGRQHSA-N	-1	0	368.377	2.606	50	0		FFAARM
Cc1ccc(-n2ccnc2SCC(=O)N2CCC(C(=O)[O-])CC2)c(C)c1	ZINC000169878176	509665372	/nfs/dbraw/zinc/66/53/72/509665372.db2.gz	RUDLBKOKRYHYMM-UHFFFAOYSA-N	-1	0	373.478	2.904	50	0		FFAARM
CCCc1nnc([N-]S(=O)(=O)c2ccc(OC(F)(F)F)cc2)o1	ZINC000170609134	509680191	/nfs/dbraw/zinc/68/01/91/509680191.db2.gz	HYAPCXXGCXQDQW-UHFFFAOYSA-N	-1	0	351.306	2.722	50	0		FFAARM
CC[NH+](CC)CCNS(=O)(=O)c1ccc(Cl)c(Cl)c1OC	ZINC000170623943	509683708	/nfs/dbraw/zinc/68/37/08/509683708.db2.gz	UVNUWRWQTGSGQP-UHFFFAOYSA-N	-1	0	355.287	2.622	50	0		FFAARM
O=C([O-])Cc1ccc(S(=O)(=O)N[C@H]2CCC[C@H](C(F)(F)F)C2)s1	ZINC000238107214	509821633	/nfs/dbraw/zinc/82/16/33/509821633.db2.gz	OOAUEXNPNNEZFV-IUCAKERBSA-N	-1	0	371.402	2.775	50	0		FFAARM
O=C([O-])[C@H]1CCN(C(=O)/C=C\c2ccc(OCc3ccccn3)cc2)C1	ZINC000255327829	509922952	/nfs/dbraw/zinc/92/29/52/509922952.db2.gz	TZHHWZDVUYKEAQ-HWYHOQROSA-N	-1	0	352.390	2.607	50	0		FFAARM
C[C@@H]1CC[C@H](C(=O)[O-])CN1C(=O)Cc1csc(Cc2ccccc2)n1	ZINC000263160051	510591622	/nfs/dbraw/zinc/59/16/22/510591622.db2.gz	IGYMDATVIWUFKE-HIFRSBDPSA-N	-1	0	358.463	2.988	50	0		FFAARM
O=C([O-])[C@@H]1CCCN(C(=O)N[C@@H](Cc2ccccn2)c2ccccc2)C1	ZINC000263408196	510694990	/nfs/dbraw/zinc/69/49/90/510694990.db2.gz	UHMCQACKDXSXKL-AEFFLSMTSA-N	-1	0	353.422	2.872	50	0		FFAARM
COc1ccc(-c2noc(CN3[C@H](C(=O)[O-])C[C@H]4CCCC[C@@H]43)n2)cc1	ZINC000294297822	511017889	/nfs/dbraw/zinc/01/78/89/511017889.db2.gz	WBMRMVTXYPCSOD-KBMXLJTQSA-N	-1	0	357.410	2.963	50	0		FFAARM
O=C([O-])[C@H]1Cc2nc(NC(=O)c3cccc(F)c3F)sc2C(=O)C1	ZINC000299768142	511674450	/nfs/dbraw/zinc/67/44/50/511674450.db2.gz	GMGZKZJJZTUWGH-LURJTMIESA-N	-1	0	352.318	2.503	50	0		FFAARM
Cc1c(C(=O)[O-])sc2ncnc(NC[C@@H]3COc4ccccc4O3)c12	ZINC000299768576	511674771	/nfs/dbraw/zinc/67/47/71/511674771.db2.gz	PGPDWOIODOEEAI-SNVBAGLBSA-N	-1	0	357.391	2.950	50	0		FFAARM
CC1(C(=O)[O-])CCN(C(=O)c2cnc(-c3ccc4c(c3)OCO4)s2)CC1	ZINC000364172407	511998655	/nfs/dbraw/zinc/99/86/55/511998655.db2.gz	QKFYTJPUSOIBDW-UHFFFAOYSA-N	-1	0	374.418	2.866	50	0		FFAARM
O=C([O-])CCN(C(=O)CCOc1ccc(Cl)cc1)C1CCOCC1	ZINC000408513269	513083247	/nfs/dbraw/zinc/08/32/47/513083247.db2.gz	JJMXNXAQLPQGJP-UHFFFAOYSA-N	-1	0	355.818	2.591	50	0		FFAARM
CCCOc1ccccc1C(=O)N1CCC[C@H](c2ccn(CC(=O)[O-])n2)C1	ZINC000426372552	513918663	/nfs/dbraw/zinc/91/86/63/513918663.db2.gz	ZTHUVDJXNUSWTJ-HNNXBMFYSA-N	-1	0	371.437	2.776	50	0		FFAARM
CC(C)c1nc(/C=C/c2ccc(S(C)(=O)=O)s2)ncc1C(=O)[O-]	ZINC000414061061	513958772	/nfs/dbraw/zinc/95/87/72/513958772.db2.gz	BMNQITXDTZJWMD-GQCTYLIASA-N	-1	0	352.437	2.934	50	0		FFAARM
COc1cccc([C@H]2CCN2C(=O)NCCc2nc(C(=O)[O-])cs2)c1	ZINC000426535619	513972689	/nfs/dbraw/zinc/97/26/89/513972689.db2.gz	DYNZUHFGWZDSBA-CQSZACIVSA-N	-1	0	361.423	2.549	50	0		FFAARM
Cc1cc(C(=O)N2CCC[C@H](c3ccn(CC(=O)[O-])n3)C2)ccc1Cl	ZINC000426677874	514014038	/nfs/dbraw/zinc/01/40/38/514014038.db2.gz	WSAHQWLLACRHBN-AWEZNQCLSA-N	-1	0	361.829	2.949	50	0		FFAARM
Cc1cc(Cl)ccc1O[C@H](C)C(=O)N(CC(=O)[O-])C1CCOCC1	ZINC000486002992	515292406	/nfs/dbraw/zinc/29/24/06/515292406.db2.gz	HOAAYQCVOXMLCG-GFCCVEGCSA-N	-1	0	355.818	2.508	50	0		FFAARM
CCOc1c(Cl)cc(/C=C\C(=O)N2CCC[C@H]2C(=O)[O-])cc1OC	ZINC000606441856	521069135	/nfs/dbraw/zinc/06/91/35/521069135.db2.gz	KIKLSTSLORVKDF-FWWRYZNZSA-N	-1	0	353.802	2.836	50	0		FFAARM
COCCn1ccnc1C1CCN(C(=O)c2ccc([O-])c(Cl)c2)CC1	ZINC000091645139	522134628	/nfs/dbraw/zinc/13/46/28/522134628.db2.gz	JUKUUBCFCPIXPE-UHFFFAOYSA-N	-1	0	363.845	2.908	50	0		FFAARM
CC(C)n1ncc2cc(C(=O)N3CCc4c(cccc4C(=O)[O-])C3)cnc21	ZINC000621578454	522943708	/nfs/dbraw/zinc/94/37/08/522943708.db2.gz	RAGBENUPGCKYOD-UHFFFAOYSA-N	-1	0	364.405	2.909	50	0		FFAARM
COc1cc2c(cc1OC)[C@@H](CC(=O)[O-])N(C(=O)CCc1ccco1)CC2	ZINC000277593328	523038668	/nfs/dbraw/zinc/03/86/68/523038668.db2.gz	GXTBWUBBVJLHMO-MRXNPFEDSA-N	-1	0	373.405	2.830	50	0		FFAARM
Cc1ccc(-c2cc(C(=O)N(C)Cc3nc(=O)c4sccc4[n-]3)[nH]n2)o1	ZINC000091625579	525715552	/nfs/dbraw/zinc/71/55/52/525715552.db2.gz	NMVIAKIHWALBDB-UHFFFAOYSA-N	-1	0	369.406	2.548	50	0		FFAARM
O=C([O-])[C@H]1CCCN1C(=O)c1ccc(-c2ccc3c(c2)OCCO3)s1	ZINC000269203434	526323442	/nfs/dbraw/zinc/32/34/42/526323442.db2.gz	SGOYRBJOEYECEX-GFCCVEGCSA-N	-1	0	359.403	2.876	50	0		FFAARM
O=C(CCNC(=O)c1c([O-])cc(Cl)cc1Cl)Nc1ccncc1	ZINC000080022706	526503941	/nfs/dbraw/zinc/50/39/41/526503941.db2.gz	AFIUQNHVINPJGU-UHFFFAOYSA-N	-1	0	354.193	2.853	50	0		FFAARM
O=C([N-]O[C@H]1CCCCO1)[C@@H]1CC(=O)N(c2cccc3ccccc32)C1	ZINC000065513496	526851998	/nfs/dbraw/zinc/85/19/98/526851998.db2.gz	WEFSUUPGKYLXGH-BEFAXECRSA-N	-1	0	354.406	2.767	50	0		FFAARM
Cc1nc(COc2ccc(F)cc2)sc1C(=O)N1CC[C@@H](C(=O)[O-])C1	ZINC000178263025	526906784	/nfs/dbraw/zinc/90/67/84/526906784.db2.gz	LQBXWXVBIUYMJZ-LLVKDONJSA-N	-1	0	364.398	2.716	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)c1cc2c(cc1F)NC(=O)CC2)c1ccccc1	ZINC000178277148	527625389	/nfs/dbraw/zinc/62/53/89/527625389.db2.gz	DEENHNJLLYEVMR-MRXNPFEDSA-N	-1	0	356.353	2.656	50	0		FFAARM
COC(=O)C[C@H](c1ccc(SC)cc1)c1c(=O)nc2ccccn2c1[O-]	ZINC000205970334	570550523	/nfs/dbraw/zinc/55/05/23/570550523.db2.gz	FMRCEKRNMWPNJV-CQSZACIVSA-N	-1	0	370.430	2.817	50	0		FFAARM
C[C@H](c1ccccc1)N1C[C@H](C(=O)N[C@@H]2CCCCC[C@@H]2C(=O)[O-])CC1=O	ZINC000120182999	570591999	/nfs/dbraw/zinc/59/19/99/570591999.db2.gz	NMCNKJXDSDPABR-NRSFXHEJSA-N	-1	0	372.465	2.746	50	0		FFAARM
O=C(Nc1ccc(OC(F)(F)F)cc1)C([O-])=C1C(=O)Nc2ccccc21	ZINC000102232223	570829082	/nfs/dbraw/zinc/82/90/82/570829082.db2.gz	FBCBCDAOHNRICT-CYBMUJFWSA-N	-1	0	364.279	2.829	50	0		FFAARM
CC[C@H](C)[C@@H](NC(=O)Cc1csc(-c2ccccc2OC)n1)C(=O)[O-]	ZINC000085432478	571115392	/nfs/dbraw/zinc/11/53/92/571115392.db2.gz	JUHBOQXNALNPGD-MEDUHNTESA-N	-1	0	362.451	2.977	50	0		FFAARM
O=C([O-])[C@@]1(O)CCCN(C(=O)OCC2c3ccccc3-c3ccccc32)C1	ZINC000307618054	571116901	/nfs/dbraw/zinc/11/69/01/571116901.db2.gz	SITJORSMOALLHK-OAQYLSRUSA-N	-1	0	367.401	2.847	50	0		FFAARM
O=C([O-])C1CCC(NC(=O)N2CCO[C@H](c3ccc(F)c(F)c3)C2)CC1	ZINC000263487720	600031654	/nfs/dbraw/zinc/03/16/54/600031654.db2.gz	PYHDDZZNPAVODF-TZDAIYRESA-N	-1	0	368.380	2.691	50	0		FFAARM
CC(C)(C)OC(=O)N[C@@H](Cc1ccc(O)c(Br)c1)C(=O)[O-]	ZINC000044295596	727985142	/nfs/dbraw/zinc/98/51/42/727985142.db2.gz	SQOXBCRLNHVHGU-JTQLQIEISA-N	-1	0	360.204	2.675	50	0		FFAARM
CC[C@](NC(=O)/C=C/c1ccc(C(=O)NC)cc1)(C(=O)[O-])c1ccccc1	ZINC000170671672	939032832	/nfs/dbraw/zinc/03/28/32/939032832.db2.gz	DQFHRJUMXCNPOH-QGFLDLQWSA-N	-1	0	366.417	2.566	50	0		FFAARM
O=C([O-])c1cn2c(n1)[C@@H](c1ccccc1)N(C(=O)Cc1ccccc1)CC2	ZINC000675015158	971492808	/nfs/dbraw/zinc/49/28/08/971492808.db2.gz	MGVQXOXFEBWYTH-LJQANCHMSA-N	-1	0	361.401	2.756	50	0		FFAARM
CCC(Nc1ccccc1N)=C1C(=O)[N-]C(=O)N(Cc2ccccc2)C1=O	ZINC000003894089	972350933	/nfs/dbraw/zinc/35/09/33/972350933.db2.gz	FKODBKALEYIALO-ICFOKQHNSA-N	-1	0	364.405	2.623	50	0		FFAARM
O=C([O-])c1cc2ncc(-c3cc(F)ccc3OC[C@H]3CCOC3)cn2n1	ZINC000874970557	990783657	/nfs/dbraw/zinc/78/36/57/990783657.db2.gz	RYNCVWPDYXZDHI-NSHDSACASA-N	-1	0	357.341	2.649	50	0		FFAARM
CO[C@@](C)(C(=O)[O-])C(=O)NC[C@@H]1CC2c3ccccc3C1c1ccccc12	ZINC000656848925	1025457932	/nfs/dbraw/zinc/45/79/32/1025457932.db2.gz	RPOHUWCQPYQPOV-PBSUNYAVSA-N	-1	0	365.429	2.890	50	0		FFAARM
O=C([O-])COc1cccc(C(=O)N2CCOC[C@H]2c2cccc(F)c2)c1	ZINC000659200518	1025971022	/nfs/dbraw/zinc/97/10/22/1025971022.db2.gz	WMJVHURBJJQXJJ-KRWDZBQOSA-N	-1	0	359.353	2.503	50	0		FFAARM
Cc1cccc([N-]S(=O)(=O)c2cc(OCC(N)=O)c(C)cc2Cl)c1	ZINC000000645305	210256319	/nfs/dbraw/zinc/25/63/19/210256319.db2.gz	WMSATIJAXKQDGR-UHFFFAOYSA-N	-1	0	368.842	2.622	50	0		FFAARM
CCS(=O)(=O)Nc1cc2nc(-c3ccccc3)n(C)c2c(C(=O)[O-])c1	ZINC000299794638	210036636	/nfs/dbraw/zinc/03/66/36/210036636.db2.gz	KYVGPKZURMCYOE-UHFFFAOYSA-N	-1	0	359.407	2.700	50	0		FFAARM
O=C([O-])[C@H](c1cccc2c1Sc1ccccc1S2)N1CCNC(=O)C1	ZINC000063869898	212035666	/nfs/dbraw/zinc/03/56/66/212035666.db2.gz	JASFTGYYXCMUDU-INIZCTEOSA-N	-1	0	372.471	2.860	50	0		FFAARM
O=C(NC12CC3CC(CC(C3)C1)C2)c1ccc2c(c1)[n-]c(=S)[nH]c2=O	ZINC000063808949	212033893	/nfs/dbraw/zinc/03/38/93/212033893.db2.gz	HIYALDAGCHQPLL-UHFFFAOYSA-N	-1	0	355.463	2.910	50	0		FFAARM
CN(Cc1cn(-c2ccccc2)nc1-c1ccccc1)C(=O)c1n[nH]c(=O)[n-]1	ZINC000058002959	211983448	/nfs/dbraw/zinc/98/34/48/211983448.db2.gz	UDBRHNGQAUYHNK-UHFFFAOYSA-N	-1	0	374.404	2.635	50	0		FFAARM
O=C([O-])[C@@H]1CC=CC[C@@H]1C(=O)Nc1ccc(C(=O)NC2CC2)c(Cl)c1	ZINC000055150044	211938357	/nfs/dbraw/zinc/93/83/57/211938357.db2.gz	UNOATPDTPZJHQB-QWHCGFSZSA-N	-1	0	362.813	2.838	50	0		FFAARM
Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(F)(F)F)C2)cc1C(=O)[O-]	ZINC000013070166	220056626	/nfs/dbraw/zinc/05/66/26/220056626.db2.gz	LSYURHVNBKDKBV-SNVBAGLBSA-N	-1	0	351.346	2.656	50	0		FFAARM
Cc1ccc(S(=O)(=O)N2CCC[C@H](C(F)(F)F)C2)cc1C(=O)[O-]	ZINC000013070168	220056649	/nfs/dbraw/zinc/05/66/49/220056649.db2.gz	LSYURHVNBKDKBV-JTQLQIEISA-N	-1	0	351.346	2.656	50	0		FFAARM
COc1cc(NS(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)cc(OC)c1	ZINC000013340855	220064743	/nfs/dbraw/zinc/06/47/43/220064743.db2.gz	NOHUHYXGWGFOBR-UHFFFAOYSA-N	-1	0	371.798	2.856	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)c2ccc(-c3ccc(Cl)cc3)s2)CCO1	ZINC000299744501	211823692	/nfs/dbraw/zinc/82/36/92/211823692.db2.gz	OYSJFBJINICCKL-LBPRGKRZSA-N	-1	0	351.811	2.994	50	0		FFAARM
C[C@](CC(=O)Nc1ccc2c(c1)CCC(=O)N2)(C(=O)[O-])c1ccccc1	ZINC000027057452	211458533	/nfs/dbraw/zinc/45/85/33/211458533.db2.gz	PLFKIVGHLRAYEH-HXUWFJFHSA-N	-1	0	352.390	2.942	50	0		FFAARM
COC(=O)c1cc(C)sc1NC(=O)[C@@H]1C2CCC(CC2)[C@H]1C(=O)[O-]	ZINC000017072894	211176326	/nfs/dbraw/zinc/17/63/26/211176326.db2.gz	ZOVUUBNABKYVSE-IOCWDNCASA-N	-1	0	351.424	2.919	50	0		FFAARM
COc1cccc(NC(=O)CSc2nnc(-c3ccccc3)c(=O)[n-]2)c1	ZINC000016806814	211170557	/nfs/dbraw/zinc/17/05/57/211170557.db2.gz	KUKIVRUQXFAGFL-UHFFFAOYSA-N	-1	0	368.418	2.984	50	0		FFAARM
COc1ccc(CNC(=O)c2ccc(-n3cccn3)cc2)cc1C(=O)[O-]	ZINC000013393159	211031818	/nfs/dbraw/zinc/03/18/18/211031818.db2.gz	YCTWDHIMUTUSTA-UHFFFAOYSA-N	-1	0	351.362	2.509	50	0		FFAARM
CCC(CC)NC(=O)CSc1nnc(-c2ccc(OC)cc2)c(=O)[n-]1	ZINC000012986826	211015703	/nfs/dbraw/zinc/01/57/03/211015703.db2.gz	HXBCIDLGTLSVLJ-UHFFFAOYSA-N	-1	0	362.455	2.650	50	0		FFAARM
CCN1C(=O)N/C(=C/c2ccc(OCc3cccc(C(=O)[O-])c3)cc2)C1=O	ZINC000004681065	210551970	/nfs/dbraw/zinc/55/19/70/210551970.db2.gz	GJJKEUKYJBDPPX-GZTJUZNOSA-N	-1	0	366.373	2.876	50	0		FFAARM
CCOc1ccc([C@H](CC(=O)[O-])NS(=O)(=O)Cc2ccccc2)cc1	ZINC000004581524	210542488	/nfs/dbraw/zinc/54/24/88/210542488.db2.gz	IIEIWLRWUKJECW-KRWDZBQOSA-N	-1	0	363.435	2.721	50	0		FFAARM
COc1ccc(-n2c(=O)c3[n-][nH]n(Cc4cc(C)ccc4C)c=3c2=O)cc1	ZINC000004483539	210532168	/nfs/dbraw/zinc/53/21/68/210532168.db2.gz	NCBVPFXHKRDSBD-QZTJIDSGSA-N	-1	0	364.405	2.805	50	0		FFAARM
O=C([O-])c1cccc(C(=O)Nc2cccc(NC(=O)[C@@H]3CCCO3)c2)c1	ZINC000002879729	210434090	/nfs/dbraw/zinc/43/40/90/210434090.db2.gz	KFCQADYFMHHBFL-INIZCTEOSA-N	-1	0	354.362	2.755	50	0		FFAARM
CCN1CCN([C@@H](c2cccs2)c2sc3nc(C)nn3c2[O-])CC1	ZINC000020216030	220318953	/nfs/dbraw/zinc/31/89/53/220318953.db2.gz	DTLHFNMTISVOMG-ZDUSSCGKSA-N	-1	0	363.512	2.593	50	0		FFAARM
O=S(=O)([N-]NC(=S)Nc1ccccc1F)c1ccc(Cl)cc1	ZINC000001023431	210303370	/nfs/dbraw/zinc/30/33/70/210303370.db2.gz	ISZRIUGNGMCOKI-UHFFFAOYSA-N	-1	0	359.835	2.659	50	0		FFAARM
COc1cc(NS(=O)(=O)c2ccc(Cl)cc2)c(C(=O)[O-])cc1OC	ZINC000001027752	210302760	/nfs/dbraw/zinc/30/27/60/210302760.db2.gz	SZOHZVRLCDOYMM-UHFFFAOYSA-N	-1	0	371.798	2.856	50	0		FFAARM
CS(=O)(=O)[N-]c1ccccc1-c1nnc(Cc2cc(F)cc(F)c2)o1	ZINC000001047181	210308675	/nfs/dbraw/zinc/30/86/75/210308675.db2.gz	YBRDAEZQYFMICC-UHFFFAOYSA-N	-1	0	365.361	2.977	50	0		FFAARM
CCOc1ccc([N-]S(=O)(=O)c2c(C)nc3sc(CC)nn32)cc1	ZINC000065183746	221175850	/nfs/dbraw/zinc/17/58/50/221175850.db2.gz	PAJPPPYDHZAFPW-UHFFFAOYSA-N	-1	0	366.468	2.861	50	0		FFAARM
COc1ccc(OC)c([C@@H](C)NC(=O)c2ccccc2NCC(=O)[O-])c1	ZINC000065373003	221205174	/nfs/dbraw/zinc/20/51/74/221205174.db2.gz	YMTKBUMSKIDVOT-GFCCVEGCSA-N	-1	0	358.394	2.691	50	0		FFAARM
Cc1c(C(=O)[O-])sc2ncnc(N3CCC(Oc4ncccn4)CC3)c12	ZINC000067847532	221293291	/nfs/dbraw/zinc/29/32/91/221293291.db2.gz	VIIVFUXYZPSHCR-UHFFFAOYSA-N	-1	0	371.422	2.536	50	0		FFAARM
O=C([O-])c1nn2cc(-c3ccccc3CN3CCOCC3)cnc2c1Cl	ZINC000067956243	221309067	/nfs/dbraw/zinc/30/90/67/221309067.db2.gz	CZIBNHDCBPRQRB-UHFFFAOYSA-N	-1	0	372.812	2.580	50	0		FFAARM
COc1cccc(N2CCN(Cc3ccccc3C(=O)[O-])[C@@H](C)C2=O)c1	ZINC000067975578	221311435	/nfs/dbraw/zinc/31/14/35/221311435.db2.gz	HWRGBEOABMBFGX-AWEZNQCLSA-N	-1	0	354.406	2.631	50	0		FFAARM
CC1(C)[C@H](C(=O)[O-])[C@H]1C(=O)Nc1ccc(C(=O)NCc2ccco2)cc1	ZINC000071288221	221340407	/nfs/dbraw/zinc/34/04/07/221340407.db2.gz	LPHKYQKNKXIOBP-GJZGRUSLSA-N	-1	0	356.378	2.505	50	0		FFAARM
O=C([O-])C1(NC(=O)[C@@H]2CC(=O)N(c3ccc(Cl)cc3)C2)CCCCC1	ZINC000071817365	221379407	/nfs/dbraw/zinc/37/94/07/221379407.db2.gz	HMXDHKCYDYBFQV-GFCCVEGCSA-N	-1	0	364.829	2.597	50	0		FFAARM
COc1ccc(Cc2nccc(-c3cc(C(=O)[O-])ccn3)n2)cc1OC	ZINC000071771312	221373869	/nfs/dbraw/zinc/37/38/69/221373869.db2.gz	KXORSVJXFJPYJR-UHFFFAOYSA-N	-1	0	351.362	2.845	50	0		FFAARM
O=C([O-])CCc1cc2n(n1)CCN(Cc1ccc(OC(F)F)cc1)C2	ZINC000072167173	221444234	/nfs/dbraw/zinc/44/42/34/221444234.db2.gz	NUGCMHFRHTUWDJ-UHFFFAOYSA-N	-1	0	351.353	2.518	50	0		FFAARM
COc1ccc(-c2cc3c(N4CCC(C(=O)[O-])CC4)nccn3n2)cc1	ZINC000021729696	132901991	/nfs/dbraw/zinc/90/19/91/132901991.db2.gz	GNVBAMZYJONGCJ-UHFFFAOYSA-N	-1	0	352.394	2.706	50	0		FFAARM
Cc1cc(C)cc(N2CCC(N3CCn4nc(C(=O)[O-])cc4C3)CC2)c1	ZINC000065421599	136136252	/nfs/dbraw/zinc/13/62/52/136136252.db2.gz	SZKPXECASADDGM-UHFFFAOYSA-N	-1	0	354.454	2.683	50	0		FFAARM
CN(C)c1nccnc1N1CCC[C@@](Cc2ccccc2F)(C(=O)[O-])C1	ZINC000071440025	136139317	/nfs/dbraw/zinc/13/93/17/136139317.db2.gz	GPQRKOWATJKSHD-IBGZPJMESA-N	-1	0	358.417	2.596	50	0		FFAARM
Cc1cnn(-c2ccc(C(=O)N(CCC(F)(F)F)CC(=O)[O-])cc2)c1	ZINC000095424926	221901157	/nfs/dbraw/zinc/90/11/57/221901157.db2.gz	BQCVACJJZORSOL-UHFFFAOYSA-N	-1	0	355.316	2.660	50	0		FFAARM
Cc1nn(CC(C)C)c(C)c1CC(=O)NC[C@H](C(=O)[O-])c1ccccc1	ZINC000095425552	221901791	/nfs/dbraw/zinc/90/17/91/221901791.db2.gz	NZGLSBBPHSGYEV-SFHVURJKSA-N	-1	0	357.454	2.683	50	0		FFAARM
Cc1nn(C)c(C)c1[C@@H](C)C(=O)NC[C@@H](Cc1ccc(C)cc1)C(=O)[O-]	ZINC000095425428	221902055	/nfs/dbraw/zinc/90/20/55/221902055.db2.gz	HUTOUQWHIMVNBW-CXAGYDPISA-N	-1	0	357.454	2.509	50	0		FFAARM
COc1ccc2c(cc(C(=O)N[C@H](Cc3ccc(F)cc3)C(=O)[O-])n2C)c1	ZINC000095510793	221937982	/nfs/dbraw/zinc/93/79/82/221937982.db2.gz	UIDWKBUJDLYTKY-MRXNPFEDSA-N	-1	0	370.380	2.752	50	0		FFAARM
CCCN1CCn2cc(S(=O)(=O)[N-]c3cc(C)ccc3C)cc2C1=O	ZINC000096102049	222023913	/nfs/dbraw/zinc/02/39/13/222023913.db2.gz	BNQDQQARGAYMPD-UHFFFAOYSA-N	-1	0	361.467	2.772	50	0		FFAARM
O=C([O-])CCNC(=O)c1ccc(NC(=O)c2ccc3cc[nH]c3c2)cc1	ZINC000095970421	221983342	/nfs/dbraw/zinc/98/33/42/221983342.db2.gz	IELLSQRKUQQFDT-UHFFFAOYSA-N	-1	0	351.362	2.625	50	0		FFAARM
COc1ccc(/C=C\C(=O)[O-])cc1S(=O)(=O)N(C)c1ccccc1F	ZINC000096402059	222120255	/nfs/dbraw/zinc/12/02/55/222120255.db2.gz	OPYXBJGGQCMDEU-NTMALXAHSA-N	-1	0	365.382	2.757	50	0		FFAARM
CC(C)C[C@H](NC(=O)c1cnc2c(cnn2Cc2ccccc2)c1)C(=O)[O-]	ZINC000097228871	222169961	/nfs/dbraw/zinc/16/99/61/222169961.db2.gz	RHZFBUMZIXEJQU-KRWDZBQOSA-N	-1	0	366.421	2.709	50	0		FFAARM
O=c1c2[n-][nH]n(Cc3ccc(Cl)cc3)c=2c(=O)n1-c1ccc(F)cc1	ZINC000101272085	222266588	/nfs/dbraw/zinc/26/65/88/222266588.db2.gz	HBRFSERQPLYUFB-HUUCEWRRSA-N	-1	0	358.760	2.973	50	0		FFAARM
CCN(C(=O)C1=C([O-])c2ccccc2S(=O)(=O)N1C)c1ccccc1	ZINC000101358427	222271651	/nfs/dbraw/zinc/27/16/51/222271651.db2.gz	MPSCMMPDQCGURF-UHFFFAOYSA-N	-1	0	358.419	2.600	50	0		FFAARM
COc1cc([C@@H]2CC(C(=O)[O-])=Nc3ncnn32)ccc1OCCC(C)C	ZINC000101585158	222278446	/nfs/dbraw/zinc/27/84/46/222278446.db2.gz	KFAVGGURNJDUSH-AWEZNQCLSA-N	-1	0	358.398	2.695	50	0		FFAARM
COc1cccc(-n2c(=O)c3[n-][nH]n(-c4ccc(C)c(C)c4)c=3c2=O)c1	ZINC000102819712	222308549	/nfs/dbraw/zinc/30/85/49/222308549.db2.gz	BJJHOKUVWRUEGK-IAGOWNOFSA-N	-1	0	350.378	2.810	50	0		FFAARM
O=C([N-]S(=O)(=O)CCCC(F)(F)F)[C@H]1CSc2ccccc21	ZINC000157044660	222553541	/nfs/dbraw/zinc/55/35/41/222553541.db2.gz	IVUAZHDATXXFAG-JTQLQIEISA-N	-1	0	353.387	2.664	50	0		FFAARM
O=S(=O)([N-]c1ccc2c(c1)OCCO2)c1ccc(-c2ccon2)s1	ZINC000001032475	506243742	/nfs/dbraw/zinc/24/37/42/506243742.db2.gz	ZYXJJZLPUMCQQN-UHFFFAOYSA-N	-1	0	364.404	2.975	50	0		FFAARM
O=C([O-])CNc1ccccc1C(=O)NCC1(COc2ccccc2)CC1	ZINC000065374242	506290043	/nfs/dbraw/zinc/29/00/43/506290043.db2.gz	MDFIIYGUPOUWFI-UHFFFAOYSA-N	-1	0	354.406	2.772	50	0		FFAARM
COc1cc2c(cc1OC)[C@@H]1[C@H](C(=O)[O-])c3ccccc3C(=O)N1CC2	ZINC000032916831	506313001	/nfs/dbraw/zinc/31/30/01/506313001.db2.gz	MXBNJFLOBHEONN-QZTJIDSGSA-N	-1	0	353.374	2.625	50	0		FFAARM
Cc1cccc(-c2nnc(CCC(=O)NCc3ccccc3F)c(=O)[n-]2)c1	ZINC000034768746	506369816	/nfs/dbraw/zinc/36/98/16/506369816.db2.gz	BBIPGPPEHKJFHI-UHFFFAOYSA-N	-1	0	366.396	2.941	50	0		FFAARM
O=C(CCc1nnc(-c2ccccc2)[n-]c1=O)NCCCc1ccccc1	ZINC000034767708	506370631	/nfs/dbraw/zinc/37/06/31/506370631.db2.gz	USLNSSXKWGIQFK-UHFFFAOYSA-N	-1	0	362.433	2.926	50	0		FFAARM
COc1ccccc1Cc1nnc(CCC(=O)NC2CCCCC2)c(=O)[n-]1	ZINC000034768267	506370821	/nfs/dbraw/zinc/37/08/21/506370821.db2.gz	UAMZAPIKFRNPKY-UHFFFAOYSA-N	-1	0	370.453	2.558	50	0		FFAARM
O=C([O-])CNC(=O)CCc1ccc(-c2ccc(Br)cc2)o1	ZINC000004542725	506381278	/nfs/dbraw/zinc/38/12/78/506381278.db2.gz	RHTRATSGFCTQAI-UHFFFAOYSA-N	-1	0	352.184	2.843	50	0		FFAARM
Cc1ccc(C)c(N2C[C@@H](C(=O)Nc3cccc(C(=O)[O-])c3)CC2=O)c1	ZINC000004610544	506384999	/nfs/dbraw/zinc/38/49/99/506384999.db2.gz	XPAWFCLTBQNUFH-HNNXBMFYSA-N	-1	0	352.390	2.993	50	0		FFAARM
O=C([O-])CN(c1cccc(Br)c1)S(=O)(=O)c1ccccc1	ZINC000004641452	506386892	/nfs/dbraw/zinc/38/68/92/506386892.db2.gz	FVFIDMHABTUZKO-UHFFFAOYSA-N	-1	0	370.224	2.729	50	0		FFAARM
CCOc1ccc(S(=O)(=O)N(CC(=O)[O-])c2ccc(F)cc2)cc1	ZINC000004741106	506392034	/nfs/dbraw/zinc/39/20/34/506392034.db2.gz	RJZFCKXKRCHJFW-UHFFFAOYSA-N	-1	0	353.371	2.504	50	0		FFAARM
O=C([O-])[C@H]1CCCC[C@H]1C(=O)N1CCN(c2ccccc2Cl)CC1	ZINC000004749304	506393831	/nfs/dbraw/zinc/39/38/31/506393831.db2.gz	MKTQWEILLANZID-KGLIPLIRSA-N	-1	0	350.846	2.880	50	0		FFAARM
COc1ccc(CCNC(=O)[C@H]2CC(C)=C(C)C[C@H]2C(=O)[O-])cc1OC	ZINC000004894541	506402559	/nfs/dbraw/zinc/40/25/59/506402559.db2.gz	UYOJBKFIFVXBNI-JKSUJKDBSA-N	-1	0	361.438	2.810	50	0		FFAARM
COC(=O)c1cccc(C)c1[N-]S(=O)(=O)c1ccc(OC)c(OC)c1	ZINC000036393776	506404169	/nfs/dbraw/zinc/40/41/69/506404169.db2.gz	ADHKHSCIKIWLPB-UHFFFAOYSA-N	-1	0	365.407	2.600	50	0		FFAARM
Cc1cc(-c2ccccc2)ccc1[N-]S(=O)(=O)c1cc(C(N)=O)n(C)c1	ZINC000040072762	506463049	/nfs/dbraw/zinc/46/30/49/506463049.db2.gz	UKTHWLGGAASWSD-UHFFFAOYSA-N	-1	0	369.446	2.900	50	0		FFAARM
CC1=C(C)C[C@H](C(=O)N2CCN(Cc3ccc(F)cc3)CC2)[C@H](C(=O)[O-])C1	ZINC000006699450	506499281	/nfs/dbraw/zinc/49/92/81/506499281.db2.gz	BIWKGQZHLMGLGB-RBUKOAKNSA-N	-1	0	374.456	2.917	50	0		FFAARM
Cc1ccccc1CN1CCN(C(=O)[C@@H]2C3CCC(CC3)[C@@H]2C(=O)[O-])CC1	ZINC000006742234	506502233	/nfs/dbraw/zinc/50/22/33/506502233.db2.gz	PMDQKGUKRVSLDM-TZJYRCSTSA-N	-1	0	370.493	2.776	50	0		FFAARM
O=C([O-])[C@H]1CCCC[C@H]1C(=O)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000006742285	506502684	/nfs/dbraw/zinc/50/26/84/506502684.db2.gz	BBIVYBWGMMORSX-SJORKVTESA-N	-1	0	364.873	2.875	50	0		FFAARM
O=C([O-])Cn1ncc2c3ccccc3n(Cc3ccccc3F)c2c1=O	ZINC000006751595	506504282	/nfs/dbraw/zinc/50/42/82/506504282.db2.gz	RHNYXBDPBUDQHD-UHFFFAOYSA-N	-1	0	351.337	2.623	50	0		FFAARM
Cc1csc2nc(C)c(S(=O)(=O)[N-]c3cc(C)ccc3C)c(=O)n12	ZINC000006784758	506507446	/nfs/dbraw/zinc/50/74/46/506507446.db2.gz	DGYADHFLRBOTKK-UHFFFAOYSA-N	-1	0	363.464	2.790	50	0		FFAARM
CCCNC(=O)c1ccccc1[N-]S(=O)(=O)c1ccc(F)cc1F	ZINC000006800786	506508656	/nfs/dbraw/zinc/50/86/56/506508656.db2.gz	DTDXJTCEAPCKOY-UHFFFAOYSA-N	-1	0	354.378	2.905	50	0		FFAARM
CCOC(=O)c1c(C)[nH]c(C)c1S(=O)(=O)[N-]c1cc(C)ccc1OC	ZINC000006887504	506514072	/nfs/dbraw/zinc/51/40/72/506514072.db2.gz	JNESLTCEXREYRT-UHFFFAOYSA-N	-1	0	366.439	2.926	50	0		FFAARM
CCOC(=O)c1c(C)n(C)c(C)c1S(=O)(=O)[N-]c1cccc(F)c1	ZINC000007002678	506524071	/nfs/dbraw/zinc/52/40/71/506524071.db2.gz	LWBLTOFQCATCKF-UHFFFAOYSA-N	-1	0	354.403	2.759	50	0		FFAARM
COc1ccc(S(=O)(=O)Nc2cc(C(=O)[O-])ccc2C)cc1OC	ZINC000007057402	506530585	/nfs/dbraw/zinc/53/05/85/506530585.db2.gz	ACWDKLOZPQUNJI-UHFFFAOYSA-N	-1	0	351.380	2.511	50	0		FFAARM
O=C1CCc2cc(S(=O)(=O)[N-]c3cccc4cccnc43)ccc2N1	ZINC000007709496	506584514	/nfs/dbraw/zinc/58/45/14/506584514.db2.gz	CYUROJHGORANHX-UHFFFAOYSA-N	-1	0	353.403	2.920	50	0		FFAARM
COc1ccc(S(=O)(=O)Nc2ccc(C)cc2C(=O)[O-])cc1OC	ZINC000042122800	506600738	/nfs/dbraw/zinc/60/07/38/506600738.db2.gz	JFIBOSHCLXTKNR-UHFFFAOYSA-N	-1	0	351.380	2.511	50	0		FFAARM
COc1cc(/C=C2\N=C(c3cccc(C)c3)OC2=O)ccc1OCC(=O)[O-]	ZINC000007925252	506602777	/nfs/dbraw/zinc/60/27/77/506602777.db2.gz	JPTRPUGHYQCEGP-DHDCSXOGSA-N	-1	0	367.357	2.812	50	0		FFAARM
O=C(Nc1ccccc1)Nc1ccc(S(=O)(=O)[N-]c2ncccn2)cc1	ZINC000008185225	506630184	/nfs/dbraw/zinc/63/01/84/506630184.db2.gz	AQJWYLVYNXEJGX-UHFFFAOYSA-N	-1	0	369.406	2.921	50	0		FFAARM
O=C([O-])COc1ccc(NC(=O)c2ccc(NC(=O)C3CC3)cc2)cc1	ZINC000008190946	506630271	/nfs/dbraw/zinc/63/02/71/506630271.db2.gz	HOGZFGLJBHBZES-UHFFFAOYSA-N	-1	0	354.362	2.751	50	0		FFAARM
COc1ccc(-c2cc(C(=O)[O-])n3nc(C(F)(F)F)nc3n2)cc1OC	ZINC000008342587	506644850	/nfs/dbraw/zinc/64/48/50/506644850.db2.gz	JBTWBNABPWCFRZ-UHFFFAOYSA-N	-1	0	368.271	2.526	50	0		FFAARM
O=C(CSc1n[nH]c(-c2ccccc2)n1)Nc1cccc(C(=O)[O-])c1	ZINC000009582261	506703800	/nfs/dbraw/zinc/70/38/00/506703800.db2.gz	JQRRKTCKHJHBQK-UHFFFAOYSA-N	-1	0	354.391	2.901	50	0		FFAARM
CCc1ccccc1NC(=O)c1cccc(N2C[C@@H](C(=O)[O-])CC2=O)c1	ZINC000009592135	506704868	/nfs/dbraw/zinc/70/48/68/506704868.db2.gz	ISVDLXNWWWHZCP-HNNXBMFYSA-N	-1	0	352.390	2.939	50	0		FFAARM
CC[C@H](C)[C@H](NC(=O)Cc1csc(-c2ccccc2OC)n1)C(=O)[O-]	ZINC000043735323	506774835	/nfs/dbraw/zinc/77/48/35/506774835.db2.gz	JUHBOQXNALNPGD-ZBEGNZNMSA-N	-1	0	362.451	2.977	50	0		FFAARM
O=C([O-])[C@@H]1CCC(=O)N(Cc2ccccc2)[C@H]1c1ccc2c(c1)OCO2	ZINC000012336762	506850744	/nfs/dbraw/zinc/85/07/44/506850744.db2.gz	QZLGYHOJUHNZKB-BEFAXECRSA-N	-1	0	353.374	2.980	50	0		FFAARM
CCOC(=O)[C@]([N-]c1cc(Cl)ccc1OC)(NC(C)=O)C(F)(F)F	ZINC000012412261	506861551	/nfs/dbraw/zinc/86/15/51/506861551.db2.gz	WBVICDUBYHFJPZ-CYBMUJFWSA-N	-1	0	368.739	2.718	50	0		FFAARM
Cc1ccc(Cl)cc1N1CCN(C(=O)[C@H]2CC=CC[C@H]2C(=O)[O-])CC1	ZINC000017074679	507115390	/nfs/dbraw/zinc/11/53/90/507115390.db2.gz	QCRHNPNJUYZFQQ-JKSUJKDBSA-N	-1	0	362.857	2.964	50	0		FFAARM
Cc1cc(=O)n2nc(CN(C(=O)CC(C)C)c3ccc(Cl)cc3)[n-]c2n1	ZINC000021796161	507268564	/nfs/dbraw/zinc/26/85/64/507268564.db2.gz	PNFZKNANNXTORC-UHFFFAOYSA-N	-1	0	373.844	2.959	50	0		FFAARM
CS(=O)(=O)[N-]c1nnc(NC(=O)c2cc3c(cccc3F)s2)s1	ZINC000047293355	507304174	/nfs/dbraw/zinc/30/41/74/507304174.db2.gz	DAALIQJFAWAKNV-UHFFFAOYSA-N	-1	0	372.428	2.516	50	0		FFAARM
CCc1ccc(OC)c(S(=O)(=O)[N-]c2ccc3c(c2)CCC(=O)N3C)c1	ZINC000022732868	507304921	/nfs/dbraw/zinc/30/49/21/507304921.db2.gz	YXFFZSJXTJKOEX-UHFFFAOYSA-N	-1	0	374.462	2.967	50	0		FFAARM
O=S(=O)(Cc1cc(Cl)c2c(c1)OCCO2)c1nc2ccccc2[n-]1	ZINC000047940202	507420418	/nfs/dbraw/zinc/42/04/18/507420418.db2.gz	JJGNJLGCGHWBQQ-UHFFFAOYSA-N	-1	0	364.810	2.961	50	0		FFAARM
COCc1cccc(NS(=O)(=O)c2cc(C(=O)[O-])cc(F)c2C)c1	ZINC000071798580	507716343	/nfs/dbraw/zinc/71/63/43/507716343.db2.gz	RKZRHODHENEZGH-UHFFFAOYSA-N	-1	0	353.371	2.780	50	0		FFAARM
CC(C)(C)[C@@H]1CCc2sc(C(=O)NCCCc3n[nH]c(=O)[n-]3)cc2C1	ZINC000072306789	507774572	/nfs/dbraw/zinc/77/45/72/507774572.db2.gz	HTISPNWTPNVPIN-GFCCVEGCSA-N	-1	0	362.499	2.673	50	0		FFAARM
Cc1cc2cc(C(=O)N3CCC(C(=O)[O-])(n4cccn4)CC3)ccc2o1	ZINC000072428631	507789261	/nfs/dbraw/zinc/78/92/61/507789261.db2.gz	FNQFVZSYGASUNC-UHFFFAOYSA-N	-1	0	353.378	2.654	50	0		FFAARM
CC(C)c1ccn(C2(C(=O)[O-])CCN(C(=O)c3cccc(F)c3)CC2)n1	ZINC000072447632	507792785	/nfs/dbraw/zinc/79/27/85/507792785.db2.gz	FNXGZJFEOZSFCE-UHFFFAOYSA-N	-1	0	359.401	2.862	50	0		FFAARM
CC(C)(C)c1ccn(C2(C(=O)[O-])CCN(C(=O)[C@@H]3CC=CCC3)CC2)n1	ZINC000072475750	507796212	/nfs/dbraw/zinc/79/62/12/507796212.db2.gz	BLWATTCNVJCPNR-OAHLLOKOSA-N	-1	0	359.470	2.939	50	0		FFAARM
O=C([O-])c1ccc(I)c(I)c1	ZINC000031576361	507820398	/nfs/dbraw/zinc/82/03/98/507820398.db2.gz	DFYULHRIYLAUJM-UHFFFAOYSA-N	-1	0	373.915	2.594	50	0		FFAARM
N#CCCN(c1ccc(F)cc1)S(=O)(=O)c1ccc(F)c(C(=O)[O-])c1	ZINC000078805954	507909545	/nfs/dbraw/zinc/90/95/45/507909545.db2.gz	TYGICCRNVIADMZ-UHFFFAOYSA-N	-1	0	366.345	2.772	50	0		FFAARM
COc1cc(C)cc(OC)c1[C@@H](C(=O)[O-])N(C)Cc1c(C)nn(C)c1C	ZINC000095357533	508175238	/nfs/dbraw/zinc/17/52/38/508175238.db2.gz	WSBWQTBLBYPWSY-SFHVURJKSA-N	-1	0	361.442	2.620	50	0		FFAARM
O=C([O-])[C@]12CN(C(=O)c3ccc(F)c(F)c3)C[C@H]1COc1ccccc1C2	ZINC000095363965	508177123	/nfs/dbraw/zinc/17/71/23/508177123.db2.gz	RSWFFVVCDUZFRN-VBKZILBWSA-N	-1	0	373.355	2.743	50	0		FFAARM
O=C([O-])c1ccc([C@H]2CCCN(C(=O)Cc3ccc(CO)cc3)C2)cc1	ZINC000095378223	508180589	/nfs/dbraw/zinc/18/05/89/508180589.db2.gz	KOOCQZVMZWAQKB-IBGZPJMESA-N	-1	0	353.418	2.826	50	0		FFAARM
Cc1cc(CN(C)[C@@H](C(=O)[O-])c2ccc(NC(=O)N3CCCC3)cc2)on1	ZINC000095384271	508181821	/nfs/dbraw/zinc/18/18/21/508181821.db2.gz	ZJARFEGWNVPPCX-QGZVFWFLSA-N	-1	0	372.425	2.868	50	0		FFAARM
CN(Cc1ccon1)[C@@H](C(=O)[O-])c1ccc(NC(=O)N2CCCC2)cc1	ZINC000095385509	508182004	/nfs/dbraw/zinc/18/20/04/508182004.db2.gz	BYEMBPZYYNAPEQ-MRXNPFEDSA-N	-1	0	358.398	2.560	50	0		FFAARM
CC1=NN(c2ccc(C(=O)N[C@H](C(=O)[O-])c3ccccc3F)cc2)CC1	ZINC000095464034	508187111	/nfs/dbraw/zinc/18/71/11/508187111.db2.gz	VGIPHNPHTANOOA-KRWDZBQOSA-N	-1	0	355.369	2.967	50	0		FFAARM
COc1cc(CNC(=O)c2ccc(-n3ccnc3)cc2)ccc1C(=O)[O-]	ZINC000095463936	508187121	/nfs/dbraw/zinc/18/71/21/508187121.db2.gz	YFCBYKRVYGRRGP-UHFFFAOYSA-N	-1	0	351.362	2.509	50	0		FFAARM
CN(C(=O)c1ccc2[n-]c(=S)oc2c1)[C@@H]1CCCC[C@@H]1S(C)(=O)=O	ZINC000129824108	508770221	/nfs/dbraw/zinc/77/02/21/508770221.db2.gz	QSLZAEORGQCJSO-OCCSQVGLSA-N	-1	0	368.480	2.544	50	0		FFAARM
COc1ccc(C[N@@H+](Cc2ccncc2)C[C@H]2CCCO2)cc1C(=O)[O-]	ZINC000216143392	509257707	/nfs/dbraw/zinc/25/77/07/509257707.db2.gz	MHNUAYWXNSGHGZ-QGZVFWFLSA-N	-1	0	356.422	2.970	50	0		FFAARM
O=C([O-])CC[C@@]1(CCC(=O)NCc2ccc3sccc3c2)CCC(=O)N1	ZINC000222330981	509313937	/nfs/dbraw/zinc/31/39/37/509313937.db2.gz	XXLMHOPFOZDULU-LJQANCHMSA-N	-1	0	374.462	2.811	50	0		FFAARM
CC(C)c1ncc(Cl)c(C(=O)N2Cc3ccccc3C[C@H]2C(=O)[O-])n1	ZINC000236625322	509467249	/nfs/dbraw/zinc/46/72/49/509467249.db2.gz	JMMROEJKQUBQTR-AWEZNQCLSA-N	-1	0	359.813	2.905	50	0		FFAARM
O=C([O-])[C@@H](Cc1ccccc1)NC(=O)CSc1ccc(F)c(F)c1	ZINC000170100023	509667632	/nfs/dbraw/zinc/66/76/32/509667632.db2.gz	VHMQBFOZFXRCPK-OAHLLOKOSA-N	-1	0	351.374	2.869	50	0		FFAARM
C[C@H](OCC(F)(F)F)C(=O)N1CCC(C(=O)[O-])(c2ccccc2)CC1	ZINC000237561619	509677746	/nfs/dbraw/zinc/67/77/46/509677746.db2.gz	CGRPTVROMWADMH-LBPRGKRZSA-N	-1	0	359.344	2.599	50	0		FFAARM
COc1ccccc1CNC(=O)c1c([O-])c2cccc3c2n(c1=O)[C@H](C)C3	ZINC000170624697	509683610	/nfs/dbraw/zinc/68/36/10/509683610.db2.gz	CUSZYVLZUUIPEX-GFCCVEGCSA-N	-1	0	364.401	2.763	50	0		FFAARM
CC(C)[C@@H]1CC[C@@H](C)CCN1C(=O)Cc1csc([N-]S(C)(=O)=O)n1	ZINC000170629880	509686118	/nfs/dbraw/zinc/68/61/18/509686118.db2.gz	SDNVLKRQEPLOKI-OCCSQVGLSA-N	-1	0	373.544	2.730	50	0		FFAARM
O=C([O-])C1CCN(C(=O)[C@H]2C[C@H]2c2cccc(Br)c2)CC1	ZINC000238030037	509802815	/nfs/dbraw/zinc/80/28/15/509802815.db2.gz	GSPSFIRDDMQGAD-KBPBESRZSA-N	-1	0	352.228	2.876	50	0		FFAARM
O=C([O-])CCN(C(=O)c1cc2ccc(Cl)cc2[nH]1)C1CCOCC1	ZINC000238077820	509816255	/nfs/dbraw/zinc/81/62/55/509816255.db2.gz	FIUHEWWPECJGBJ-UHFFFAOYSA-N	-1	0	350.802	2.917	50	0		FFAARM
O=C([O-])CN(C(=O)c1ccn(-c2cccc(C(F)(F)F)c2)n1)C1CC1	ZINC000238091089	509819983	/nfs/dbraw/zinc/81/99/83/509819983.db2.gz	FWTAOKNSACNSRA-UHFFFAOYSA-N	-1	0	353.300	2.580	50	0		FFAARM
O=C([O-])Cc1ccc(S(=O)(=O)N[C@@H]2CCC[C@@H](C(F)(F)F)C2)s1	ZINC000238107120	509821579	/nfs/dbraw/zinc/82/15/79/509821579.db2.gz	OOAUEXNPNNEZFV-RKDXNWHRSA-N	-1	0	371.402	2.775	50	0		FFAARM
CN(C(=O)c1ccc2c(c1)[n-]c(=S)[nH]c2=O)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C	ZINC000253534974	509886627	/nfs/dbraw/zinc/88/66/27/509886627.db2.gz	OMNZWFIPKBSAKB-IACUBPJLSA-N	-1	0	359.451	2.510	50	0		FFAARM
O=C([O-])[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1ccc(CN2CCCC2=O)cc1	ZINC000265534070	510103580	/nfs/dbraw/zinc/10/35/80/510103580.db2.gz	BREKUPJPNOEFLC-KURKYZTESA-N	-1	0	370.449	2.667	50	0		FFAARM
O=C([O-])[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)CCc1nnc(-c2ccccc2)o1	ZINC000265544338	510109061	/nfs/dbraw/zinc/10/90/61/510109061.db2.gz	FIRVKGSYFSHPBG-XHSDSOJGSA-N	-1	0	369.421	2.914	50	0		FFAARM
Cc1cc(S(=O)(=O)[N-]c2ccccc2-c2nnnn2C(C)C)c(C)o1	ZINC000181797553	510598892	/nfs/dbraw/zinc/59/88/92/510598892.db2.gz	BKAAQVFZPZZAGT-UHFFFAOYSA-N	-1	0	361.427	2.932	50	0		FFAARM
O=C([O-])[C@H]1CCCN(C(=O)N[C@@H](Cc2ccccn2)c2ccccc2)C1	ZINC000263408204	510694225	/nfs/dbraw/zinc/69/42/25/510694225.db2.gz	UHMCQACKDXSXKL-WMZOPIPTSA-N	-1	0	353.422	2.872	50	0		FFAARM
COc1cccc([C@@H]2CN(C(=O)CCc3ccccc3C(=O)[O-])CCO2)c1	ZINC000263540755	510742849	/nfs/dbraw/zinc/74/28/49/510742849.db2.gz	QSBPCEXDIHSVCO-IBGZPJMESA-N	-1	0	369.417	2.926	50	0		FFAARM
O=C([O-])c1cccc(CNC(=O)[C@@H]2C[C@H]2c2ccc3c(c2)OCCO3)c1	ZINC000299745948	511668646	/nfs/dbraw/zinc/66/86/46/511668646.db2.gz	UFKDTKSPSRUQJR-JKSUJKDBSA-N	-1	0	353.374	2.576	50	0		FFAARM
COc1ccc2c(c1)OC[C@H](C(=O)N(C)Cc1cc(C(=O)[O-])c(C)o1)C2	ZINC000299750898	511668965	/nfs/dbraw/zinc/66/89/65/511668965.db2.gz	ORMZWDGIULRITN-CYBMUJFWSA-N	-1	0	359.378	2.505	50	0		FFAARM
COc1ccc(S(=O)(=O)N2CCC(CCC(=O)[O-])CC2)cc1Cl	ZINC000275142401	512053676	/nfs/dbraw/zinc/05/36/76/512053676.db2.gz	PUUWVKUQYNPYTL-UHFFFAOYSA-N	-1	0	361.847	2.614	50	0		FFAARM
Cc1ccc(C)c(CC(=O)N2CCC[C@@H](c3ccnn3CC(=O)[O-])C2)c1	ZINC000426488376	513956109	/nfs/dbraw/zinc/95/61/09/513956109.db2.gz	UBALJHOQKBJGSI-MRXNPFEDSA-N	-1	0	355.438	2.533	50	0		FFAARM
O=C([O-])Cn1ccc([C@H]2CCCN(C(=O)c3cc4ccccc4cn3)C2)n1	ZINC000426538488	513974687	/nfs/dbraw/zinc/97/46/87/513974687.db2.gz	YTCHTKUDONAUOD-INIZCTEOSA-N	-1	0	364.405	2.536	50	0		FFAARM
O=C([O-])Cn1ccc([C@H]2CCCN(C(=O)Cc3ccccc3Cl)C2)n1	ZINC000426563448	513981534	/nfs/dbraw/zinc/98/15/34/513981534.db2.gz	NLMYIJYHZXBKRU-AWEZNQCLSA-N	-1	0	361.829	2.570	50	0		FFAARM
C[C@]1(c2ccccc2)CN(C(=O)c2cccc(OCC(=O)[O-])c2)CCO1	ZINC000537369694	517158607	/nfs/dbraw/zinc/15/86/07/517158607.db2.gz	VTSOIDCOQOLYQX-HXUWFJFHSA-N	-1	0	355.390	2.538	50	0		FFAARM
Cn1nc(C(=O)[O-])cc1C(=O)N(CCc1ccc(F)cc1)C1CCCC1	ZINC000630184027	522679174	/nfs/dbraw/zinc/67/91/74/522679174.db2.gz	YPTSWTWOCWVFAR-UHFFFAOYSA-N	-1	0	359.401	2.885	50	0		FFAARM
Cc1oc(CN(C)C(=O)c2cc3c(c(Cl)c2)OCO3)cc1C(=O)[O-]	ZINC000268936707	526769479	/nfs/dbraw/zinc/76/94/79/526769479.db2.gz	PAHVUDBJABICDV-UHFFFAOYSA-N	-1	0	351.742	2.941	50	0		FFAARM
O=S(=O)([N-]c1ccc(N2CCOCC2)cc1)c1cccc2cccnc21	ZINC000000635242	527250496	/nfs/dbraw/zinc/25/04/96/527250496.db2.gz	CQPNXIHYLVYZLV-UHFFFAOYSA-N	-1	0	369.446	2.872	50	0		FFAARM
O=C([O-])C1CCN(C(=O)COc2ccccc2OCc2ccccc2)CC1	ZINC000268935861	527563315	/nfs/dbraw/zinc/56/33/15/527563315.db2.gz	HBDZQKXSHPCVPY-UHFFFAOYSA-N	-1	0	369.417	2.968	50	0		FFAARM
O=C([O-])COc1cccc(CNC(=O)[C@@H]2SCCc3sccc32)c1	ZINC000268901588	527618721	/nfs/dbraw/zinc/61/87/21/527618721.db2.gz	FXBBGOVTJDZLEV-MRXNPFEDSA-N	-1	0	363.460	2.858	50	0		FFAARM
CCN1C(=O)CCc2cc(S(=O)(=O)[N-]c3ncc(C)s3)ccc21	ZINC000257173058	535430223	/nfs/dbraw/zinc/43/02/23/535430223.db2.gz	BVVZMDXDBYEUTE-UHFFFAOYSA-N	-1	0	351.453	2.551	50	0		FFAARM
CCOc1ccc(-c2ccnc(N3CCC[C@](C)(O)C3)n2)cc1C(=O)[O-]	ZINC000072480225	535692767	/nfs/dbraw/zinc/69/27/67/535692767.db2.gz	BIBDASKRQGRSEP-IBGZPJMESA-N	-1	0	357.410	2.592	50	0		FFAARM
COC(=O)N1CCCc2cc(NC(=O)[C@H]3CC=CC[C@@H]3C(=O)[O-])ccc21	ZINC000006668248	536426780	/nfs/dbraw/zinc/42/67/80/536426780.db2.gz	KPFUFQIEFZZIBO-GJZGRUSLSA-N	-1	0	358.394	2.811	50	0		FFAARM
Cc1noc(C)c1COC(=O)c1cc(Cl)ccc1[N-]S(C)(=O)=O	ZINC000049999752	570966935	/nfs/dbraw/zinc/96/69/35/570966935.db2.gz	GCXMDZOEZHRRSU-UHFFFAOYSA-N	-1	0	358.803	2.673	50	0		FFAARM
COc1ccc(C(C)(C)C(=O)[N-]S(=O)(=O)c2cncc(Cl)c2)cc1	ZINC000119238141	571097346	/nfs/dbraw/zinc/09/73/46/571097346.db2.gz	QFTGPQXLUSOXDP-UHFFFAOYSA-N	-1	0	368.842	2.526	50	0		FFAARM
O=C([O-])[C@H](CC(F)F)NC(=O)c1cccc(Br)c1Cl	ZINC000261580453	729650359	/nfs/dbraw/zinc/65/03/59/729650359.db2.gz	FISLIFUPEVOFGC-ZETCQYMHSA-N	-1	0	356.550	2.941	50	0		FFAARM
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)c1c([O-])cc(F)cc1F	ZINC000130286639	1013306955	/nfs/dbraw/zinc/30/69/55/1013306955.db2.gz	RRXNIXLDIWOAOM-OAHLLOKOSA-N	-1	0	360.360	2.591	50	0		FFAARM
O=C([O-])c1ccccc1C=NNC(=O)CNc1cccc(C(F)(F)F)c1	ZINC000254315854	982070583	/nfs/dbraw/zinc/07/05/83/982070583.db2.gz	DFFKXQNKZCQVHA-UHFFFAOYSA-N	-1	0	365.311	2.966	50	0		FFAARM
O=C(N[C@H]1CC[C@H](O)CC1)c1ccccc1[N-]S(=O)(=O)c1ccccc1	ZINC000864097190	1024043932	/nfs/dbraw/zinc/04/39/32/1024043932.db2.gz	LQEQAQYNVAFMLT-SHTZXODSSA-N	-1	0	374.462	2.521	50	0		FFAARM
Cc1c(C(=O)N[C@H]2C[C@H](C(=O)[O-])c3ccccc32)cnn1C1CCOCC1	ZINC000653327136	1024901855	/nfs/dbraw/zinc/90/18/55/1024901855.db2.gz	RBCQQMZHALPHJU-WMZOPIPTSA-N	-1	0	369.421	2.586	50	0		FFAARM
COc1cc(N[C@@H]2CCCN(C(=O)C3(C(=O)[O-])CC=CC3)C2)cc(OC)c1	ZINC000663044807	1026582397	/nfs/dbraw/zinc/58/23/97/1026582397.db2.gz	BTBJITSLOMKDTM-CQSZACIVSA-N	-1	0	374.437	2.528	50	0		FFAARM
CC[C@H](C)[C@@H](NC(=O)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1)C(=O)[O-]	ZINC000236976814	1031709050	/nfs/dbraw/zinc/70/90/50/1031709050.db2.gz	YCKHWAZAWYDYAM-MEDUHNTESA-N	-1	0	359.426	2.674	50	0		FFAARM
COc1ccc(OC)c([C@@H](C(=O)[O-])N(C)Cc2cnc3ccccn23)c1	ZINC001506419835	1059509350	/nfs/dbraw/zinc/50/93/50/1059509350.db2.gz	YDRLDVVFTNECLC-SFHVURJKSA-N	-1	0	355.394	2.609	50	0		FFAARM
O=C([O-])/C=C/C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1	ZINC000000319758	210250773	/nfs/dbraw/zinc/25/07/73/210250773.db2.gz	DQLGXAYUAURASJ-VAWYXSNFSA-N	-1	0	350.418	2.561	50	0		FFAARM
CCO[C@@H]1C[C@H](O)C12CCN(C(=O)c1ccc3[n-]c(=S)oc3c1)CC2	ZINC000175191500	222615051	/nfs/dbraw/zinc/61/50/51/222615051.db2.gz	PNBQRYVVBYUBDN-LSDHHAIUSA-N	-1	0	362.451	2.509	50	0		FFAARM
O=C([O-])C[C@@H](NCc1ccco1)C(=O)Nc1nc(-c2ccccc2)cs1	ZINC000008771275	539493064	/nfs/dbraw/zinc/49/30/64/539493064.db2.gz	LPNJEDWBOQUBJM-CQSZACIVSA-N	-1	0	371.418	2.975	50	0		FFAARM
O=C([O-])C1CCN(S(=O)(=O)Cc2c(Cl)cccc2Cl)CC1	ZINC000226087308	222882225	/nfs/dbraw/zinc/88/22/25/222882225.db2.gz	FVOIBGCFCVWZLP-UHFFFAOYSA-N	-1	0	352.239	2.620	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)CCCc2cc(Cl)sc2Cl)CCO1	ZINC000237961364	222912440	/nfs/dbraw/zinc/91/24/40/222912440.db2.gz	IQHAERKOUJIUBI-VIFPVBQESA-N	-1	0	352.239	2.690	50	0		FFAARM
O=C([O-])CCN(C(=O)Cn1ccc2ccc(Cl)cc21)C1CCOCC1	ZINC000238067194	222913085	/nfs/dbraw/zinc/91/30/85/222913085.db2.gz	GKTJLVVJRSYWSD-UHFFFAOYSA-N	-1	0	364.829	2.777	50	0		FFAARM
O=C([O-])c1cccc(CNC(=O)C2(c3ccc(F)cc3)CCOCC2)c1	ZINC000238213767	222915178	/nfs/dbraw/zinc/91/51/78/222915178.db2.gz	DUPGNGLRVYFVHI-UHFFFAOYSA-N	-1	0	357.381	2.889	50	0		FFAARM
O=C([O-])c1cccc(S(=O)(=O)Nc2ccc3c(c2)OC(F)(F)O3)c1	ZINC000012521263	220001516	/nfs/dbraw/zinc/00/15/16/220001516.db2.gz	AZZBSJKHEMCALI-UHFFFAOYSA-N	-1	0	357.290	2.507	50	0		FFAARM
CCOC(=O)c1c(C)c(S(=O)(=O)[N-]c2ccc(F)cc2)c(C)n1C	ZINC000064863143	212046862	/nfs/dbraw/zinc/04/68/62/212046862.db2.gz	QDAUVUKTRBKXBG-UHFFFAOYSA-N	-1	0	354.403	2.759	50	0		FFAARM
COc1ccc2c(c1)S[C@H](CC(=O)Nc1ccc(C(=O)[O-])cc1)C(=O)N2	ZINC000061720351	212024919	/nfs/dbraw/zinc/02/49/19/212024919.db2.gz	AQVIJQWBQXNBSQ-OAHLLOKOSA-N	-1	0	372.402	2.835	50	0		FFAARM
COc1cc(C)c(S(=O)(=O)Nc2ccc(F)cc2C(=O)[O-])cc1C	ZINC000058380547	212008277	/nfs/dbraw/zinc/00/82/77/212008277.db2.gz	VLNLNKGOMKDIGW-UHFFFAOYSA-N	-1	0	353.371	2.950	50	0		FFAARM
CC(C)(C)c1ccccc1OCC(=O)N(CCC(=O)[O-])C1CCOCC1	ZINC000299750973	211835261	/nfs/dbraw/zinc/83/52/61/211835261.db2.gz	OYFSKWFGZNELHK-UHFFFAOYSA-N	-1	0	363.454	2.845	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)CCc1ccc2c(c1)OCCO2)c1ccc(F)cc1	ZINC000299745998	211826096	/nfs/dbraw/zinc/82/60/96/211826096.db2.gz	UQCAVBSSPFPXIG-MRXNPFEDSA-N	-1	0	373.380	2.862	50	0		FFAARM
CCOc1ccc(-n2c(=O)c3[n-][nH]n(Cc4cccc(F)c4)c=3c2=O)cc1	ZINC000021778520	211325054	/nfs/dbraw/zinc/32/50/54/211325054.db2.gz	HJYJMWWTZMIHLW-DLBZAZTESA-N	-1	0	368.368	2.718	50	0		FFAARM
O=C([O-])[C@@H]1CCCN(C(=O)Cn2ccc3cc(Br)ccc32)C1	ZINC000020726914	211292657	/nfs/dbraw/zinc/29/26/57/211292657.db2.gz	CMWIZKDENDNHOY-GFCCVEGCSA-N	-1	0	365.227	2.727	50	0		FFAARM
Cn1c(=O)c2ccc(C(=O)NCCSc3ccccc3)cc2[n-]c1=S	ZINC000018214781	211196270	/nfs/dbraw/zinc/19/62/70/211196270.db2.gz	JMDDXGIVFHLKQN-UHFFFAOYSA-N	-1	0	371.487	2.744	50	0		FFAARM
NC(=O)c1c(NC(=O)C[C@H](C(=O)[O-])c2ccccc2)sc2c1CCC2	ZINC000013254971	211027952	/nfs/dbraw/zinc/02/79/52/211027952.db2.gz	CGCNJQPAHJQHMX-LBPRGKRZSA-N	-1	0	358.419	2.533	50	0		FFAARM
O=C([O-])CN(Cc1ccco1)S(=O)(=O)c1ccc(Cl)c(Cl)c1	ZINC000002633015	210410288	/nfs/dbraw/zinc/41/02/88/210410288.db2.gz	VFMNMLNDTXMIID-UHFFFAOYSA-N	-1	0	364.206	2.862	50	0		FFAARM
O=C([O-])C[C@H](NCc1ccco1)C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000001884654	210373992	/nfs/dbraw/zinc/37/39/92/210373992.db2.gz	QVAURIZCXYLCEN-ZDUSSCGKSA-N	-1	0	356.300	2.870	50	0		FFAARM
O=C1c2ccccc2N[C@@H](c2ccco2)N1[N-]S(=O)(=O)c1ccccc1	ZINC000001441641	210352914	/nfs/dbraw/zinc/35/29/14/210352914.db2.gz	QNOUUJYNWOHGAU-QGZVFWFLSA-N	-1	0	369.402	2.740	50	0		FFAARM
Cc1oc(-c2ccc3c(c2)OCCO3)cc1C(=O)N[C@H](C(=O)[O-])C(C)C	ZINC000001105315	210316767	/nfs/dbraw/zinc/31/67/67/210316767.db2.gz	MTSNQZACVRBVTI-KRWDZBQOSA-N	-1	0	359.378	2.865	50	0		FFAARM
CC(C)(C)[C@H]1CCc2c(sc(NC(=O)CCC(=O)[O-])c2C(N)=O)C1	ZINC000000908713	210288092	/nfs/dbraw/zinc/28/80/92/210288092.db2.gz	WQRIMHPJBNLIPB-VIFPVBQESA-N	-1	0	352.456	2.801	50	0		FFAARM
Cc1ccc(C)c(OCC(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)[O-])c1	ZINC000000790587	210271137	/nfs/dbraw/zinc/27/11/37/210271137.db2.gz	XARTUSSXSHKXQV-GOSISDBHSA-N	-1	0	366.417	2.976	50	0		FFAARM
O=C([O-])c1cc(NS(=O)(=O)c2ccc3c(c2)OCCO3)ccc1Cl	ZINC000047318074	220992646	/nfs/dbraw/zinc/99/26/46/220992646.db2.gz	LGHZTYHOULPFTP-UHFFFAOYSA-N	-1	0	369.782	2.610	50	0		FFAARM
C[C@H](Cc1ccccc1F)NC(=O)c1cc(F)ccc1[N-]S(C)(=O)=O	ZINC000056146831	221078526	/nfs/dbraw/zinc/07/85/26/221078526.db2.gz	IGXCZJKTYIZGID-LLVKDONJSA-N	-1	0	368.405	2.697	50	0		FFAARM
CC(=O)N1CCc2sc(S(=O)(=O)[N-]c3ccc(C)cc3)cc2C1	ZINC000065196130	221178308	/nfs/dbraw/zinc/17/83/08/221178308.db2.gz	NYZUJLHNPPJZHU-UHFFFAOYSA-N	-1	0	350.465	2.762	50	0		FFAARM
O=C([O-])c1cc2n(n1)CCN(C(=O)c1ccc(Oc3ccccc3)o1)C2	ZINC000065381907	221207678	/nfs/dbraw/zinc/20/76/78/221207678.db2.gz	MTPMMMRVSXHJQE-UHFFFAOYSA-N	-1	0	353.334	2.623	50	0		FFAARM
Cc1ccc2[nH]c(=O)c(-c3nc(-c4ccc5c(c4)OCO5)no3)c([O-])c2c1	ZINC000065248658	221187046	/nfs/dbraw/zinc/18/70/46/221187046.db2.gz	BJQUDPJPCOCKIF-UHFFFAOYSA-N	-1	0	363.329	2.988	50	0		FFAARM
O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)[N-]O[C@H]1CCCCO1	ZINC000065496384	221227542	/nfs/dbraw/zinc/22/75/42/221227542.db2.gz	PPABBQWELRDXJW-IBGZPJMESA-N	-1	0	354.406	2.658	50	0		FFAARM
CC1(C)[C@H](C(=O)[O-])[C@@H]1C(=O)Nc1ccc(F)c(C(=O)Nc2cccnc2)c1	ZINC000071289108	221340345	/nfs/dbraw/zinc/34/03/45/221340345.db2.gz	VHNLFDDIVPXBAZ-CABCVRRESA-N	-1	0	371.368	2.768	50	0		FFAARM
CC(=O)N1CCc2c(sc3[n-]c(=S)n(Cc4ccco4)c(=O)c32)C1	ZINC000071289367	221340591	/nfs/dbraw/zinc/34/05/91/221340591.db2.gz	VUWWJEWXNWGHET-UHFFFAOYSA-N	-1	0	361.448	2.666	50	0		FFAARM
COc1ccc(-c2cc(C(=O)[O-])cc(S(=O)(=O)NC3CC3)c2)c(C)c1	ZINC000071524173	221350938	/nfs/dbraw/zinc/35/09/38/221350938.db2.gz	QZSHHSAEVYTXIC-UHFFFAOYSA-N	-1	0	361.419	2.810	50	0		FFAARM
Cc1n[nH]c(C)c1CCC(=O)N1CCC[C@@](Cc2ccccc2)(C(=O)[O-])C1	ZINC000071756817	221364665	/nfs/dbraw/zinc/36/46/65/221364665.db2.gz	RBTHZCASVCXSNS-NRFANRHFSA-N	-1	0	369.465	2.895	50	0		FFAARM
CCC[C@@H]1CCc2sc(C(=O)N3CCC(O)(C(=O)[O-])CC3)cc2C1	ZINC000071764663	221370849	/nfs/dbraw/zinc/37/08/49/221370849.db2.gz	MEPLAKFLCFOJAK-GFCCVEGCSA-N	-1	0	351.468	2.705	50	0		FFAARM
CCOC(=O)c1cc([N-]S(=O)(=O)c2cc(Cl)ccc2C)cn1C	ZINC000072306284	221461007	/nfs/dbraw/zinc/46/10/07/221461007.db2.gz	ZUXPJZMWVGJUAT-UHFFFAOYSA-N	-1	0	356.831	2.964	50	0		FFAARM
CCn1nc(C)c(S(=O)(=O)[N-]c2ncc(Br)cc2C)c1C	ZINC000331111923	258177380	/nfs/dbraw/zinc/17/73/80/258177380.db2.gz	LOPLROYQIBFRGS-UHFFFAOYSA-N	-1	0	373.276	2.787	50	0		FFAARM
CC(=O)N1CC2(C[C@@H]1C(=O)[O-])CCN(c1nccc3ccccc31)CC2	ZINC000082115785	132195681	/nfs/dbraw/zinc/19/56/81/132195681.db2.gz	AQOOSOYOAPGSFN-QGZVFWFLSA-N	-1	0	353.422	2.527	50	0		FFAARM
CCc1nn(C)c(Cl)c1CN1CCN(c2ccc(C(=O)[O-])cc2)CC1	ZINC000097155774	132228118	/nfs/dbraw/zinc/22/81/18/132228118.db2.gz	GNZCEHLAXWGXLZ-UHFFFAOYSA-N	-1	0	362.861	2.656	50	0		FFAARM
Cc1ccc(N2CCC(C(=O)NCc3ccc(C(=O)[O-])cc3)CC2)nc1	ZINC000237875261	132248477	/nfs/dbraw/zinc/24/84/77/132248477.db2.gz	FVKLSCYGFFLOMD-UHFFFAOYSA-N	-1	0	353.422	2.621	50	0		FFAARM
O=C([O-])C[C@@H]1Oc2ccccc2N(CCCOCc2ccccc2)C1=O	ZINC000055308987	136126498	/nfs/dbraw/zinc/12/64/98/136126498.db2.gz	NTWVOIMKGUFMBE-SFHVURJKSA-N	-1	0	355.390	2.862	50	0		FFAARM
COc1cccc(SCC(=O)N2C[C@@H](c3ccncc3)[C@H](C(=O)[O-])C2)c1	ZINC000091951166	221818656	/nfs/dbraw/zinc/81/86/56/221818656.db2.gz	HPTQAYZHHYYHGM-DLBZAZTESA-N	-1	0	372.446	2.509	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)c1cccc(-n2cccn2)c1)c1ccc(F)cc1	ZINC000095362410	221864002	/nfs/dbraw/zinc/86/40/02/221864002.db2.gz	SPHPNZHCMUGFEV-QGZVFWFLSA-N	-1	0	353.353	2.957	50	0		FFAARM
CC1=C(C(=O)N2CCC[C@@H](c3ccc(C(=O)[O-])cc3)C2)SC2=NCCN12	ZINC000095380762	221885093	/nfs/dbraw/zinc/88/50/93/221885093.db2.gz	ZTSYHDBCPOIPEB-OAHLLOKOSA-N	-1	0	371.462	2.741	50	0		FFAARM
Cc1nn(C)c(C)c1C[C@H](C)C(=O)N[C@@H](C(=O)[O-])c1ccccc1Cl	ZINC000095464031	221911538	/nfs/dbraw/zinc/91/15/38/221911538.db2.gz	LMNPMQZBKUOUCZ-MGPLVRAMSA-N	-1	0	363.845	2.811	50	0		FFAARM
O=C([O-])[C@@H](NC(=O)COc1ccc(F)cc1F)c1cccc(F)c1F	ZINC000095517454	221942220	/nfs/dbraw/zinc/94/22/20/221942220.db2.gz	JKNSBMLAGFCQJG-HNNXBMFYSA-N	-1	0	357.259	2.564	50	0		FFAARM
Cn1cc(/C=C\c2nc3ccccc3c(=O)n2-c2ccc(C(=O)[O-])cc2)cn1	ZINC000096939808	222145400	/nfs/dbraw/zinc/14/54/00/222145400.db2.gz	QGAVIVBVVODHDP-WDZFZDKYSA-N	-1	0	372.384	2.988	50	0		FFAARM
O=C([O-])c1cccc2c3c([nH]c21)CCN(S(=O)(=O)Cc1ccccc1)C3	ZINC000097160148	222164177	/nfs/dbraw/zinc/16/41/77/222164177.db2.gz	HMTCPJFJRMRBHC-UHFFFAOYSA-N	-1	0	370.430	2.754	50	0		FFAARM
O=C([O-])CCCCCCCNS(=O)(=O)c1ccc(C(F)(F)F)nc1	ZINC000097165122	222166608	/nfs/dbraw/zinc/16/66/08/222166608.db2.gz	YKZLHJMKRLKSDR-UHFFFAOYSA-N	-1	0	368.377	2.804	50	0		FFAARM
O=C(NCc1ccccc1F)c1c([O-])c2cccc3c2n(c1=O)CCC3	ZINC000100613664	222247917	/nfs/dbraw/zinc/24/79/17/222247917.db2.gz	PEROWVFEVZUNPX-UHFFFAOYSA-N	-1	0	352.365	2.722	50	0		FFAARM
COc1ccc(NC(=O)c2c([O-])c3cccc4c3n(c2=O)CCC4)cc1	ZINC000100613766	222248253	/nfs/dbraw/zinc/24/82/53/222248253.db2.gz	RQRLHHLEXDRNSK-UHFFFAOYSA-N	-1	0	350.374	2.914	50	0		FFAARM
CCCCn1c2ccccc2c([O-])c(C(=O)Nc2nnc(C)s2)c1=O	ZINC000100965231	222257840	/nfs/dbraw/zinc/25/78/40/222257840.db2.gz	VJELGBFQTIPPDF-UHFFFAOYSA-N	-1	0	358.423	2.919	50	0		FFAARM
CCOc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccccc4)c=3c2=O)cc1	ZINC000101417724	222274036	/nfs/dbraw/zinc/27/40/36/222274036.db2.gz	VKVRKORTRNWXTE-IRXDYDNUSA-N	-1	0	350.378	2.579	50	0		FFAARM
Cc1ccccc1Cn1[nH][n-]c2c(=O)n(-c3ccc(F)c(F)c3)c(=O)c1=2	ZINC000101418097	222274661	/nfs/dbraw/zinc/27/46/61/222274661.db2.gz	WPCAHZSGHCNMNV-JKSUJKDBSA-N	-1	0	356.332	2.767	50	0		FFAARM
C[C@H](NC(=O)c1ccc2c(c1)[n-]c(=S)n(C)c2=O)c1cccc(F)c1	ZINC000102173296	222290440	/nfs/dbraw/zinc/29/04/40/222290440.db2.gz	KUVWCLVYVZDEBG-JTQLQIEISA-N	-1	0	357.410	2.852	50	0		FFAARM
Cc1ccc(N2C(=O)[C@@H]3C(C(=O)c4ccc(Cl)cc4)=NOC3=C2[O-])cc1	ZINC000103118669	222321770	/nfs/dbraw/zinc/32/17/70/222321770.db2.gz	LJWXLMOQRWMLFW-PBHICJAKSA-N	-1	0	368.776	2.776	50	0		FFAARM
O=C([O-])CN(c1ccc(Br)cc1)S(=O)(=O)c1ccccc1	ZINC000004714206	506390535	/nfs/dbraw/zinc/39/05/35/506390535.db2.gz	GVGQYKZSEMZUKZ-UHFFFAOYSA-N	-1	0	370.224	2.729	50	0		FFAARM
O=C([O-])[C@@H]1CC=CC[C@H]1C(=O)Nc1ccccc1C(=O)NCc1ccco1	ZINC000001019555	506244282	/nfs/dbraw/zinc/24/42/82/506244282.db2.gz	STQFQNBZRUSIST-HUUCEWRRSA-N	-1	0	368.389	2.815	50	0		FFAARM
Cc1ccc(S(=O)(=O)[N-]C(=O)Nc2cc(-c3ccccc3)nn2C)cc1	ZINC000001035095	506244464	/nfs/dbraw/zinc/24/44/64/506244464.db2.gz	IUUYSBDPLSYUFI-UHFFFAOYSA-N	-1	0	370.434	2.906	50	0		FFAARM
CCCCOC(=O)Nc1ccc(S(=O)(=O)[N-]c2nnc(C)s2)cc1	ZINC000001663341	506267334	/nfs/dbraw/zinc/26/73/34/506267334.db2.gz	CICMOJZPXPKXDI-UHFFFAOYSA-N	-1	0	370.456	2.996	50	0		FFAARM
CCn1c2ccsc2c([O-])c(C(=O)Nc2ccccc2C(=O)OC)c1=O	ZINC000065215437	506270481	/nfs/dbraw/zinc/27/04/81/506270481.db2.gz	ZVEGFZFCGQKDFS-UHFFFAOYSA-N	-1	0	372.402	2.827	50	0		FFAARM
Cc1ccc(N2C(=O)C[C@H](Sc3ncccc3C(=O)[O-])C2=O)c(C)c1	ZINC000002890044	506299911	/nfs/dbraw/zinc/29/99/11/506299911.db2.gz	BCDKCERGWIBYHV-AWEZNQCLSA-N	-1	0	356.403	2.821	50	0		FFAARM
O=C(N[C@@H](c1cccs1)C1CCCC1)c1c[nH]c2nc(=O)[n-]c(=O)c-2c1	ZINC000053108639	506314254	/nfs/dbraw/zinc/31/42/54/506314254.db2.gz	TUYKIOMKRGRVSP-CQSZACIVSA-N	-1	0	370.434	2.747	50	0		FFAARM
COC(=O)c1ccccc1NC(=O)Cc1c2ccccc2n(C)c1C(=O)[O-]	ZINC000003660286	506350060	/nfs/dbraw/zinc/35/00/60/506350060.db2.gz	QYQZCYMRPCPYBI-UHFFFAOYSA-N	-1	0	366.373	2.844	50	0		FFAARM
COc1ccc(/C=C2\SC(=O)N(CC(=O)[O-])C2=O)cc1Br	ZINC000033291195	506353344	/nfs/dbraw/zinc/35/33/44/506353344.db2.gz	YLSDSCIXQLKNAO-YHYXMXQVSA-N	-1	0	372.196	2.579	50	0		FFAARM
O=C([O-])c1c(C(F)(F)F)nc2ccc(I)cn21	ZINC000004002410	506355460	/nfs/dbraw/zinc/35/54/60/506355460.db2.gz	XYBUMLCHWKYLTD-UHFFFAOYSA-N	-1	0	356.041	2.656	50	0		FFAARM
Nc1nonc1-n1nnc(C(=O)[O-])c1-c1ccc(C2CCCCC2)cc1	ZINC000004281586	506368007	/nfs/dbraw/zinc/36/80/07/506368007.db2.gz	CJDFLOGYGBAZAP-UHFFFAOYSA-N	-1	0	354.370	2.645	50	0		FFAARM
O=C(CCc1nnc(-c2ccccc2F)[n-]c1=O)NCCc1ccccc1	ZINC000034767744	506370946	/nfs/dbraw/zinc/37/09/46/506370946.db2.gz	SWBAEWJVQZJBPV-UHFFFAOYSA-N	-1	0	366.396	2.675	50	0		FFAARM
COC(=O)C(Sc1c([O-])cc(C)oc1=O)(C(F)(F)F)C(F)(F)F	ZINC000004577603	506382651	/nfs/dbraw/zinc/38/26/51/506382651.db2.gz	UCODBRMDVNVWKW-UHFFFAOYSA-N	-1	0	366.235	2.782	50	0		FFAARM
O=C([O-])c1ccc(-n2nnnc2Oc2ccc(Br)cc2)cc1	ZINC000004597932	506384409	/nfs/dbraw/zinc/38/44/09/506384409.db2.gz	FRVLZXKVJYDAIS-UHFFFAOYSA-N	-1	0	361.155	2.915	50	0		FFAARM
COC(=O)C[C@H](NC(=O)[C@H]1CCCC[C@@H]1C(=O)[O-])c1cc(C)ccc1C	ZINC000004590174	506384777	/nfs/dbraw/zinc/38/47/77/506384777.db2.gz	UIZSNGWYNLFTHM-ZOBUZTSGSA-N	-1	0	361.438	2.915	50	0		FFAARM
CCc1ccccc1NC(=O)[C@@H](Cc1ccccc1OC)c1nnn[n-]1	ZINC000004674813	506386169	/nfs/dbraw/zinc/38/61/69/506386169.db2.gz	BHYOGFLJEUUBFA-HNNXBMFYSA-N	-1	0	351.410	2.736	50	0		FFAARM
O=C([O-])CN(Cc1ccc(F)cc1)S(=O)(=O)c1ccc(Cl)cc1	ZINC000004641528	506387226	/nfs/dbraw/zinc/38/72/26/506387226.db2.gz	JUZNVNYXTXIOKO-UHFFFAOYSA-N	-1	0	357.790	2.755	50	0		FFAARM
CCCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C(=O)[O-])C(C)C	ZINC000004760611	506393152	/nfs/dbraw/zinc/39/31/52/506393152.db2.gz	SPAQWPZGFYWELB-CVEARBPZSA-N	-1	0	364.442	2.697	50	0		FFAARM
Cc1occc1-c1nnc(SCc2nc(=O)c3sccc3[n-]2)n1C	ZINC000004938533	506408235	/nfs/dbraw/zinc/40/82/35/506408235.db2.gz	NNJXDHHPIYHEJX-UHFFFAOYSA-N	-1	0	359.436	2.974	50	0		FFAARM
O=C(NC[C@@H](c1cccs1)N1CCOCC1)c1c([O-])cc(F)cc1F	ZINC000066041905	506413722	/nfs/dbraw/zinc/41/37/22/506413722.db2.gz	IPQXEYHKNTWHDZ-ZDUSSCGKSA-N	-1	0	368.405	2.535	50	0		FFAARM
O=C(N[C@@]1(C(F)(F)F)[N-]c2nc3ccccc3n2C1=O)c1ccccc1	ZINC000005209851	506428579	/nfs/dbraw/zinc/42/85/79/506428579.db2.gz	HMNWHHJKIKCOET-MRXNPFEDSA-N	-1	0	360.295	2.791	50	0		FFAARM
O=C([O-])[C@@H]1C2CCC(CC2)[C@@H]1C(=O)N1CCN(Cc2ccc(F)cc2)CC1	ZINC000006727046	506500649	/nfs/dbraw/zinc/50/06/49/506500649.db2.gz	BEYAEIJMMUGRIU-YVZJPGBNSA-N	-1	0	374.456	2.607	50	0		FFAARM
COc1ccccc1[N-]S(=O)(=O)c1ccc2c(c1)C[C@@H](C)N2C(C)=O	ZINC000006729993	506501169	/nfs/dbraw/zinc/50/11/69/506501169.db2.gz	BBYHTSJFZJGYIJ-GFCCVEGCSA-N	-1	0	360.435	2.794	50	0		FFAARM
CCOC(=O)c1c(C)n(C)c(C)c1S(=O)(=O)[N-]c1ccc(F)c(F)c1	ZINC000007006930	506526101	/nfs/dbraw/zinc/52/61/01/506526101.db2.gz	BHFUSSBLXPRROF-UHFFFAOYSA-N	-1	0	372.393	2.898	50	0		FFAARM
CC[C@@H](C)NC(=O)c1ccccc1[N-]S(=O)(=O)c1c(C)noc1C	ZINC000007054184	506528391	/nfs/dbraw/zinc/52/83/91/506528391.db2.gz	BBYZOMHDAYRUOZ-SNVBAGLBSA-N	-1	0	351.428	2.621	50	0		FFAARM
Cc1ccc(C2=Nn3c(nnc3[C@@H]3CCCO3)S[C@@H]2CC(=O)[O-])cc1	ZINC000008428705	506649495	/nfs/dbraw/zinc/64/94/95/506649495.db2.gz	UPWGLMBITHDUMP-QWHCGFSZSA-N	-1	0	358.423	2.639	50	0		FFAARM
CCOC(=O)c1cnc([N-]c2nc(C)c3cc(OC)ccc3n2)nc1C	ZINC000009305501	506689170	/nfs/dbraw/zinc/68/91/70/506689170.db2.gz	NQIGMLMHXSHZGT-UHFFFAOYSA-N	-1	0	353.382	2.966	50	0		FFAARM
Cc1cc([C@@H](C(=O)[O-])N(C)Cc2nc(-c3ccncc3)no2)ccc1F	ZINC000055393482	506741532	/nfs/dbraw/zinc/74/15/32/506741532.db2.gz	CEIHOLAUKOJACB-INIZCTEOSA-N	-1	0	356.357	2.837	50	0		FFAARM
O=C([O-])[C@H](Cc1ccccc1)NC(=O)CCn1ccc2ccc(F)cc21	ZINC000011866026	506799043	/nfs/dbraw/zinc/79/90/43/506799043.db2.gz	NQEDZORQBDRZQV-KRWDZBQOSA-N	-1	0	354.381	2.983	50	0		FFAARM
COC(=O)c1ccc(CSc2nnc(-c3ccccc3)c(=O)[n-]2)cc1	ZINC000011990964	506808023	/nfs/dbraw/zinc/80/80/23/506808023.db2.gz	VKZFMGBCGBVPIB-UHFFFAOYSA-N	-1	0	353.403	2.911	50	0		FFAARM
O=S(=O)([N-]c1ccn(Cc2ccccc2)n1)c1ccc2c(c1)OCCO2	ZINC000055635839	506808683	/nfs/dbraw/zinc/80/86/83/506808683.db2.gz	DLGWTHZQBIFSIB-UHFFFAOYSA-N	-1	0	371.418	2.503	50	0		FFAARM
CCOC(=O)N1CCN([C@H](C(=O)[O-])c2c[nH]c3ccc(Cl)cc32)CC1	ZINC000012408941	506860163	/nfs/dbraw/zinc/86/01/63/506860163.db2.gz	SKTXPNPLTCLDFJ-HNNXBMFYSA-N	-1	0	365.817	2.721	50	0		FFAARM
O=c1nc(Nc2ccc3c(c2)OCCO3)[n-]nc1Cc1ccc(Cl)cc1	ZINC000012514318	506869522	/nfs/dbraw/zinc/86/95/22/506869522.db2.gz	ICNHKOYRPQUIOM-UHFFFAOYSA-N	-1	0	370.796	2.924	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)c2ccc(Br)o2)c2ccccc2O1	ZINC000013435070	506940594	/nfs/dbraw/zinc/94/05/94/506940594.db2.gz	LURZDNWKUNPQNL-NSHDSACASA-N	-1	0	352.140	2.535	50	0		FFAARM
Cc1ccc(C(=O)[O-])cc1S(=O)(=O)Nc1cccc(-n2cccn2)c1	ZINC000045774263	507016323	/nfs/dbraw/zinc/01/63/23/507016323.db2.gz	MOARVDVCYJLUKE-UHFFFAOYSA-N	-1	0	357.391	2.680	50	0		FFAARM
O=C([O-])Cn1ncc2c3ccccc3n(Cc3ccc(F)cc3)c2c1=O	ZINC000045795966	507021476	/nfs/dbraw/zinc/02/14/76/507021476.db2.gz	UDCYYBFXPPAXOQ-UHFFFAOYSA-N	-1	0	351.337	2.623	50	0		FFAARM
COc1cc(S(=O)(=O)Nc2ccc(C)cc2)cc(C(=O)[O-])c1OC	ZINC000045946763	507049979	/nfs/dbraw/zinc/04/99/79/507049979.db2.gz	JISBJXJEEMIMDV-UHFFFAOYSA-N	-1	0	351.380	2.511	50	0		FFAARM
COc1cccc(O[C@H]2C[C@@H](C(=O)[O-])N(C(=O)OC(C)(C)C)C2)c1OC	ZINC000072233827	507770742	/nfs/dbraw/zinc/77/07/42/507770742.db2.gz	DDPUBIBOQPPIIG-RYUDHWBXSA-N	-1	0	367.398	2.545	50	0		FFAARM
CC(C)(C)c1ccn(C2(C(=O)[O-])CCN(C(=O)[C@H]3CC34CCC4)CC2)n1	ZINC000072458066	507794036	/nfs/dbraw/zinc/79/40/36/507794036.db2.gz	GNMZMCYYYXRUKH-CQSZACIVSA-N	-1	0	359.470	2.773	50	0		FFAARM
CC[C@@H](C)[C@@H](NS(=O)(=O)c1cccc2c1cccc2N(C)C)C(=O)[O-]	ZINC000030836187	507813571	/nfs/dbraw/zinc/81/35/71/507813571.db2.gz	NJTOKQLVHXSRPR-SJKOYZFVSA-N	-1	0	364.467	2.683	50	0		FFAARM
O=C([O-])Cc1ccc(N[C@H]2CC(=O)N(c3cccc(Cl)c3)C2=O)cc1	ZINC000089774637	507864815	/nfs/dbraw/zinc/86/48/15/507864815.db2.gz	BYZULDMWZQNAHF-HNNXBMFYSA-N	-1	0	358.781	2.711	50	0		FFAARM
COc1ccc(-c2cc(=O)[nH]c(Nc3ccc(O)c(C(=O)[O-])c3)n2)cc1	ZINC000073647928	507942597	/nfs/dbraw/zinc/94/25/97/507942597.db2.gz	BGCMFSKXCBUKKE-UHFFFAOYSA-N	-1	0	353.334	2.593	50	0		FFAARM
Cc1cc(NCc2nc(-c3ncccn3)no2)nc(-c2ccccc2[O-])n1	ZINC000091876963	508021984	/nfs/dbraw/zinc/02/19/84/508021984.db2.gz	HHUPQXWARMAYMG-UHFFFAOYSA-N	-1	0	361.365	2.610	50	0		FFAARM
Cc1c(F)cc(C(=O)[O-])cc1S(=O)(=O)N(C)c1ccc(F)c(F)c1	ZINC000075582003	508119929	/nfs/dbraw/zinc/11/99/29/508119929.db2.gz	QWZRQHZRIVVFKW-UHFFFAOYSA-N	-1	0	359.325	2.936	50	0		FFAARM
CCc1c(C)nc(C)nc1N1C[C@H]2COc3ccccc3C[C@@]2(C(=O)[O-])C1	ZINC000095371916	508179241	/nfs/dbraw/zinc/17/92/41/508179241.db2.gz	MHRMMQLTKYKSJR-HRAATJIYSA-N	-1	0	367.449	2.798	50	0		FFAARM
O=C([O-])CCCOc1ccc(S(=O)(=O)Nc2ccc(O)cc2)cc1F	ZINC000095464207	508187262	/nfs/dbraw/zinc/18/72/62/508187262.db2.gz	AYRLLRDGSPSKDH-UHFFFAOYSA-N	-1	0	369.370	2.576	50	0		FFAARM
O=C([O-])c1ccc(Br)c(N2C(=O)[C@@H]3CCCC[C@H]3C2=O)c1	ZINC000096581776	508215213	/nfs/dbraw/zinc/21/52/13/508215213.db2.gz	DZJIVAZJTPUGRZ-NXEZZACHSA-N	-1	0	352.184	2.827	50	0		FFAARM
Cc1nc2c([N-]S(=O)(=O)c3ccccc3Br)cccn2n1	ZINC000097096390	508218991	/nfs/dbraw/zinc/21/89/91/508218991.db2.gz	ZVAAZUZAWFHMLS-UHFFFAOYSA-N	-1	0	367.228	2.601	50	0		FFAARM
O=C(N[C@@H]1CCO[C@]2(CCSC2)C1)c1ccc2[n-]c(=S)oc2c1	ZINC000157438251	508566363	/nfs/dbraw/zinc/56/63/63/508566363.db2.gz	ZNWKKRSHXMEFKM-BDJLRTHQSA-N	-1	0	350.465	2.901	50	0		FFAARM
O=C([O-])Cn1ccc(NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)n1	ZINC000122743626	508581562	/nfs/dbraw/zinc/58/15/62/508581562.db2.gz	DBUPVBCRYQFTNT-WDEREUQCSA-N	-1	0	353.300	2.729	50	0		FFAARM
CCO[C@@H]1C[C@H](N(C)C(=O)c2ccc3c(c2)[n-]c(=S)[nH]c3=O)C12CCC2	ZINC000160541414	509000349	/nfs/dbraw/zinc/00/03/49/509000349.db2.gz	OROIFRRWOUFPOM-LSDHHAIUSA-N	-1	0	373.478	2.632	50	0		FFAARM
CC[C@@]1(C(=O)[O-])CCC[N@H+](Cc2cc(Cl)ccc2OCC(=O)[O-])C1	ZINC000215421723	509247647	/nfs/dbraw/zinc/24/76/47/509247647.db2.gz	GDGPHOBRLKLWFS-QGZVFWFLSA-N	-1	0	355.818	2.880	50	0		FFAARM
Cc1nn(CC(C)C)c(Cl)c1/C=C/C(=O)N1CCC[C@H](C(=O)[O-])C1	ZINC000263970650	509254821	/nfs/dbraw/zinc/25/48/21/509254821.db2.gz	PZDYYVKDECBORB-YBJDMEARSA-N	-1	0	353.850	2.837	50	0		FFAARM
O=C(NCc1nncn1CCc1ccccc1)c1ccc([O-])c(Cl)c1	ZINC000223757075	509347929	/nfs/dbraw/zinc/34/79/29/509347929.db2.gz	GXHHKJOXAMECNX-UHFFFAOYSA-N	-1	0	356.813	2.810	50	0		FFAARM
CC(C)[S@](=O)c1ccc(C(=O)N2CCC[C@@H](CCC(=O)[O-])C2)cc1	ZINC000236702958	509484897	/nfs/dbraw/zinc/48/48/97/509484897.db2.gz	LBCDLKXXRPZFQB-BSEYFRJRSA-N	-1	0	351.468	2.920	50	0		FFAARM
CC[C@H](C)N(CC(=O)[O-])C(=O)c1ccc(CN2C[C@H](C)O[C@@H](C)C2)cc1	ZINC000236933275	509536455	/nfs/dbraw/zinc/53/64/55/509536455.db2.gz	FMMZQOGSPVUYJX-JYJNAYRXSA-N	-1	0	362.470	2.621	50	0		FFAARM
Cc1nc(-c2cccc(Cl)c2)sc1C(=O)N1CCO[C@@H](C(=O)[O-])C1	ZINC000237695143	509712168	/nfs/dbraw/zinc/71/21/68/509712168.db2.gz	ATFDRNVDRCKBAQ-GFCCVEGCSA-N	-1	0	366.826	2.698	50	0		FFAARM
Cc1ccccc1C1(CNC(=O)c2ccc(C(=O)[O-])nc2)CCOCC1	ZINC000237694981	509712552	/nfs/dbraw/zinc/71/25/52/509712552.db2.gz	PLHQAAMTTKCFPL-UHFFFAOYSA-N	-1	0	354.406	2.566	50	0		FFAARM
Cc1nc(C)n(-c2ccc(C(=O)N3CCCC[C@@H]3CCC(=O)[O-])cc2)n1	ZINC000237696519	509713690	/nfs/dbraw/zinc/71/36/90/509713690.db2.gz	JPPIOWPCDLDHMK-MRXNPFEDSA-N	-1	0	356.426	2.744	50	0		FFAARM
Cn1c(C(=O)N(CCC(=O)[O-])C2CCOCC2)ccc1-c1ccccc1	ZINC000237709585	509716081	/nfs/dbraw/zinc/71/60/81/509716081.db2.gz	DDLXBJULTGYMAW-UHFFFAOYSA-N	-1	0	356.422	2.788	50	0		FFAARM
O=C([O-])C[C@H]1CN(C(=O)CCc2ccc(-c3ccccc3F)o2)CCO1	ZINC000238051730	509808568	/nfs/dbraw/zinc/80/85/68/509808568.db2.gz	YMFUUIPFGFJOHT-AWEZNQCLSA-N	-1	0	361.369	2.720	50	0		FFAARM
O=C([O-])CCN(C(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1)C1CCOCC1	ZINC000238068030	509812575	/nfs/dbraw/zinc/81/25/75/509812575.db2.gz	BCNJWUBNIBODFL-HZPDHXFCSA-N	-1	0	351.830	2.926	50	0		FFAARM
C[C@H](c1ccccc1)N1C[C@H](C(=O)N[C@@H]2CCCCC[C@H]2C(=O)[O-])CC1=O	ZINC000252515787	509849364	/nfs/dbraw/zinc/84/93/64/509849364.db2.gz	NMCNKJXDSDPABR-VDHUWJSZSA-N	-1	0	372.465	2.746	50	0		FFAARM
Cc1c(C(=O)N2CCc3[nH]c(-c4ccc(C(=O)[O-])cc4)nc3C2)ccn1C	ZINC000244828586	509871975	/nfs/dbraw/zinc/87/19/75/509871975.db2.gz	TYXHJLCBEWBIPE-UHFFFAOYSA-N	-1	0	364.405	2.620	50	0		FFAARM
COc1ccc(NN=C(C#N)C(=O)Nc2ccccc2C(=O)[O-])cc1Cl	ZINC000254466451	509907806	/nfs/dbraw/zinc/90/78/06/509907806.db2.gz	FEJFSRVGRNITOP-UHFFFAOYSA-N	-1	0	372.768	2.977	50	0		FFAARM
O=C([O-])[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc2c(c1)NC(=O)CS2	ZINC000261657948	510015793	/nfs/dbraw/zinc/01/57/93/510015793.db2.gz	KJPKIKPTJFKACH-BPNCWPANSA-N	-1	0	360.435	2.589	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)[C@H]2CC=CC[C@H]2c2nc3ccccc3s2)CCO1	ZINC000263046920	510534489	/nfs/dbraw/zinc/53/44/89/510534489.db2.gz	WKCUTVWKQUVJGC-IPYPFGDCSA-N	-1	0	372.446	2.658	50	0		FFAARM
C[C@@H](c1ccccc1)N1C[C@H](C(=O)Nc2cccc(CC(=O)[O-])c2)CC1=O	ZINC000263144418	510582731	/nfs/dbraw/zinc/58/27/31/510582731.db2.gz	KETJNWHZLTUWRN-WMLDXEAASA-N	-1	0	366.417	2.862	50	0		FFAARM
C[C@@H](c1ccccc1)N1C[C@@H](C(=O)NCc2ccc(C(=O)[O-])s2)CC1=O	ZINC000263164956	510592790	/nfs/dbraw/zinc/59/27/90/510592790.db2.gz	ISBHIUOAQJEANN-JSGCOSHPSA-N	-1	0	372.446	2.672	50	0		FFAARM
Cc1nc(C)c(CCNS(=O)(=O)c2cc(C(=O)[O-])c(C)cc2C)s1	ZINC000185016773	510636728	/nfs/dbraw/zinc/63/67/28/510636728.db2.gz	HZOZAEBRNURBRZ-UHFFFAOYSA-N	-1	0	368.480	2.596	50	0		FFAARM
Cc1cc(O[C@@H](C)C(=O)N(CCC(=O)[O-])C2CCOCC2)ccc1Cl	ZINC000299747218	511668066	/nfs/dbraw/zinc/66/80/66/511668066.db2.gz	CKCNWGVOXGUAFV-ZDUSSCGKSA-N	-1	0	369.845	2.898	50	0		FFAARM
COc1ccc(CNC(=O)[C@H]2CSc3ccccc3O2)cc1C(=O)[O-]	ZINC000299750972	511668244	/nfs/dbraw/zinc/66/82/44/511668244.db2.gz	OYAPUNNNKOCRHJ-OAHLLOKOSA-N	-1	0	359.403	2.563	50	0		FFAARM
Cc1oc(CN(C)C(=O)c2cc(Cl)c3c(c2)OCCO3)cc1C(=O)[O-]	ZINC000299747877	511669104	/nfs/dbraw/zinc/66/91/04/511669104.db2.gz	FMFOWOJXNJBSAX-UHFFFAOYSA-N	-1	0	365.769	2.983	50	0		FFAARM
Cc1oc(C)c(S(=O)(=O)NC[C@@H]2CCCCC2(F)F)c1C(=O)[O-]	ZINC000389853119	512903503	/nfs/dbraw/zinc/90/35/03/512903503.db2.gz	VIPRDNBGFIYPHG-JTQLQIEISA-N	-1	0	351.371	2.698	50	0		FFAARM
Cc1nc(-c2ccc(C(=O)N3CCC4(CCO4)CC3)cc2)c(Cl)c(=O)[n-]1	ZINC000584893467	518526881	/nfs/dbraw/zinc/52/68/81/518526881.db2.gz	ZBRINGXILXWWOE-UHFFFAOYSA-N	-1	0	373.840	2.794	50	0		FFAARM
CCOc1c(Br)cc(C(=O)N2CCC[C@@H]2C(=O)[O-])cc1OC	ZINC000263296881	520590417	/nfs/dbraw/zinc/59/04/17/520590417.db2.gz	MNEUDQLXZDAMPT-LLVKDONJSA-N	-1	0	372.215	2.546	50	0		FFAARM
CS(=O)(=O)C1=N[N-]c2c(-c3ccccc3)cnn2[C@H]1c1ccccc1	ZINC000618256195	520966644	/nfs/dbraw/zinc/96/66/44/520966644.db2.gz	FWCGLUWWODTFQQ-INIZCTEOSA-N	-1	0	352.419	2.923	50	0		FFAARM
O=C([O-])c1ccc2nc(/C=C\c3cnc(N4CCOCC4)nc3)ccc2c1	ZINC000606441604	521068423	/nfs/dbraw/zinc/06/84/23/521068423.db2.gz	QMGHHRHHRXLSKM-RJRFIUFISA-N	-1	0	362.389	2.730	50	0		FFAARM
O=C([O-])[C@H]1CCCN1C(=O)/C=C\c1ccc(OCc2ccccn2)cc1	ZINC000606442113	521069308	/nfs/dbraw/zinc/06/93/08/521069308.db2.gz	ULNRSNYCKIZETJ-IBWPDUFMSA-N	-1	0	352.390	2.749	50	0		FFAARM
COCCC[C@@]1(C(=O)[O-])CCCN(C(=O)Cc2ccc3[nH]c(C)nc3c2)C1	ZINC000091650362	523467774	/nfs/dbraw/zinc/46/77/74/523467774.db2.gz	PGPQAGLVLZLRGP-FQEVSTJZSA-N	-1	0	373.453	2.534	50	0		FFAARM
O=C([O-])[C@H]1COCCN1C(=O)/C=C/c1ccc(Cl)c(C(F)(F)F)c1	ZINC000268989647	526332346	/nfs/dbraw/zinc/33/23/46/526332346.db2.gz	RYTLKJHCMGTIKU-FXMSTWTQSA-N	-1	0	363.719	2.684	50	0		FFAARM
Cc1oc(CN(C)C(=O)c2ccc(N3CCCC3=O)cc2)cc1C(=O)[O-]	ZINC000268944507	526769468	/nfs/dbraw/zinc/76/94/68/526769468.db2.gz	VSSOSXBMFUCDEA-UHFFFAOYSA-N	-1	0	356.378	2.685	50	0		FFAARM
O=C([O-])COc1cccc(CNC(=O)[C@H]2C[C@@H]2c2cc(F)ccc2F)c1	ZINC000238020470	527618359	/nfs/dbraw/zinc/61/83/59/527618359.db2.gz	HUGGUINYSXVEFB-ZBFHGGJFSA-N	-1	0	361.344	2.848	50	0		FFAARM
O=C(NC[C@H](c1cccs1)N1CCOCC1)c1c([O-])cc(F)cc1F	ZINC000084436997	571085740	/nfs/dbraw/zinc/08/57/40/571085740.db2.gz	IPQXEYHKNTWHDZ-CYBMUJFWSA-N	-1	0	368.405	2.535	50	0		FFAARM
CC(C)Cc1cc(C(=O)N[C@@H]2CCC[N@H+](Cc3cccs3)C2)[nH]c(=O)n1	ZINC000670444633	571349895	/nfs/dbraw/zinc/34/98/95/571349895.db2.gz	OKSFSRDTCHKVTE-CQSZACIVSA-N	-1	0	374.510	2.837	50	0		FFAARM
CC(C)n1ccc(C(=O)N[C@H](C(=O)[O-])c2ccccc2Br)n1	ZINC000659189655	731949002	/nfs/dbraw/zinc/94/90/02/731949002.db2.gz	IUSVCYYERBAGMR-ZDUSSCGKSA-N	-1	0	366.215	2.782	50	0		FFAARM
COc1ccccc1[C@H]1CCCN1C(=O)c1cnc2c(cnn2C)c1O	ZINC000119214786	975741794	/nfs/dbraw/zinc/74/17/94/975741794.db2.gz	FDLMKNVJIQHPEU-OAHLLOKOSA-N	-1	0	352.394	2.660	50	0		FFAARM
O=C(c1n[n-]c2ccccc2c1=O)N1CCC(Oc2ccc(F)cc2)CC1	ZINC000115722541	1011512906	/nfs/dbraw/zinc/51/29/06/1011512906.db2.gz	QIQJDKPWCATBJX-UHFFFAOYSA-N	-1	0	367.380	2.746	50	0		FFAARM
C[C@H](NC(=O)Nc1ccc(-c2ncon2)cc1)[C@@H]1C[C@H](C(=O)[O-])C1(C)C	ZINC000653537775	1024936632	/nfs/dbraw/zinc/93/66/32/1024936632.db2.gz	FYFIUYWWDPHJIK-LEWSCRJBSA-N	-1	0	358.398	2.994	50	0		FFAARM
O=C([O-])COc1cccc(C(=O)N2CCOC[C@@H]2c2cccc(F)c2)c1	ZINC000659200520	1025971003	/nfs/dbraw/zinc/97/10/03/1025971003.db2.gz	WMJVHURBJJQXJJ-QGZVFWFLSA-N	-1	0	359.353	2.503	50	0		FFAARM
CC[C@H](NC(=O)c1ccccc1NC(=O)c1ccc(OC)cc1)C(=O)[O-]	ZINC000000846180	210224079	/nfs/dbraw/zinc/22/40/79/210224079.db2.gz	ICPRRRIOSWIIEG-HNNXBMFYSA-N	-1	0	356.378	2.541	50	0	biogenic	FFAARM
O=C([O-])CCC(=O)Nc1ccc(NC(=O)CC(=O)c2ccccc2)cc1	ZINC000000640477	210148766	/nfs/dbraw/zinc/14/87/66/210148766.db2.gz	DUXRKPCOBNFQQF-UHFFFAOYSA-N	-1	0	354.362	2.701	50	0		FFAARM
Cc1oc(CN(C)C(=O)/C=C/c2ccc3c(c2)OCCO3)cc1C(=O)[O-]	ZINC000328595465	210110617	/nfs/dbraw/zinc/11/06/17/210110617.db2.gz	VSBPCCNOHNVNBQ-GQCTYLIASA-N	-1	0	357.362	2.729	50	0		FFAARM
Cn1nccc1C(=O)N1C[C@@H]2C[C@@H](c3ccccc3)CC[C@]2(C(=O)[O-])C1	ZINC000299776848	210021280	/nfs/dbraw/zinc/02/12/80/210021280.db2.gz	DOJSUBOIMKLQSS-FTRWYGJKSA-N	-1	0	353.422	2.531	50	0		FFAARM
O=C([O-])c1ccc(N2C(=O)c3ccc(Br)cc3C2=O)cc1O	ZINC000000752524	219318373	/nfs/dbraw/zinc/31/83/73/219318373.db2.gz	QRJUPAKWHJDABI-UHFFFAOYSA-N	-1	0	362.135	2.654	50	0		FFAARM
O=C([O-])[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)CCc1nc(-c2ccoc2)no1	ZINC000237969458	222912325	/nfs/dbraw/zinc/91/23/25/222912325.db2.gz	JDCPTIKURAPWJV-UBHSHLNASA-N	-1	0	359.382	2.507	50	0		FFAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)CCc2cnn(-c3ccccc3)c2)C1	ZINC000237957353	222912881	/nfs/dbraw/zinc/91/28/81/222912881.db2.gz	OIHYBHPPNZZYGY-INIZCTEOSA-N	-1	0	355.438	2.908	50	0		FFAARM
Cc1nn(Cc2ccc(F)cc2)c(Cl)c1C(=O)N1CC[C@H](C(=O)[O-])C1	ZINC000237604297	222908826	/nfs/dbraw/zinc/90/88/26/222908826.db2.gz	KNDRBDVDQSWSEM-LBPRGKRZSA-N	-1	0	365.792	2.579	50	0		FFAARM
O=C([O-])CSc1nnc(-c2ccc3c(c2)OCO3)n1-c1ccccc1	ZINC000004134794	219547704	/nfs/dbraw/zinc/54/77/04/219547704.db2.gz	GMYYZRSOBBZPTI-UHFFFAOYSA-N	-1	0	355.375	2.840	50	0		FFAARM
CC(=O)c1ccc(S(=O)(=O)[N-]c2ccccc2C(=O)NC2CC2)cc1	ZINC000007054341	219789672	/nfs/dbraw/zinc/78/96/72/219789672.db2.gz	VHGNRSHJYHIWIM-UHFFFAOYSA-N	-1	0	358.419	2.582	50	0		FFAARM
COc1cccc([N-]S(=O)(=O)c2ccc(-c3nnc(C)o3)s2)c1	ZINC000064919913	212048312	/nfs/dbraw/zinc/04/83/12/212048312.db2.gz	CDEMDFFRDRMXAV-UHFFFAOYSA-N	-1	0	351.409	2.916	50	0		FFAARM
COc1ccc(-c2ccc(=O)[nH]n2)cc1S(=O)(=O)[N-]c1ccc(C)cc1	ZINC000064837080	212045021	/nfs/dbraw/zinc/04/50/21/212045021.db2.gz	BPQJODKMJDILTE-UHFFFAOYSA-N	-1	0	371.418	2.555	50	0		FFAARM
COc1ccc(Br)cc1NC(=O)C[C@@]1(C(=O)[O-])CCSC1	ZINC000064611345	212041969	/nfs/dbraw/zinc/04/19/69/212041969.db2.gz	GHHMUYCFGVLNOK-AWEZNQCLSA-N	-1	0	374.256	2.994	50	0		FFAARM
CN(Cc1ccccc1)S(=O)(=O)[N-]C(=O)/C=C/c1cccc(Cl)c1	ZINC000059368919	212017049	/nfs/dbraw/zinc/01/70/49/212017049.db2.gz	BNVYLUMNVMBDOZ-ZHACJKMWSA-N	-1	0	364.854	2.846	50	0		FFAARM
Cc1cc(S(=O)(=O)N(C)c2c(F)cccc2F)ccc1OCC(=O)[O-]	ZINC000058377225	212008201	/nfs/dbraw/zinc/00/82/01/212008201.db2.gz	UQTBTWXZMKDQSR-UHFFFAOYSA-N	-1	0	371.361	2.562	50	0		FFAARM
CC(C)CNC(=O)c1ccccc1[N-]S(=O)(=O)c1ccc2c(c1)CCO2	ZINC000057512887	211976141	/nfs/dbraw/zinc/97/61/41/211976141.db2.gz	JNBLKJRTIVEHMN-UHFFFAOYSA-N	-1	0	374.462	2.808	50	0		FFAARM
COc1cc(Cl)c(NS(=O)(=O)c2cccc(C(=O)[O-])c2)cc1OC	ZINC000012970219	220047895	/nfs/dbraw/zinc/04/78/95/220047895.db2.gz	SBLKQQNCDSDXTO-UHFFFAOYSA-N	-1	0	371.798	2.856	50	0		FFAARM
O=C([O-])CCc1ccc(S(=O)(=O)N2CCC[C@@H](C(F)(F)F)C2)cc1	ZINC000013089037	220057233	/nfs/dbraw/zinc/05/72/33/220057233.db2.gz	RUQSOMHUSBUZCJ-GFCCVEGCSA-N	-1	0	365.373	2.667	50	0		FFAARM
O=C([O-])[C@@H]1CCCN1S(=O)(=O)c1ccc(Cl)cc1C(F)(F)F	ZINC000013027832	220055438	/nfs/dbraw/zinc/05/54/38/220055438.db2.gz	NEIKGKSUXSUTCT-VIFPVBQESA-N	-1	0	357.737	2.597	50	0		FFAARM
COc1ccc2c(c1)CCC[C@H]2CC(=O)N(CC(=O)[O-])C1CCOCC1	ZINC000299748365	211829745	/nfs/dbraw/zinc/82/97/45/211829745.db2.gz	HDAJVXPBJYRRDZ-HNNXBMFYSA-N	-1	0	361.438	2.597	50	0		FFAARM
O=C([O-])[C@@H]1CCCCN1C(=O)CCc1nc(-c2ccc(Cl)cc2)no1	ZINC000299748985	211830432	/nfs/dbraw/zinc/83/04/32/211830432.db2.gz	ITSDPERIAIGARK-ZDUSSCGKSA-N	-1	0	363.801	2.788	50	0		FFAARM
O=C([O-])[C@@H]1Cc2ccccc2CN1C(=O)Cc1csc(-c2ccoc2)n1	ZINC000299742254	211822572	/nfs/dbraw/zinc/82/25/72/211822572.db2.gz	AWEISNOGUOSBFK-INIZCTEOSA-N	-1	0	368.414	2.984	50	0		FFAARM
Cc1cc(O[C@H](C)C(=O)N(CC(=O)[O-])C2CCOCC2)ccc1Cl	ZINC000299748743	211827456	/nfs/dbraw/zinc/82/74/56/211827456.db2.gz	IAUXOABDXFXKJR-GFCCVEGCSA-N	-1	0	355.818	2.508	50	0		FFAARM
Cc1oc(CNC(=O)c2ccc3c(c2)NC(=O)[C@H](C)S3)cc1C(=O)[O-]	ZINC000299747196	211826274	/nfs/dbraw/zinc/82/62/74/211826274.db2.gz	CIRNKABTOYUWDM-VIFPVBQESA-N	-1	0	360.391	2.649	50	0		FFAARM
C[C@]1(C(=O)[O-])CCN(C(=O)[C@H]2C[C@H]2c2cccc(Br)c2)C1	ZINC000299745547	211826296	/nfs/dbraw/zinc/82/62/96/211826296.db2.gz	QZYCNZYTEKGAQQ-XEZPLFJOSA-N	-1	0	352.228	2.876	50	0		FFAARM
CC[C@H](C)[C@@H](NS(=O)(=O)c1cccc2c1cccc2N(C)C)C(=O)[O-]	ZINC000030836190	211526285	/nfs/dbraw/zinc/52/62/85/211526285.db2.gz	NJTOKQLVHXSRPR-YVEFUNNKSA-N	-1	0	364.467	2.683	50	0		FFAARM
O=C([O-])C1=Nc2nc(-c3ccccc3)nn2[C@@H](c2ccc3c(c2)OCO3)C1	ZINC000020745671	211294966	/nfs/dbraw/zinc/29/49/66/211294966.db2.gz	BXGJNCCVTQSBOA-CQSZACIVSA-N	-1	0	362.345	2.657	50	0		FFAARM
CCOc1cccc2cc(C(N)=O)/c(=N/c3ccc(C(=O)[O-])cc3)oc21	ZINC000020616633	211291844	/nfs/dbraw/zinc/29/18/44/211291844.db2.gz	IBOTVJFZEAYOEQ-UZYVYHOESA-N	-1	0	352.346	2.861	50	0		FFAARM
CSc1nnc(-c2cc(Br)ccc2NC(C)=O)c(=O)[n-]1	ZINC000015016215	211114375	/nfs/dbraw/zinc/11/43/75/211114375.db2.gz	REIFEIFMBGAFQB-UHFFFAOYSA-N	-1	0	355.217	2.687	50	0		FFAARM
COc1cccc(C[C@H](C(=O)Nc2cc(C)ccc2C)c2nnn[n-]2)c1	ZINC000013943537	211065720	/nfs/dbraw/zinc/06/57/20/211065720.db2.gz	SKDOYQIXNPKZKZ-INIZCTEOSA-N	-1	0	351.410	2.790	50	0		FFAARM
CCc1c2c(cc(=O)n1Cc1ccccn1)[n-]n(-c1ccc(F)cc1)c2=O	ZINC000013957595	211064804	/nfs/dbraw/zinc/06/48/04/211064804.db2.gz	SVWXTWPIDMRQBZ-UHFFFAOYSA-N	-1	0	364.380	2.625	50	0		FFAARM
C[C@@H](NC(=O)CC1(C(=O)[O-])CCCCC1)c1ccc(-n2cncn2)cc1	ZINC000013468267	211033647	/nfs/dbraw/zinc/03/36/47/211033647.db2.gz	RPBHVMHYZOFDTG-CQSZACIVSA-N	-1	0	356.426	2.870	50	0		FFAARM
COc1ccc(OC)c([C@@H](C)NC(=O)COc2ccccc2C(=O)[O-])c1	ZINC000013411522	211032926	/nfs/dbraw/zinc/03/29/26/211032926.db2.gz	JGZKFIFHXPBUCX-GFCCVEGCSA-N	-1	0	359.378	2.658	50	0		FFAARM
O=C([O-])c1cc2c(cc1NS(=O)(=O)c1ccc(Cl)cc1)OCCO2	ZINC000013090193	211023199	/nfs/dbraw/zinc/02/31/99/211023199.db2.gz	NPIAIEUEEGOENS-UHFFFAOYSA-N	-1	0	369.782	2.610	50	0		FFAARM
Cc1ccc(S(=O)(=O)Nc2cc3c(cc2C(=O)[O-])OCCO3)cc1C	ZINC000013090209	211022731	/nfs/dbraw/zinc/02/27/31/211022731.db2.gz	DDEVNRQMNSULJN-UHFFFAOYSA-N	-1	0	363.391	2.574	50	0		FFAARM
O=C([O-])C1(c2ccccc2)CCN(C(=O)Cc2ccc3c(c2)CCO3)CC1	ZINC000013257378	211028549	/nfs/dbraw/zinc/02/85/49/211028549.db2.gz	LMWLEKUFYZXAEV-UHFFFAOYSA-N	-1	0	365.429	2.809	50	0		FFAARM
COc1cccc(-n2nnc(C(=O)Nc3ccc(C(=O)[O-])cc3)c2C)c1	ZINC000009970548	210858689	/nfs/dbraw/zinc/85/86/89/210858689.db2.gz	QIOWSBZOVVWBBK-UHFFFAOYSA-N	-1	0	352.350	2.535	50	0		FFAARM
O=C(NCc1cccnc1)c1ccccc1[N-]S(=O)(=O)c1cccs1	ZINC000004411718	210529521	/nfs/dbraw/zinc/52/95/21/210529521.db2.gz	HEGVYBCFHSBAIZ-UHFFFAOYSA-N	-1	0	373.459	2.874	50	0		FFAARM
CN1C(=O)C(=Cc2ccccc2OCc2ccc(C(=O)[O-])cc2)NC1=S	ZINC000002168196	210381376	/nfs/dbraw/zinc/38/13/76/210381376.db2.gz	NYYXJEMFEOJIPF-GDNBJRDFSA-N	-1	0	368.414	2.651	50	0		FFAARM
O=C1c2ccccc2N[C@H](c2ccco2)N1[N-]S(=O)(=O)c1ccccc1	ZINC000001441640	210352610	/nfs/dbraw/zinc/35/26/10/210352610.db2.gz	QNOUUJYNWOHGAU-KRWDZBQOSA-N	-1	0	369.402	2.740	50	0		FFAARM
CCCCNC(=O)Cc1csc([N-]S(=O)(=O)c2ccc(C)cc2)n1	ZINC000009828560	210341406	/nfs/dbraw/zinc/34/14/06/210341406.db2.gz	WIEVLPHCFRLFLA-UHFFFAOYSA-N	-1	0	367.496	2.711	50	0		FFAARM
Cn1ncc(C(=O)[O-])c1C(=O)Nc1ccc(Br)c(Cl)c1	ZINC000020614682	220336750	/nfs/dbraw/zinc/33/67/50/220336750.db2.gz	QVFJHJAIYSZHCE-UHFFFAOYSA-N	-1	0	358.579	2.787	50	0		FFAARM
CCOC(=O)c1sc([N-]c2ncc(C(=O)OCC)c(C)n2)nc1C	ZINC000020673445	220337513	/nfs/dbraw/zinc/33/75/13/220337513.db2.gz	DVLVUUDBMRYMBE-UHFFFAOYSA-N	-1	0	350.400	2.647	50	0		FFAARM
Cn1nc(C(F)(F)F)c(-c2ccccc2)c1NC(=O)CSCC(=O)[O-]	ZINC000001043724	210308206	/nfs/dbraw/zinc/30/82/06/210308206.db2.gz	NFAAEPQDCCCWNH-UHFFFAOYSA-N	-1	0	373.356	2.862	50	0		FFAARM
COc1cc(C)c(C)cc1S(=O)(=O)[N-]c1ccc2c(c1)CC(=O)N2C	ZINC000009572739	210293738	/nfs/dbraw/zinc/29/37/38/210293738.db2.gz	RNFSBQCCNQVUPK-UHFFFAOYSA-N	-1	0	360.435	2.632	50	0		FFAARM
CCS(=O)(=O)c1ccc([O-])c(NC(=O)COc2ccc(Cl)cc2)c1	ZINC000000846824	210280849	/nfs/dbraw/zinc/28/08/49/210280849.db2.gz	HPIATNJAIVPOST-UHFFFAOYSA-N	-1	0	369.826	2.857	50	0		FFAARM
O=C([O-])c1cccc(S(=O)(=O)Nc2ccc(Br)cc2)c1	ZINC000000820118	210276041	/nfs/dbraw/zinc/27/60/41/210276041.db2.gz	FSENLNZWRUKHDI-UHFFFAOYSA-N	-1	0	356.197	2.948	50	0		FFAARM
COc1ccc(-c2cc(C(=O)N3CCC[C@@H]3C(=O)[O-])c(C)o2)cc1OC	ZINC000000811802	210274569	/nfs/dbraw/zinc/27/45/69/210274569.db2.gz	PAFBZCCPXRQOJW-CQSZACIVSA-N	-1	0	359.378	2.961	50	0		FFAARM
Cc1nc2sc([C@H](c3ccc(F)c(F)c3)N3CCOCC3)c([O-])n2n1	ZINC000022626673	220393120	/nfs/dbraw/zinc/39/31/20/220393120.db2.gz	OULAQZVVMCQQJX-ZDUSSCGKSA-N	-1	0	366.393	2.505	50	0		FFAARM
CCN(c1cccc(F)c1)S(=O)(=O)c1cc(C(=O)[O-])ccc1OC	ZINC000055663161	221073144	/nfs/dbraw/zinc/07/31/44/221073144.db2.gz	CMRXKLUUOFHZMB-UHFFFAOYSA-N	-1	0	353.371	2.748	50	0		FFAARM
CC(C)CN1CCn2cc(S(=O)(=O)[N-]c3ccc(F)cc3)cc2C1=O	ZINC000065254811	221188415	/nfs/dbraw/zinc/18/84/15/221188415.db2.gz	YLRQXFUULVDLEX-UHFFFAOYSA-N	-1	0	365.430	2.540	50	0		FFAARM
CCc1ccc(N2C[C@H](C(=O)NC3(C(=O)[O-])CCCCC3)CC2=O)cc1	ZINC000071892823	221385594	/nfs/dbraw/zinc/38/55/94/221385594.db2.gz	FQHQAXWBRRUYAJ-OAHLLOKOSA-N	-1	0	358.438	2.506	50	0		FFAARM
CC(C)(C(=O)[O-])c1cnc(NCC2CCCCC2)nc1N1CCOCC1	ZINC000096162310	132221428	/nfs/dbraw/zinc/22/14/28/132221428.db2.gz	ZEAVDDWKQLXROV-UHFFFAOYSA-N	-1	0	362.474	2.668	50	0		FFAARM
C[C@H]1CN(c2ccc(NC(=O)CC(C)(C)C(=O)[O-])cc2F)C[C@H](C)O1	ZINC000170627450	132265169	/nfs/dbraw/zinc/26/51/69/132265169.db2.gz	CHVUDGZQFRLNAV-RYUDHWBXSA-N	-1	0	352.406	2.879	50	0		FFAARM
C[C@H](O)c1cccc(N2CCc3nc(-c4ccc(C(=O)[O-])cc4)[nH]c3C2)n1	ZINC000219006009	132273710	/nfs/dbraw/zinc/27/37/10/132273710.db2.gz	FOWKCSVTVDXUEE-LBPRGKRZSA-N	-1	0	364.405	2.786	50	0		FFAARM
O=C([O-])C[C@@H]1Oc2ccccc2N(CCOc2ccc(Cl)cc2)C1=O	ZINC000055370424	136126725	/nfs/dbraw/zinc/12/67/25/136126725.db2.gz	OOGFKXYWAODHRF-INIZCTEOSA-N	-1	0	361.781	2.988	50	0		FFAARM
CC(C)c1nc(CN(C)C(=O)c2ccc(N3CC(=O)N=C3[O-])cc2)cs1	ZINC000077518179	221640431	/nfs/dbraw/zinc/64/04/31/221640431.db2.gz	AFJBJGGPBOWOJP-UHFFFAOYSA-N	-1	0	372.450	2.595	50	0		FFAARM
O=S(=O)([N-]CCn1ccc(-c2cccs2)n1)c1c(F)cccc1F	ZINC000096103869	222023947	/nfs/dbraw/zinc/02/39/47/222023947.db2.gz	MSHHHJHWITYRRR-UHFFFAOYSA-N	-1	0	369.418	2.868	50	0		FFAARM
Cc1ccc(NC(=O)c2c[nH]nc2S(=O)(=O)[N-]c2ccc(F)cc2)cc1	ZINC000096361182	222117165	/nfs/dbraw/zinc/11/71/65/222117165.db2.gz	DFTFXQFATIQNSA-UHFFFAOYSA-N	-1	0	374.397	2.910	50	0		FFAARM
Cc1ccc(S(=O)(=O)Nc2ccccc2-n2ccc(C(=O)[O-])n2)c(C)c1	ZINC000097591233	222194684	/nfs/dbraw/zinc/19/46/84/222194684.db2.gz	FHAVRNUFYQORGS-UHFFFAOYSA-N	-1	0	371.418	2.988	50	0		FFAARM
O=C1C[C@@H](Sc2nnc(-c3ccccc3O)o2)C(=O)N1c1ccccc1	ZINC000100285073	222240876	/nfs/dbraw/zinc/24/08/76/222240876.db2.gz	LVJLMFNHFSOLJO-CQSZACIVSA-N	-1	0	367.386	2.866	50	0		FFAARM
Cc1ccc(Cn2[nH][n-]c3c(=O)n(-c4ccc(F)c(F)c4)c(=O)c2=3)cc1	ZINC000101418111	222274019	/nfs/dbraw/zinc/27/40/19/222274019.db2.gz	GIVYTRMNKCEZMN-CVEARBPZSA-N	-1	0	356.332	2.767	50	0		FFAARM
CCOc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccccc4C)c=3c2=O)cc1	ZINC000101417742	222274352	/nfs/dbraw/zinc/27/43/52/222274352.db2.gz	VIOVSNWSXDKUJK-ZWKOTPCHSA-N	-1	0	364.405	2.887	50	0		FFAARM
O=C(CSc1nc([O-])cc(=O)n1-c1ccccc1)Nc1ccccc1	ZINC000102650768	222302330	/nfs/dbraw/zinc/30/23/30/222302330.db2.gz	MADUNJZOPRJMRG-UHFFFAOYSA-N	-1	0	353.403	2.669	50	0		FFAARM
COc1ccc(-n2c(=O)c3[n-][nH]n(-c4ccc(C)cc4)c=3c2=O)cc1OC	ZINC000102819026	222309435	/nfs/dbraw/zinc/30/94/35/222309435.db2.gz	HEMYIGNNRKIKML-DLBZAZTESA-N	-1	0	366.377	2.510	50	0		FFAARM
Cc1ccc2[nH]cc([C@H](C(=O)[O-])N3CCN(C(=O)c4ccco4)CC3)c2c1	ZINC000032096936	506229352	/nfs/dbraw/zinc/22/93/52/506229352.db2.gz	XBYRDXWPYAAHQI-GOSISDBHSA-N	-1	0	367.405	2.653	50	0		FFAARM
CCN1CCCn2cc(S(=O)(=O)[N-]c3ccc(C)c(F)c3)cc2C1=O	ZINC000065258785	506277450	/nfs/dbraw/zinc/27/74/50/506277450.db2.gz	WILRDOZNCWOPBQ-UHFFFAOYSA-N	-1	0	365.430	2.602	50	0		FFAARM
NC(=O)c1ccccc1[N-]S(=O)(=O)c1c(F)cc(F)c(Cl)c1F	ZINC000002662750	506288631	/nfs/dbraw/zinc/28/86/31/506288631.db2.gz	AYRKSTRCXVNADB-UHFFFAOYSA-N	-1	0	364.732	2.657	50	0		FFAARM
CC(C)[C@@H](NC(=O)/C(=C/c1ccccc1)NC(=O)c1ccccc1)C(=O)[O-]	ZINC000002983314	506305800	/nfs/dbraw/zinc/30/58/00/506305800.db2.gz	UODHKQUGRPVOKE-MTMYEVCSSA-N	-1	0	366.417	2.683	50	0	biogenic	FFAARM
CCOC(=O)[C@]([N-]c1ccc(F)c(F)c1F)(NC(=O)CC)C(F)(F)F	ZINC000003118484	506311660	/nfs/dbraw/zinc/31/16/60/506311660.db2.gz	HJKZAEBOGGKFRL-ZDUSSCGKSA-N	-1	0	372.265	2.864	50	0		FFAARM
COc1cc2c(cc1OC)[C@@H](C(=O)[O-])[C@@H]1c3ccccc3CCN1C2=O	ZINC000032916817	506312833	/nfs/dbraw/zinc/31/28/33/506312833.db2.gz	XWMZLQGDUVBINT-MSOLQXFVSA-N	-1	0	353.374	2.625	50	0		FFAARM
CN(C)c1ccc(NS(=O)(=O)c2ccc(F)c(F)c2)cc1C(=O)[O-]	ZINC000032962257	506318009	/nfs/dbraw/zinc/31/80/09/506318009.db2.gz	CZHQCFWFEXSMOJ-UHFFFAOYSA-N	-1	0	356.350	2.530	50	0		FFAARM
COc1cc(S(=O)(=O)Nc2ccc(CC(=O)[O-])cc2)ccc1Cl	ZINC000003620803	506347647	/nfs/dbraw/zinc/34/76/47/506347647.db2.gz	OAPUEACMOXUUPC-UHFFFAOYSA-N	-1	0	355.799	2.777	50	0		FFAARM
COc1ccc(-c2cc3ccc(OCc4nnn[n-]4)cc3oc2=O)cc1	ZINC000004282624	506367858	/nfs/dbraw/zinc/36/78/58/506367858.db2.gz	IVRLAVIATUXSQY-UHFFFAOYSA-N	-1	0	350.334	2.561	50	0		FFAARM
O=C([O-])CCCCCC[C@@H]1C(=O)NC(=O)N1CC[C@@H](O)C1CCCCC1	ZINC000004257977	506368098	/nfs/dbraw/zinc/36/80/98/506368098.db2.gz	ZIDQIOZJEJFMOH-HZPDHXFCSA-N	-1	0	368.474	2.663	50	0	in-vitro	FFAARM
O=C([O-])c1ccc2oc(=O)c(S(=O)(=O)c3ccc(Cl)cc3)cc2c1	ZINC000004316034	506371276	/nfs/dbraw/zinc/37/12/76/506371276.db2.gz	HFVKNNFYEGSRPH-UHFFFAOYSA-N	-1	0	364.762	2.977	50	0		FFAARM
Cc1cccc(Cn2[nH][n-]c3c(=O)n(-c4ccc(F)c(F)c4)c(=O)c2=3)c1	ZINC000004483758	506377217	/nfs/dbraw/zinc/37/72/17/506377217.db2.gz	FOPMKNFNBXRFIQ-CVEARBPZSA-N	-1	0	356.332	2.767	50	0		FFAARM
CCc1ccccc1NC(=O)[C@H](Cc1ccccc1OC)c1nnn[n-]1	ZINC000004674815	506385670	/nfs/dbraw/zinc/38/56/70/506385670.db2.gz	BHYOGFLJEUUBFA-OAHLLOKOSA-N	-1	0	351.410	2.736	50	0		FFAARM
CCc1nc(-c2cc(S(=O)(=O)[N-]c3cc(C)ccn3)c(C)s2)no1	ZINC000035539294	506387495	/nfs/dbraw/zinc/38/74/95/506387495.db2.gz	BDHAHXFBSZNIDU-UHFFFAOYSA-N	-1	0	364.452	3.173	50	0		FFAARM
CC1=C(C)C[C@H](C(=O)Nc2sc3c(c2C(N)=O)CCC3)[C@@H](C(=O)[O-])C1	ZINC000004902953	506404645	/nfs/dbraw/zinc/40/46/45/506404645.db2.gz	ZSIOQPWHGGVIDW-RYUDHWBXSA-N	-1	0	362.451	2.721	50	0		FFAARM
Cc1cccc(C)c1-n1nnnc1SCc1nc(=O)c2sccc2[n-]1	ZINC000005262976	506432365	/nfs/dbraw/zinc/43/23/65/506432365.db2.gz	SRNVPSBOUFXDMQ-UHFFFAOYSA-N	-1	0	370.463	2.869	50	0		FFAARM
O=c1c([O-])cc(-c2ccc(Cl)cc2)nn1-c1ncnc2ccccc21	ZINC000005262148	506432393	/nfs/dbraw/zinc/43/23/93/506432393.db2.gz	BGEATYCYFAFVKR-UHFFFAOYSA-N	-1	0	350.765	2.993	50	0		FFAARM
COc1ccc(C)cc1S(=O)(=O)N(CC(=O)[O-])c1ccc(Cl)cc1	ZINC000039315656	506448712	/nfs/dbraw/zinc/44/87/12/506448712.db2.gz	DJUCEOJVPWBZHF-UHFFFAOYSA-N	-1	0	369.826	2.937	50	0		FFAARM
CSCC[C@H](NC(=O)CCn1cc(C(C)=O)c2ccccc21)C(=O)[O-]	ZINC000040312516	506481686	/nfs/dbraw/zinc/48/16/86/506481686.db2.gz	OTVRPAYVXOGAPS-HNNXBMFYSA-N	-1	0	362.451	2.557	50	0	biogenic	FFAARM
C[C@H]1CCc2c(sc(NC(=O)CCC(=O)[O-])c2C(=O)NC2CC2)C1	ZINC000006731029	506500905	/nfs/dbraw/zinc/50/09/05/506500905.db2.gz	JECAMYWEUHYMDE-VIFPVBQESA-N	-1	0	350.440	2.568	50	0		FFAARM
Cc1ccc(-n2c(=O)c3[n-][nH]n(Cc4cccc(F)c4)c=3c2=O)cc1C	ZINC000006770843	506505639	/nfs/dbraw/zinc/50/56/39/506505639.db2.gz	NMASCJJRCPNVDC-IAGOWNOFSA-N	-1	0	352.369	2.936	50	0		FFAARM
CC[C@H](C)NC(=O)c1ccccc1[N-]S(=O)(=O)c1c(C)noc1C	ZINC000007054186	506529442	/nfs/dbraw/zinc/52/94/42/506529442.db2.gz	BBYZOMHDAYRUOZ-JTQLQIEISA-N	-1	0	351.428	2.621	50	0		FFAARM
Cc1ccc(C2=Nn3c(nnc3-c3ccncc3)S[C@@H]2CC(=O)[O-])cc1	ZINC000008315724	506642586	/nfs/dbraw/zinc/64/25/86/506642586.db2.gz	ARYVHLMOHBTIIN-CQSZACIVSA-N	-1	0	365.418	2.850	50	0		FFAARM
COc1ccccc1CN(C(=O)c1cccc(NCC(=O)[O-])c1)C1CC1	ZINC000055042629	506666065	/nfs/dbraw/zinc/66/60/65/506666065.db2.gz	NAQIELODXXXNHY-UHFFFAOYSA-N	-1	0	354.406	2.997	50	0		FFAARM
Cn1c(SCc2nc(=O)c3sccc3[n-]2)nc2sccc2c1=O	ZINC000009314045	506689393	/nfs/dbraw/zinc/68/93/93/506689393.db2.gz	CEGZAJUKRUXJQJ-UHFFFAOYSA-N	-1	0	362.461	2.585	50	0		FFAARM
Cc1cccc(N2C(=O)[N-]C(=O)[C@@]3(Cc4cc(C)ccc4N(C)C3)C2=O)c1	ZINC000009358268	506693630	/nfs/dbraw/zinc/69/36/30/506693630.db2.gz	MLPUERASAJNOJS-NRFANRHFSA-N	-1	0	363.417	2.565	50	0		FFAARM
COc1ccccc1S(=O)(=O)[N-]c1ccc(OCC(F)(F)F)nc1	ZINC000057504998	507281639	/nfs/dbraw/zinc/28/16/39/507281639.db2.gz	SOBUGXUCUUCKAW-UHFFFAOYSA-N	-1	0	362.329	2.832	50	0		FFAARM
CCN(CC)C(=O)c1cccc([N-]S(=O)(=O)c2c[nH]c3ncccc23)c1	ZINC000058160252	507377133	/nfs/dbraw/zinc/37/71/33/507377133.db2.gz	JNJXUZPDVLCBQG-UHFFFAOYSA-N	-1	0	372.450	2.846	50	0		FFAARM
CON(C)C(=O)c1ccccc1[N-]S(=O)(=O)c1ccc2c(c1)CCC2	ZINC000058167277	507378810	/nfs/dbraw/zinc/37/88/10/507378810.db2.gz	GQPOMMAPWSXNEB-UHFFFAOYSA-N	-1	0	360.435	2.610	50	0		FFAARM
CC(=O)N1c2ccc(S(=O)(=O)[N-]c3cccc4c[nH]nc43)cc2C[C@H]1C	ZINC000024425523	507410118	/nfs/dbraw/zinc/41/01/18/507410118.db2.gz	KQUJADRACGJJOT-LLVKDONJSA-N	-1	0	370.434	2.661	50	0		FFAARM
O=C([O-])CCc1cc2n(n1)CCN(Cc1cccc(-c3ccccn3)c1)C2	ZINC000072134531	507754493	/nfs/dbraw/zinc/75/44/93/507754493.db2.gz	GHEAPDAZJUDHSR-UHFFFAOYSA-N	-1	0	362.433	2.978	50	0		FFAARM
O=C([O-])C1(Oc2ccccc2F)CCN(C(=O)NC2CCCC2)CC1	ZINC000072432125	507790837	/nfs/dbraw/zinc/79/08/37/507790837.db2.gz	RDNNMQCLGFZTCD-UHFFFAOYSA-N	-1	0	350.390	2.776	50	0		FFAARM
O=C1OCCN1c1cccc([N-]S(=O)(=O)c2cc(F)ccc2F)c1	ZINC000031719979	507821251	/nfs/dbraw/zinc/82/12/51/507821251.db2.gz	HZARRLSNPNUOSW-UHFFFAOYSA-N	-1	0	354.334	2.722	50	0		FFAARM
COC(=O)c1ccc(S(=O)(=O)[N-]c2cc(CC(C)C)[nH]n2)cc1C	ZINC000079108508	507933698	/nfs/dbraw/zinc/93/36/98/507933698.db2.gz	JUXWUCXUYQICDT-UHFFFAOYSA-N	-1	0	351.428	2.504	50	0		FFAARM
Cc1nn(C)c(C)c1CCC(=O)N1C[C@@H](c2ccccc2C)[C@H](C(=O)[O-])C1	ZINC000091417027	507984218	/nfs/dbraw/zinc/98/42/18/507984218.db2.gz	IPNSUVYIBXWFBM-RBUKOAKNSA-N	-1	0	369.465	2.605	50	0		FFAARM
COc1cccc(C(=O)N2C[C@@H](c3cccc(F)c3)[C@H](C(=O)[O-])C2)c1OC	ZINC000091965250	508028155	/nfs/dbraw/zinc/02/81/55/508028155.db2.gz	YXHPTCNNVTUJET-JKSUJKDBSA-N	-1	0	373.380	2.783	50	0		FFAARM
COc1cccc(C(=O)N2C[C@@H](c3cccc(OC)c3)[C@H](C(=O)[O-])C2)c1	ZINC000092045878	508037288	/nfs/dbraw/zinc/03/72/88/508037288.db2.gz	MJBFHOIOCLNBOA-ZWKOTPCHSA-N	-1	0	355.390	2.644	50	0		FFAARM
O=C([O-])c1ccc([C@@H]2CCCN(C(=O)C3(Cn4cccn4)CC3)C2)cc1	ZINC000095358542	508175336	/nfs/dbraw/zinc/17/53/36/508175336.db2.gz	NTUBCENFAWKPSH-QGZVFWFLSA-N	-1	0	353.422	2.768	50	0		FFAARM
C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)N1CCC[C@H](c2nnn[n-]2)C1	ZINC000095432772	508184886	/nfs/dbraw/zinc/18/48/86/508184886.db2.gz	BOFLRDAYHMWEKU-KBPBESRZSA-N	-1	0	357.458	2.671	50	0		FFAARM
COc1ccc(Cn2[nH][n-]c3c(=O)n(-c4ccccc4Cl)c(=O)c2=3)cc1	ZINC000095481475	508188860	/nfs/dbraw/zinc/18/88/60/508188860.db2.gz	SKYKQGPQVIMSDX-HZPDHXFCSA-N	-1	0	370.796	2.842	50	0		FFAARM
C[C@@H](NC(=O)Cc1csc(-c2cccc(Br)c2)n1)C(=O)[O-]	ZINC000095482638	508189067	/nfs/dbraw/zinc/18/90/67/508189067.db2.gz	MJGHWHFWSSFKAG-MRVPVSSYSA-N	-1	0	369.240	2.704	50	0		FFAARM
Cc1nc(N(C)C)ncc1C(=O)N1CCC[C@@H]1c1ccc(C(=O)[O-])s1	ZINC000095505982	508192162	/nfs/dbraw/zinc/19/21/62/508192162.db2.gz	PTAYTZUIVNYCNU-GFCCVEGCSA-N	-1	0	360.439	2.588	50	0		FFAARM
Cc1ccc2nc(C(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)[O-])cn2c1	ZINC000095521967	508194775	/nfs/dbraw/zinc/19/47/75/508194775.db2.gz	DIGJZGBSCPSKEB-INIZCTEOSA-N	-1	0	362.389	2.550	50	0		FFAARM
Cn1ccnc1[C@H](Nc1nccc(-c2cc(C(=O)[O-])ccn2)n1)C1CC1	ZINC000077375597	508306885	/nfs/dbraw/zinc/30/68/85/508306885.db2.gz	PLKBSVYWDBBELS-OAHLLOKOSA-N	-1	0	350.382	2.534	50	0		FFAARM
CCOc1ccc(-c2ccnc(N(C)Cc3nccn3C)n2)cc1C(=O)[O-]	ZINC000077407118	508312072	/nfs/dbraw/zinc/31/20/72/508312072.db2.gz	XJOWPUGKCZEKBP-UHFFFAOYSA-N	-1	0	367.409	2.610	50	0		FFAARM
CN(C(=O)c1cccc(C(=O)N2CCC[C@@H](C(=O)[O-])C2)c1)c1ccccc1	ZINC000136127135	508672709	/nfs/dbraw/zinc/67/27/09/508672709.db2.gz	PQXAMQQMPLRCQV-QGZVFWFLSA-N	-1	0	366.417	2.900	50	0		FFAARM
O=C(NC1CCN(C(=O)N2CCCCC2)CC1)c1ccc([O-])c(Cl)c1	ZINC000216285346	509259395	/nfs/dbraw/zinc/25/93/95/509259395.db2.gz	HCIRJUWOBPNYON-UHFFFAOYSA-N	-1	0	365.861	2.846	50	0		FFAARM
O=C([O-])c1ccc(-c2nc3c([nH]2)CN(Cc2cncn2C2CC2)CC3)cc1	ZINC000222986723	509327061	/nfs/dbraw/zinc/32/70/61/509327061.db2.gz	BOTNWCXOOWDUNW-UHFFFAOYSA-N	-1	0	363.421	2.865	50	0		FFAARM
COc1ccc2[nH]cc(CC(=O)N3Cc4ccccc4C[C@@H]3C(=O)[O-])c2c1	ZINC000237459832	509651717	/nfs/dbraw/zinc/65/17/17/509651717.db2.gz	YOPPYUAEIJQPPM-LJQANCHMSA-N	-1	0	364.401	2.757	50	0		FFAARM
C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N1CCO[C@@H](CC(=O)[O-])C1	ZINC000237528491	509671156	/nfs/dbraw/zinc/67/11/56/509671156.db2.gz	GDRYTECYSNFNTB-FZMZJTMJSA-N	-1	0	359.344	2.586	50	0		FFAARM
C[C@H](Oc1cccc(Br)c1)C(=O)N1CC[C@](C)(C(=O)[O-])C1	ZINC000237646178	509701285	/nfs/dbraw/zinc/70/12/85/509701285.db2.gz	QEQGPSIJJJPDES-BONVTDFDSA-N	-1	0	356.216	2.540	50	0		FFAARM
Cc1oc(-c2ccco2)nc1CC(=O)N1Cc2ccccc2C[C@@H]1C(=O)[O-]	ZINC000237657313	509703519	/nfs/dbraw/zinc/70/35/19/509703519.db2.gz	VYQDQUZISVCPQF-MRXNPFEDSA-N	-1	0	366.373	2.824	50	0		FFAARM
Cc1nc(-c2cnn(C)c2)sc1C(=O)N1CCC[C@H](CCC(=O)[O-])C1	ZINC000237733648	509722501	/nfs/dbraw/zinc/72/25/01/509722501.db2.gz	QLKRBVCDXAIIRN-GFCCVEGCSA-N	-1	0	362.455	2.569	50	0		FFAARM
Cc1cccc2c(CCC(=O)N(CCC(=O)[O-])C3CCOCC3)c[nH]c21	ZINC000237759799	509728964	/nfs/dbraw/zinc/72/89/64/509728964.db2.gz	VGLYBTQHUBJONE-UHFFFAOYSA-N	-1	0	358.438	2.891	50	0		FFAARM
Cc1nn(-c2ccc(F)cc2)c(Cl)c1C(=O)N1CC[C@H](C(=O)[O-])C1	ZINC000237768629	509730845	/nfs/dbraw/zinc/73/08/45/509730845.db2.gz	OVHPFYSVELEEBS-JTQLQIEISA-N	-1	0	351.765	2.520	50	0		FFAARM
O=C([O-])CC[C@@H]1CCCCN1C(=O)Cc1ccn(-c2ccc(F)cc2)n1	ZINC000237929577	509776343	/nfs/dbraw/zinc/77/63/43/509776343.db2.gz	IEPYCVGHRVHJDX-INIZCTEOSA-N	-1	0	359.401	2.800	50	0		FFAARM
O=C([O-])[C@@H]1CCN(C(=O)CCCOc2cccc(Br)c2)C1	ZINC000237947356	509781570	/nfs/dbraw/zinc/78/15/70/509781570.db2.gz	VICSGMIURUZVOO-LLVKDONJSA-N	-1	0	356.216	2.541	50	0		FFAARM
O=C([O-])CN(C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1)C1CCOCC1	ZINC000238103925	509821359	/nfs/dbraw/zinc/82/13/59/509821359.db2.gz	PDKVPQKQEAJEKL-LSDHHAIUSA-N	-1	0	371.355	2.901	50	0		FFAARM
O=C([O-])Cc1ccc(S(=O)(=O)N[C@@H]2CCC[C@H](C(F)(F)F)C2)s1	ZINC000238107140	509821551	/nfs/dbraw/zinc/82/15/51/509821551.db2.gz	OOAUEXNPNNEZFV-DTWKUNHWSA-N	-1	0	371.402	2.775	50	0		FFAARM
O=C([O-])CN(C(=O)[C@@H]1C[C@H]1c1c(F)cccc1Cl)C1CCOCC1	ZINC000238103783	509821592	/nfs/dbraw/zinc/82/15/92/509821592.db2.gz	LPGSFIMUFIMLKY-VXGBXAGGSA-N	-1	0	355.793	2.675	50	0		FFAARM
O=C([O-])CN(C(=O)/C=C(/c1ccccc1)C(F)(F)F)C1CCOCC1	ZINC000238106104	509821600	/nfs/dbraw/zinc/82/16/00/509821600.db2.gz	KSOXZAAMDQELEP-UVTDQMKNSA-N	-1	0	357.328	2.725	50	0		FFAARM
O=C([O-])c1ccc(CNC(=O)c2cc(N3CCCC3=O)ccc2F)cc1	ZINC000238130468	509825261	/nfs/dbraw/zinc/82/52/61/509825261.db2.gz	ANUFGTRLTXJYNG-UHFFFAOYSA-N	-1	0	356.353	2.581	50	0		FFAARM
O=C([O-])C[C@@H]1CN(C(=O)c2ccccc2CCc2ccccc2)CCO1	ZINC000238197745	509831726	/nfs/dbraw/zinc/83/17/26/509831726.db2.gz	IZUCLAAKKWBBRH-GOSISDBHSA-N	-1	0	353.418	2.788	50	0		FFAARM
O=C([O-])C[C@@H]1CN(C(=O)[C@H]2C[C@@H]2c2cccc(Cl)c2Cl)CCO1	ZINC000238197139	509832459	/nfs/dbraw/zinc/83/24/59/509832459.db2.gz	FTHODCZSPUCXTO-JLLWLGSASA-N	-1	0	358.221	2.799	50	0		FFAARM
CCOc1cc(C)c(Cl)cc1S(=O)(=O)[N-]c1ccccc1C(N)=O	ZINC000252491893	509842398	/nfs/dbraw/zinc/84/23/98/509842398.db2.gz	LYLHLYSBMADXPI-UHFFFAOYSA-N	-1	0	368.842	2.947	50	0		FFAARM
O=C([O-])c1cccc(CNC(=O)[C@@H]2C[C@@H]2c2ccc3c(c2)OCCO3)c1	ZINC000299745947	511667990	/nfs/dbraw/zinc/66/79/90/511667990.db2.gz	UFKDTKSPSRUQJR-HZPDHXFCSA-N	-1	0	353.374	2.576	50	0		FFAARM
CCOc1ccc2c(c1)C[C@H](C(=O)N(C)Cc1cc(C(=O)[O-])c(C)o1)CO2	ZINC000299748645	511669114	/nfs/dbraw/zinc/66/91/14/511669114.db2.gz	HTYBIMSPDCMSCK-AWEZNQCLSA-N	-1	0	373.405	2.895	50	0		FFAARM
C[C@@H](C(=O)[O-])N(C)C(=O)[C@@H](c1cccc(Br)c1)N1CCCC1	ZINC000408513540	513084557	/nfs/dbraw/zinc/08/45/57/513084557.db2.gz	VCRSHTUKJFJQGO-SMDDNHRTSA-N	-1	0	369.259	2.518	50	0		FFAARM
COc1ccc(NC(=O)N2CCC[C@@H](c3ccn(CC(=O)[O-])n3)C2)c(C)c1	ZINC000426397439	513927720	/nfs/dbraw/zinc/92/77/20/513927720.db2.gz	OLYAIINHYDUABD-CQSZACIVSA-N	-1	0	372.425	2.696	50	0		FFAARM
CC(C)[C@H](CC(=O)[O-])NC(=O)N(C)Cc1cnn(-c2ccc(F)cc2)c1	ZINC000426573159	513984975	/nfs/dbraw/zinc/98/49/75/513984975.db2.gz	NSEBKMJLGMHNGU-INIZCTEOSA-N	-1	0	362.405	2.652	50	0		FFAARM
COc1cc(CCC(=O)N2Cc3ccccc3C[C@@H]2C(=O)[O-])cc(OC)c1	ZINC000268961969	522325615	/nfs/dbraw/zinc/32/56/15/522325615.db2.gz	ZSCFRKYUDBYXQH-LJQANCHMSA-N	-1	0	369.417	2.675	50	0		FFAARM
CC(=O)Nc1cc(C(=O)N2CCc3c(F)ccc(C(=O)[O-])c3C2)ccc1C	ZINC000630239465	522726457	/nfs/dbraw/zinc/72/64/57/522726457.db2.gz	UPMATKPRSXIKGX-UHFFFAOYSA-N	-1	0	370.380	2.989	50	0		FFAARM
O=C([O-])c1cnc(C2CCN(C(=O)[C@H]3COc4ccccc4C3)CC2)s1	ZINC000630243007	522731179	/nfs/dbraw/zinc/73/11/79/522731179.db2.gz	QPSDHEIXTMCYML-CQSZACIVSA-N	-1	0	372.446	2.799	50	0		FFAARM
Cc1ccccc1N1CCN(c2ccc(NC(=O)/C=C/C(=O)[O-])cc2)CC1	ZINC000000627217	525227060	/nfs/dbraw/zinc/22/70/60/525227060.db2.gz	SBZCRTNWUMXPLR-ZHACJKMWSA-N	-1	0	365.433	2.901	50	0		FFAARM
C[C@@H](Sc1ccccc1Cl)C(=O)N1CCC[C@@H](c2nnn[n-]2)C1	ZINC000089420094	525994807	/nfs/dbraw/zinc/99/48/07/525994807.db2.gz	NCJJLCDGQZTTHR-GHMZBOCLSA-N	-1	0	351.863	2.740	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)C[C@H]1CCCO1)c1ccc(Br)cc1	ZINC000238129239	527624342	/nfs/dbraw/zinc/62/43/42/527624342.db2.gz	WZSWPTNEPDCJCV-CHWSQXEVSA-N	-1	0	356.216	2.650	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)[C@@H]1CC(=O)Nc2ccccc21)c1ccc(F)cc1	ZINC000238142250	527625605	/nfs/dbraw/zinc/62/56/05/527625605.db2.gz	RFBAPSSIFUKBQD-GDBMZVCRSA-N	-1	0	356.353	2.584	50	0		FFAARM
O=C([O-])C[C@@H]1CN(C(=O)c2cccc(OCc3cccs3)c2)CCO1	ZINC000262436951	527631309	/nfs/dbraw/zinc/63/13/09/527631309.db2.gz	LZQWHZBOHDTZCB-OAHLLOKOSA-N	-1	0	361.419	2.643	50	0		FFAARM
CCN1C(=O)CC(C)(C)c2cc(S(=O)(=O)[N-]c3cc(C)on3)ccc21	ZINC000096183065	535426941	/nfs/dbraw/zinc/42/69/41/535426941.db2.gz	QCPLTYQQWJHUES-UHFFFAOYSA-N	-1	0	363.439	2.818	50	0		FFAARM
COc1ccccc1N1CCN(C(=O)c2ccc([O-])c(Cl)c2)CC1=O	ZINC000082109600	537066661	/nfs/dbraw/zinc/06/66/61/537066661.db2.gz	FKUUFKUBZZTNCK-UHFFFAOYSA-N	-1	0	360.797	2.543	50	0		FFAARM
O=C(CCC(=O)c1cccs1)[N-]S(=O)(=O)c1cccc2cnccc21	ZINC000109414870	570918458	/nfs/dbraw/zinc/91/84/58/570918458.db2.gz	GQEOXOGCTAAHKX-UHFFFAOYSA-N	-1	0	374.443	2.764	50	0		FFAARM
Cc1nn(C(C)(C)C)c2nc(C3CC3)cc(C(=O)N3CC[C@H](C(=O)[O-])C3)c12	ZINC000178256842	597495853	/nfs/dbraw/zinc/49/58/53/597495853.db2.gz	HWDIVHFHNXCJKZ-ZDUSSCGKSA-N	-1	0	370.453	2.919	50	0		FFAARM
O=C([O-])C1CCC(NC(=O)Cc2cc(F)ccc2Br)CC1	ZINC000263156427	604836844	/nfs/dbraw/zinc/83/68/44/604836844.db2.gz	OEYSWAHKJIWFHA-UHFFFAOYSA-N	-1	0	358.207	2.890	50	0		FFAARM
CC(C)Cc1nnc([N-]S(=O)(=O)c2cccc3c2OC(C)(C)C3)o1	ZINC000192627244	729454373	/nfs/dbraw/zinc/45/43/73/729454373.db2.gz	YCAJSWVXWJTKHR-UHFFFAOYSA-N	-1	0	351.428	2.782	50	0		FFAARM
Cc1csc([C@@H](NC(=O)NC2CCC(C(=O)[O-])CC2)C(F)(F)F)n1	ZINC000262986237	729675860	/nfs/dbraw/zinc/67/58/60/729675860.db2.gz	CSPHTURXNPNVIO-UDNWOFFPSA-N	-1	0	365.377	2.998	50	0		FFAARM
COC(=O)CCCCC([O-])=C1C(=O)CC(C)(C)[C@H](c2cc(C)no2)C1=O	ZINC000105304174	975849129	/nfs/dbraw/zinc/84/91/29/975849129.db2.gz	UYYRYVLWZLNLTI-IAGOWNOFSA-N	-1	0	363.410	2.553	50	0		FFAARM
Cc1ccc(CN(C(=O)c2cc(C)c3c(=O)[n-]c(=O)nc-3[nH]2)C(C)C)s1	ZINC000174267222	986166356	/nfs/dbraw/zinc/16/63/56/986166356.db2.gz	HDEWIUNICBBFKJ-UHFFFAOYSA-N	-1	0	372.450	2.753	50	0		FFAARM
Cn1ccnc1[C@H]1OCC[C@@H]1N=c1[n-]nc(-c2ccccc2Cl)s1	ZINC000585079887	1008239862	/nfs/dbraw/zinc/23/98/62/1008239862.db2.gz	AZHIFAQZAITJFF-STQMWFEESA-N	-1	0	361.858	2.956	50	0		FFAARM
CC[C@H](C(=O)N1CCC(Oc2ccccc2)(C(=O)[O-])CC1)n1cccc1	ZINC000072474839	1019904314	/nfs/dbraw/zinc/90/43/14/1019904314.db2.gz	PHNJOVAFMYFBCV-QGZVFWFLSA-N	-1	0	356.422	2.964	50	0		FFAARM
O=C([O-])c1ccc(CN2CCC[C@H](S(=O)(=O)Nc3ccccc3)C2)cc1	ZINC000666575968	1027131616	/nfs/dbraw/zinc/13/16/16/1027131616.db2.gz	CMQLRHCTSNUGJT-SFHVURJKSA-N	-1	0	374.462	2.791	50	0		FFAARM
Cc1ccc(C(=O)[O-])c(N2C[C@H]3CC[C@@H](C2)C(=O)N3Cc2ccccc2)n1	ZINC000091974027	1027180291	/nfs/dbraw/zinc/18/02/91/1027180291.db2.gz	WSDSKTLINSUKDF-DLBZAZTESA-N	-1	0	365.433	2.716	50	0		FFAARM
O=C([O-])c1ccccc1C1CCN(C(=O)Nc2nc3ccccn3n2)CC1	ZINC000669502585	1027958123	/nfs/dbraw/zinc/95/81/23/1027958123.db2.gz	QTHCRHCPDGGQEZ-UHFFFAOYSA-N	-1	0	365.393	2.839	50	0		FFAARM
COc1ccc(Cl)cc1[C@H](C(=O)[O-])N(C)Cc1nncn1C(C)C	ZINC001506413198	1059504130	/nfs/dbraw/zinc/50/41/30/1059504130.db2.gz	IHQZLHKEWROLOW-OAHLLOKOSA-N	-1	0	352.822	2.779	50	0		FFAARM
O=C([O-])c1ccc(Br)c(N2C(=O)[C@@H]3CC=CC[C@H]3C2=O)c1	ZINC000000032555	210247423	/nfs/dbraw/zinc/24/74/23/210247423.db2.gz	JZIPZDADEZRTHY-NXEZZACHSA-N	-1	0	350.168	2.603	50	0		FFAARM
COc1cc(/C=C2/N=C(c3cccc(C)c3)OC2=O)ccc1OCC(=O)[O-]	ZINC000006478642	210230473	/nfs/dbraw/zinc/23/04/73/210230473.db2.gz	JPTRPUGHYQCEGP-OQLLNIDSSA-N	-1	0	367.357	2.812	50	0		FFAARM
COc1ccccc1/C=C(/C(=O)N1CCO[C@H](C(=O)[O-])C1)c1ccccc1	ZINC000328595274	210109895	/nfs/dbraw/zinc/10/98/95/210109895.db2.gz	PTXWLLSDBYLQOC-UMEYKSNOSA-N	-1	0	367.401	2.548	50	0		FFAARM
COc1ccc(-n2c(=O)c3ccc(C(=O)[O-])cc3[nH]c2=S)c(OC)c1	ZINC000003632922	210080361	/nfs/dbraw/zinc/08/03/61/210080361.db2.gz	ZUCRCYBNURKAFO-UHFFFAOYSA-N	-1	0	358.375	2.764	50	0		FFAARM
COc1ccc(OC)c(-c2ccnc(-n3ncc(C(=O)[O-])c3C3CC3)n2)c1	ZINC000299782982	210027423	/nfs/dbraw/zinc/02/74/23/210027423.db2.gz	GVPRKHQWXOSONH-UHFFFAOYSA-N	-1	0	366.377	2.922	50	0		FFAARM
Cc1nc(NC(=O)CN2CCCC[C@@H]2c2ccccn2)sc1C(=O)[O-]	ZINC000299767291	210015864	/nfs/dbraw/zinc/01/58/64/210015864.db2.gz	FWKMBVLHFYMECQ-CYBMUJFWSA-N	-1	0	360.439	2.710	50	0		FFAARM
CCCc1cc(-c2nc(CC(=O)N[C@H](C(=O)[O-])C(C)C)cs2)ccn1	ZINC000223241709	222770488	/nfs/dbraw/zinc/77/04/88/222770488.db2.gz	UVHMFJKPOXBUSL-INIZCTEOSA-N	-1	0	361.467	2.926	50	0		FFAARM
COc1ccc(CCC(=O)N2CC[C@](C)(C(=O)[O-])C2)cc1Br	ZINC000237189664	222905244	/nfs/dbraw/zinc/90/52/44/222905244.db2.gz	QGOGIKWPHSNQBY-INIZCTEOSA-N	-1	0	370.243	2.714	50	0		FFAARM
Cn1c2ccccc2c(Cl)c1C(=O)N(CCC(=O)[O-])C1CCOCC1	ZINC000237709458	222909266	/nfs/dbraw/zinc/90/92/66/222909266.db2.gz	TYPCKMHYMWPLEN-UHFFFAOYSA-N	-1	0	364.829	2.928	50	0		FFAARM
Cc1ccccc1[C@H](CC(=O)[O-])NC(=O)[C@H]1CC(=O)Nc2ccccc21	ZINC000237657809	222909894	/nfs/dbraw/zinc/90/98/94/222909894.db2.gz	UACSJFQMNOEEFZ-RDJZCZTQSA-N	-1	0	352.390	2.753	50	0		FFAARM
Cn1cnnc1Sc1ccc([N-]S(=O)(=O)c2cccs2)cc1	ZINC000012520872	220001434	/nfs/dbraw/zinc/00/14/34/220001434.db2.gz	JTOSFWIWSPYWPO-UHFFFAOYSA-N	-1	0	352.466	2.829	50	0		FFAARM
CCOc1ccc(S(=O)(=O)Nc2cccc(C(=O)[O-])c2)cc1OCC	ZINC000012541610	220004777	/nfs/dbraw/zinc/00/47/77/220004777.db2.gz	IASSHVYJLNZVDC-UHFFFAOYSA-N	-1	0	365.407	2.983	50	0		FFAARM
Cc1csc([C@](O)(CC(=O)[N-]OCc2ccccc2)C(F)(F)F)n1	ZINC000058417868	212009722	/nfs/dbraw/zinc/00/97/22/212009722.db2.gz	HDBMJJYEHRIROL-CQSZACIVSA-N	-1	0	360.357	2.840	50	0		FFAARM
O=C([O-])[C@H]1CC=CC[C@H]1C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1	ZINC000055150490	211938900	/nfs/dbraw/zinc/93/89/00/211938900.db2.gz	UNWMZUURJPDCDL-SJORKVTESA-N	-1	0	356.422	2.965	50	0		FFAARM
O=C([O-])[C@H]1CC=CC[C@@H]1C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1	ZINC000055150493	211938707	/nfs/dbraw/zinc/93/87/07/211938707.db2.gz	UNWMZUURJPDCDL-IRXDYDNUSA-N	-1	0	356.422	2.965	50	0		FFAARM
O=C([O-])COc1cccc(CNC(=O)C[C@@H]2CCOc3ccccc32)c1	ZINC000299753103	211837628	/nfs/dbraw/zinc/83/76/28/211837628.db2.gz	WVRVZWBGBZCKHE-HNNXBMFYSA-N	-1	0	355.390	2.723	50	0		FFAARM
COc1cccc2c(C)c(C(=O)N(CCC(=O)[O-])C[C@@H]3CCCO3)oc21	ZINC000299749004	211829040	/nfs/dbraw/zinc/82/90/40/211829040.db2.gz	IWDYYSLBLNBRBQ-ZDUSSCGKSA-N	-1	0	361.394	2.846	50	0		FFAARM
Cc1oc(CN(C)C(=O)[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1C(=O)[O-]	ZINC000299747022	211825412	/nfs/dbraw/zinc/82/54/12/211825412.db2.gz	BWBNKRJEJNCVHU-MRXNPFEDSA-N	-1	0	370.405	2.606	50	0		FFAARM
Cc1noc2nc(-c3ccccc3)cc(C(=O)N3CC[C@H](C(=O)[O-])C3)c12	ZINC000299742220	211821383	/nfs/dbraw/zinc/82/13/83/211821383.db2.gz	IXYSBAIUICLZOS-ZDUSSCGKSA-N	-1	0	351.362	2.745	50	0		FFAARM
COc1ccc(-c2ccc(S(=O)(=O)N3CCC[C@H]3C(=O)[O-])cc2)cc1	ZINC000036293944	211659832	/nfs/dbraw/zinc/65/98/32/211659832.db2.gz	HKJZCSFHYGTQEW-KRWDZBQOSA-N	-1	0	361.419	2.600	50	0		FFAARM
O=C1NCc2cccc([N-]S(=O)(=O)c3ccc(OC(F)(F)F)cc3)c21	ZINC000025045405	211421160	/nfs/dbraw/zinc/42/11/60/211421160.db2.gz	GMJRMMYSGMFXEH-UHFFFAOYSA-N	-1	0	372.324	2.629	50	0		FFAARM
CCn1nc(C)c(-c2cc(C(=O)[O-])n3ncc(Br)c3n2)c1C	ZINC000020605630	211289925	/nfs/dbraw/zinc/28/99/25/211289925.db2.gz	LMVUNRUJTCIWMX-UHFFFAOYSA-N	-1	0	364.203	2.690	50	0		FFAARM
CCN1C(=O)/C(=C/C=C2/Sc3ccccc3N2CC(=O)[O-])OC1=S	ZINC000018173695	211193999	/nfs/dbraw/zinc/19/39/99/211193999.db2.gz	QZSCNGYYVQSXHA-JKNYEHFOSA-N	-1	0	362.432	2.572	50	0		FFAARM
CC(C)(C)NS(=O)(=O)c1ccc([N-]S(=O)(=O)c2cccs2)cc1	ZINC000017076669	211178989	/nfs/dbraw/zinc/17/89/89/211178989.db2.gz	JYCDACRXIXWBRN-UHFFFAOYSA-N	-1	0	374.509	2.626	50	0		FFAARM
C[C@H](CC(=O)[O-])CC(=O)Nc1sc(Cc2ccccc2)cc1C(N)=O	ZINC000017074249	211177894	/nfs/dbraw/zinc/17/78/94/211177894.db2.gz	IILAHVKJDNHGII-NSHDSACASA-N	-1	0	360.435	2.877	50	0		FFAARM
COc1ccc(CCNc2nc(=O)c(-c3ccc(C)cc3)n[n-]2)cc1OC	ZINC000016045960	211152882	/nfs/dbraw/zinc/15/28/82/211152882.db2.gz	OOVOUMKDVTVSGS-UHFFFAOYSA-N	-1	0	366.421	2.812	50	0		FFAARM
COc1ccc(OC)c(S(=O)(=O)[N-]c2cccc(Cn3cccn3)c2)c1	ZINC000014232447	211087696	/nfs/dbraw/zinc/08/76/96/211087696.db2.gz	DXIPYOKEKWGOFA-UHFFFAOYSA-N	-1	0	373.434	2.749	50	0		FFAARM
COc1ccccc1CC(=O)N1CCC(C(=O)[O-])(c2ccccc2)CC1	ZINC000013186212	211028458	/nfs/dbraw/zinc/02/84/58/211028458.db2.gz	PRGRXHWAPRJHIJ-UHFFFAOYSA-N	-1	0	353.418	2.883	50	0		FFAARM
CS(=O)(=O)[N-]c1ccccc1C(=O)NCCc1c[nH]c2ccccc12	ZINC000012605451	210977003	/nfs/dbraw/zinc/97/70/03/210977003.db2.gz	BXULVHHWYSRSGE-UHFFFAOYSA-N	-1	0	357.435	2.512	50	0		FFAARM
COc1ccc(CC(=O)Nc2c([O-])c3ccccc3oc2=O)cc1OC	ZINC000006825896	210706826	/nfs/dbraw/zinc/70/68/26/210706826.db2.gz	RROJYCSBIXJAHB-UHFFFAOYSA-N	-1	0	355.346	2.697	50	0		FFAARM
O=C([O-])C1[C@@H](c2ccccc2)C(C(=O)OCCCO)[C@@H]1c1ccccc1	ZINC000004410294	210529618	/nfs/dbraw/zinc/52/96/18/210529618.db2.gz	PCFRNRNCXSRKCS-YYZRRKBYSA-N	-1	0	354.402	2.810	50	0		FFAARM
Cc1oc2cc3oc(=O)c(CC(=O)N(C)CC(=O)[O-])c(C)c3cc2c1C	ZINC000002156056	210382208	/nfs/dbraw/zinc/38/22/08/210382208.db2.gz	RSULOWWWKRFJQU-UHFFFAOYSA-N	-1	0	357.362	2.550	50	0	biogenic	FFAARM
Cc1ccc(S(=O)(=O)[N-]c2ccc(-c3ccc(=O)n(C)n3)cc2)s1	ZINC000010324941	210354109	/nfs/dbraw/zinc/35/41/09/210354109.db2.gz	HHGBNOJKCRHRQG-UHFFFAOYSA-N	-1	0	361.448	2.618	50	0		FFAARM
COc1cc(C)c(C)cc1S(=O)(=O)[N-]c1ccc2c(c1)CCC(=O)N2	ZINC000009828280	210341384	/nfs/dbraw/zinc/34/13/84/210341384.db2.gz	VQNYPHLKSHRWCJ-UHFFFAOYSA-N	-1	0	360.435	2.998	50	0		FFAARM
COc1cccc(NC(=O)CSCc2nc(=O)c3sccc3[n-]2)c1	ZINC000009743618	210336397	/nfs/dbraw/zinc/33/63/97/210336397.db2.gz	ZRBDLHFKUANGKR-UHFFFAOYSA-N	-1	0	361.448	2.865	50	0		FFAARM
COc1cc(/C=C(/NC(=O)c2ccc(C)cc2)C(=O)[O-])cc(OC)c1OC	ZINC000001170059	210328375	/nfs/dbraw/zinc/32/83/75/210328375.db2.gz	GXSURNOALWJSDB-OQLLNIDSSA-N	-1	0	371.389	2.876	50	0		FFAARM
CCCNC(=O)c1cccc(Cn2c(=O)c3ccccc3[n-]c2=S)c1	ZINC000055179152	221061660	/nfs/dbraw/zinc/06/16/60/221061660.db2.gz	HYEWLVULELDGNQ-UHFFFAOYSA-N	-1	0	353.447	2.873	50	0		FFAARM
COc1ccc(NS(=O)(=O)c2ccc(OC)c(C(=O)[O-])c2)cc1C	ZINC000055688707	221073654	/nfs/dbraw/zinc/07/36/54/221073654.db2.gz	TWNNGPLYJVDOKV-UHFFFAOYSA-N	-1	0	351.380	2.511	50	0		FFAARM
CCn1nc(C)c([N-]S(=O)(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)c1C	ZINC000057279923	221085988	/nfs/dbraw/zinc/08/59/88/221085988.db2.gz	DNIFWLZIZJQRPU-UHFFFAOYSA-N	-1	0	362.455	2.550	50	0		FFAARM
CCc1nn2c(nc(C)c2S(=O)(=O)[N-]c2ccc(C)cc2F)s1	ZINC000065183797	221176184	/nfs/dbraw/zinc/17/61/84/221176184.db2.gz	BNXLDTHMBMCZKS-UHFFFAOYSA-N	-1	0	354.432	2.910	50	0		FFAARM
CCc1nc2sc(C)nn2c1S(=O)(=O)[N-]c1cc(C)ccc1F	ZINC000065183913	221176205	/nfs/dbraw/zinc/17/62/05/221176205.db2.gz	DSNPVSGTOQADOS-UHFFFAOYSA-N	-1	0	354.432	2.910	50	0		FFAARM
COc1cccc(-c2c(C(=O)[O-])nnn2-c2ccc(OC)c(OC)c2)c1	ZINC000065288233	221195482	/nfs/dbraw/zinc/19/54/82/221195482.db2.gz	OWVFMRCGCQALLG-UHFFFAOYSA-N	-1	0	355.350	2.658	50	0		FFAARM
CCCN1CCn2cc(S(=O)(=O)[N-]c3cccc(C)c3C)cc2C1=O	ZINC000065254795	221188679	/nfs/dbraw/zinc/18/86/79/221188679.db2.gz	CCZWHILTAXDKBM-UHFFFAOYSA-N	-1	0	361.467	2.772	50	0		FFAARM
Cc1nn(Cc2nnc(SCC(=O)[O-])n2-c2ccccc2)c(C)c1C	ZINC000065507483	221228082	/nfs/dbraw/zinc/22/80/82/221228082.db2.gz	WHEARGMNWGJCPF-UHFFFAOYSA-N	-1	0	357.439	2.614	50	0		FFAARM
O=C([C@@H]1CC(c2ccccc2)=NO1)N1CCC(c2n[n-]c(=S)o2)CC1	ZINC000065575781	221233455	/nfs/dbraw/zinc/23/34/55/221233455.db2.gz	ITHQWINXLDNUON-AWEZNQCLSA-N	-1	0	358.423	2.631	50	0		FFAARM
Cc1c(C(=O)[O-])sc2ncnc(N(C)CCc3noc(C(C)C)n3)c12	ZINC000067726321	221277929	/nfs/dbraw/zinc/27/79/29/221277929.db2.gz	UAXVGZSTGLPLQB-UHFFFAOYSA-N	-1	0	361.427	2.883	50	0		FFAARM
CC(C)c1nc(CNC(=O)c2ccc(-c3ccccc3C(=O)[O-])nc2)no1	ZINC000067894840	221302212	/nfs/dbraw/zinc/30/22/12/221302212.db2.gz	LGQDMMXYHFWDOT-UHFFFAOYSA-N	-1	0	366.377	2.883	50	0		FFAARM
CC1(C)[C@H](C(=O)[O-])[C@@H]1C(=O)Nc1cc(Cl)ccc1C(=O)N1CCCC1	ZINC000071285650	221338992	/nfs/dbraw/zinc/33/89/92/221338992.db2.gz	NUVHWRWGGRJMPG-KGLIPLIRSA-N	-1	0	364.829	2.871	50	0		FFAARM
COc1ccc(NC(=O)[C@@H]2[C@H](C(=O)[O-])C2(C)C)cc1NC(=O)C1CCC1	ZINC000071285512	221339514	/nfs/dbraw/zinc/33/95/14/221339514.db2.gz	RBYPOAPBDUQLQN-LSDHHAIUSA-N	-1	0	360.410	2.729	50	0		FFAARM
Cn1ccnc1C(=O)c1cccc(NC(=O)Cc2ccccc2C(=O)[O-])c1	ZINC000071288584	221340404	/nfs/dbraw/zinc/34/04/04/221340404.db2.gz	QQLAYEQBXFNJKG-UHFFFAOYSA-N	-1	0	363.373	2.531	50	0		FFAARM
CCc1ccc(NS(=O)(=O)c2cc3c(c(C(=O)[O-])c2)OCCO3)cc1	ZINC000071824014	221380662	/nfs/dbraw/zinc/38/06/62/221380662.db2.gz	QYLOUGGRPXXWFH-UHFFFAOYSA-N	-1	0	363.391	2.519	50	0		FFAARM
C[C@@H]1CN(c2ccc(NC(=O)CC(C)(C)C(=O)[O-])cc2F)C[C@H](C)O1	ZINC000170627449	132265301	/nfs/dbraw/zinc/26/53/01/132265301.db2.gz	CHVUDGZQFRLNAV-TXEJJXNPSA-N	-1	0	352.406	2.879	50	0		FFAARM
Cc1ccc(S(=O)(=O)N2c3ccc(F)cc3OC[C@@H]2CC(=O)[O-])cc1	ZINC000299803897	132300820	/nfs/dbraw/zinc/30/08/20/132300820.db2.gz	JXVKRTGSRKXUSN-ZDUSSCGKSA-N	-1	0	365.382	2.565	50	0		FFAARM
Cc1nn(C)c2ncc(C(=O)[O-])c(N3CCO[C@@H](c4ccc(F)cc4)C3)c12	ZINC000071752790	136140389	/nfs/dbraw/zinc/14/03/89/136140389.db2.gz	UBOFAFGOJRLEAY-OAHLLOKOSA-N	-1	0	370.384	2.692	50	0		FFAARM
CCC(CC)NC(=O)[C@H](C)S(=O)(=O)c1ccc(Cl)c(C(=O)[O-])c1	ZINC000095949093	221977825	/nfs/dbraw/zinc/97/78/25/221977825.db2.gz	CQANWCDBPRISQY-VIFPVBQESA-N	-1	0	361.847	2.505	50	0		FFAARM
O=C([O-])[C@H]1Cc2[nH]cnc2CN1C(=O)C(c1ccccc1)c1ccccc1	ZINC000096152695	222055304	/nfs/dbraw/zinc/05/53/04/222055304.db2.gz	VCOUIWCGBRSEGQ-GOSISDBHSA-N	-1	0	361.401	2.580	50	0		FFAARM
CC(C)n1cc(C(=O)[O-])c(=O)c(-c2ncnn2Cc2ccc(F)cc2)c1	ZINC000097743686	222210231	/nfs/dbraw/zinc/21/02/31/222210231.db2.gz	XDQHMBAEXZIWFV-UHFFFAOYSA-N	-1	0	356.357	2.573	50	0		FFAARM
CSc1nc(-c2nc(COc3ccccc3)nn2CC(=O)[O-])cs1	ZINC000097819696	222215578	/nfs/dbraw/zinc/21/55/78/222215578.db2.gz	LMHRODVLXKXMNT-UHFFFAOYSA-N	-1	0	362.436	2.787	50	0		FFAARM
CCCn1c(=O)c(C(=O)OCC)c([O-])c2cnc(-c3ccccc3)nc21	ZINC000100227210	222239889	/nfs/dbraw/zinc/23/98/89/222239889.db2.gz	SQKIAZZCKMOZGL-UHFFFAOYSA-N	-1	0	353.378	2.751	50	0		FFAARM
COC(=O)Cc1[n-]n(-c2ccccc2)c(=O)c1[C@@H]1OC(=O)c2ccccc21	ZINC000100430201	222243628	/nfs/dbraw/zinc/24/36/28/222243628.db2.gz	TYNGMHBUXNCNTA-GOSISDBHSA-N	-1	0	364.357	2.553	50	0		FFAARM
CCCc1nnc(NC(=O)c2c([O-])c3ccccc3n(CC)c2=O)s1	ZINC000100502102	222245482	/nfs/dbraw/zinc/24/54/82/222245482.db2.gz	ZUIKGMICGHFJCG-UHFFFAOYSA-N	-1	0	358.423	2.783	50	0		FFAARM
C[C@@H]1CCc2cc(F)cc3c([O-])c(C(=O)Nc4ncccc4O)c(=O)n1c23	ZINC000100663048	222248691	/nfs/dbraw/zinc/24/86/91/222248691.db2.gz	VJTRPQFKKYYOEQ-SECBINFHSA-N	-1	0	369.352	2.706	50	0		FFAARM
CCc1ccc(-n2c(=O)c3[n-][nH]n(Cc4cccc(F)c4)c=3c2=O)cc1	ZINC000101418357	222274360	/nfs/dbraw/zinc/27/43/60/222274360.db2.gz	MUUSZAKUFURIBS-IRXDYDNUSA-N	-1	0	352.369	2.882	50	0		FFAARM
COCc1c(C(=O)Nc2ccn(CC(=O)[O-])n2)sc2cccc(F)c21	ZINC000122797056	222525104	/nfs/dbraw/zinc/52/51/04/222525104.db2.gz	RMBBBOFNZIUELG-UHFFFAOYSA-N	-1	0	363.370	2.720	50	0		FFAARM
COC(=O)c1sc(S(=O)(=O)[N-]c2ccc(OC)cc2)cc1Cl	ZINC000001028657	506244061	/nfs/dbraw/zinc/24/40/61/506244061.db2.gz	OLYZBUKWQILLCQ-UHFFFAOYSA-N	-1	0	361.828	2.998	50	0		FFAARM
Cc1coc2c1cc1c(C)c(CCC(=O)N[C@@H](C)C(=O)[O-])c(=O)oc1c2C	ZINC000002103340	506272631	/nfs/dbraw/zinc/27/26/31/506272631.db2.gz	OQAGNSUHFOSDCB-LBPRGKRZSA-N	-1	0	371.389	2.986	50	0	biogenic	FFAARM
CCOC(=O)[C@]([N-]c1nccs1)(NC(=O)OC(C)C)C(F)(F)F	ZINC000002262221	506276801	/nfs/dbraw/zinc/27/68/01/506276801.db2.gz	FVJAQTANDABOPG-NSHDSACASA-N	-1	0	355.338	2.511	50	0		FFAARM
CC[C@@H](O)[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)[O-]	ZINC000002583278	506283958	/nfs/dbraw/zinc/28/39/58/506283958.db2.gz	VSKJOSVYDOHRGI-MSOLQXFVSA-N	-1	0	355.390	2.749	50	0		FFAARM
C[C@H](Cn1cc(Br)cn1)C(=O)Nc1ccc(C(=O)[O-])cc1	ZINC000002794759	506292722	/nfs/dbraw/zinc/29/27/22/506292722.db2.gz	IQDCOHOLRQKVEW-SECBINFHSA-N	-1	0	352.188	2.619	50	0		FFAARM
CCn1cc(S(=O)(=O)[N-]c2cnn(Cc3cccc(Cl)c3)c2)cn1	ZINC000002804697	506295090	/nfs/dbraw/zinc/29/50/90/506295090.db2.gz	UWKGCNVRSMOWJQ-UHFFFAOYSA-N	-1	0	365.846	2.602	50	0		FFAARM
O=C([O-])c1cccnc1S[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1=O	ZINC000002890063	506299733	/nfs/dbraw/zinc/29/97/33/506299733.db2.gz	OJTPSWWTNFEMPJ-GFCCVEGCSA-N	-1	0	362.794	2.857	50	0		FFAARM
COc1ccc(Cl)cc1N(CC(=O)[O-])S(=O)(=O)c1ccccc1	ZINC000002907601	506301777	/nfs/dbraw/zinc/30/17/77/506301777.db2.gz	WLCOJLOLYHAWKG-UHFFFAOYSA-N	-1	0	355.799	2.629	50	0		FFAARM
O=C([O-])CCNC(=O)/C(=C\c1ccc(Cl)cc1)NC(=O)c1ccccc1	ZINC000002949971	506304166	/nfs/dbraw/zinc/30/41/66/506304166.db2.gz	XUJMPCQZKXWGEP-FOWTUZBSSA-N	-1	0	372.808	2.702	50	0		FFAARM
COc1ccc(C)cc1S(=O)(=O)NC[C@H](CC(=O)[O-])c1ccccc1	ZINC000003623216	506347677	/nfs/dbraw/zinc/34/76/77/506347677.db2.gz	OVFBGQVMIPVPID-HNNXBMFYSA-N	-1	0	363.435	2.540	50	0		FFAARM
CCN1C(=O)S/C(=C\c2ccc(O[C@@H](C)C(=O)[O-])c(OC)c2)C1=O	ZINC000003672814	506349785	/nfs/dbraw/zinc/34/97/85/506349785.db2.gz	MSHCZQFUCBHKIN-LMRAXHDRSA-N	-1	0	351.380	2.603	50	0		FFAARM
O=C([O-])/C=C\C(=O)Nc1ccccc1N1CCN(c2ccccc2)CC1	ZINC000033330720	506356694	/nfs/dbraw/zinc/35/66/94/506356694.db2.gz	MBACQRCTXOZQEI-KHPPLWFESA-N	-1	0	351.406	2.593	50	0		FFAARM
O=C([O-])CN(CC(=O)NCc1cccc(C(F)(F)F)c1)c1ccccc1	ZINC000034926524	506373970	/nfs/dbraw/zinc/37/39/70/506373970.db2.gz	JYSLYBCVUJAZAR-UHFFFAOYSA-N	-1	0	366.339	2.913	50	0		FFAARM
O=C([N-]C(=O)c1c(F)cccc1Cl)C(=O)Nc1ccc(F)cc1F	ZINC000004382833	506374921	/nfs/dbraw/zinc/37/49/21/506374921.db2.gz	FDWXUOQPEVUENV-UHFFFAOYSA-N	-1	0	356.687	2.652	50	0		FFAARM
O=C(Nc1ccccn1)c1cccc(S(=O)(=O)[N-]c2ccccn2)c1	ZINC000004439772	506376467	/nfs/dbraw/zinc/37/64/67/506376467.db2.gz	IUUQMZZBKVOSBY-UHFFFAOYSA-N	-1	0	354.391	2.530	50	0		FFAARM
COc1ccc(Cn2[nH][n-]c3c(=O)n(-c4ccccc4Cl)c(=O)c2=3)cc1	ZINC000004483722	506378243	/nfs/dbraw/zinc/37/82/43/506378243.db2.gz	SKYKQGPQVIMSDX-CVEARBPZSA-N	-1	0	370.796	2.842	50	0		FFAARM
CCCC[C@H](NC(=O)[C@H](CCC)NC(=O)OCc1ccccc1)C(=O)[O-]	ZINC000004760576	506393312	/nfs/dbraw/zinc/39/33/12/506393312.db2.gz	XPRXIIXCLWGYHA-HOTGVXAUSA-N	-1	0	364.442	2.841	50	0		FFAARM
CC[C@H](C)[C@@H](NC(=O)N1CCC(c2nc3ccccc3[nH]2)CC1)C(=O)[O-]	ZINC000036579912	506406350	/nfs/dbraw/zinc/40/63/50/506406350.db2.gz	XSBUSYJZIAGEDP-BLLLJJGKSA-N	-1	0	358.442	2.951	50	0		FFAARM
CCc1ccc(NC(=O)[C@@H](Cc2ccc(OC)cc2)c2nnn[n-]2)cc1	ZINC000005444919	506443288	/nfs/dbraw/zinc/44/32/88/506443288.db2.gz	RZDDTKUGCPKJLX-KRWDZBQOSA-N	-1	0	351.410	2.736	50	0		FFAARM
COc1cccc2ccn(CCC(=O)N[C@@H](C(=O)[O-])c3ccccc3)c21	ZINC000040308923	506481727	/nfs/dbraw/zinc/48/17/27/506481727.db2.gz	URRIQHWWGFUPHG-GOSISDBHSA-N	-1	0	352.390	2.982	50	0	biogenic	FFAARM
COC(=O)N1CCCc2cc(NC(=O)[C@H]3CC=CC[C@H]3C(=O)[O-])ccc21	ZINC000006668250	506495309	/nfs/dbraw/zinc/49/53/09/506495309.db2.gz	KPFUFQIEFZZIBO-LSDHHAIUSA-N	-1	0	358.394	2.811	50	0		FFAARM
O=C([O-])CCCn1cc(NC(=O)c2ccccc2Br)cn1	ZINC000006728664	506500292	/nfs/dbraw/zinc/50/02/92/506500292.db2.gz	UJNPAYIAQNWBHS-UHFFFAOYSA-N	-1	0	352.188	2.763	50	0		FFAARM
Cc1ccc(CN2CCN(C(=O)[C@H]3C4CCC(CC4)[C@H]3C(=O)[O-])CC2)cc1	ZINC000006741077	506501975	/nfs/dbraw/zinc/50/19/75/506501975.db2.gz	KVZDBJRDXYZGOE-GHBBCFCZSA-N	-1	0	370.493	2.776	50	0		FFAARM
COc1ccc2c(C)c(CCC(=O)N3CCCC[C@@H]3C(=O)[O-])c(=O)oc2c1	ZINC000006921939	506517347	/nfs/dbraw/zinc/51/73/47/506517347.db2.gz	TYUFSXIBMQOPIZ-MRXNPFEDSA-N	-1	0	373.405	2.508	50	0		FFAARM
COc1ccc(CC(=O)[O-])cc1S(=O)(=O)Nc1cc(Cl)ccc1F	ZINC000054294917	506533314	/nfs/dbraw/zinc/53/33/14/506533314.db2.gz	IDVIWIFPPSFTGF-UHFFFAOYSA-N	-1	0	373.789	2.916	50	0		FFAARM
CCOc1ccc([N-]S(=O)(=O)c2ccc(C(=O)N(C)C)s2)cc1	ZINC000008608526	506660777	/nfs/dbraw/zinc/66/07/77/506660777.db2.gz	GQTVZEZUTDVHOM-UHFFFAOYSA-N	-1	0	354.453	2.649	50	0		FFAARM
CCCOc1cc(Cl)c(CN[C@@H](C)c2n[nH]c(=O)[n-]2)cc1OCC	ZINC000055054737	506667082	/nfs/dbraw/zinc/66/70/82/506667082.db2.gz	ZUBAEDXGIZDNJO-JTQLQIEISA-N	-1	0	354.838	2.790	50	0		FFAARM
O=c1cc(CSc2nnnn2-c2ccccc2)[n-]n1-c1ccc(F)cc1	ZINC000009052511	506679567	/nfs/dbraw/zinc/67/95/67/506679567.db2.gz	GYMDXPLIRIWKAR-UHFFFAOYSA-N	-1	0	368.397	2.573	50	0		FFAARM
CCc1cc(=O)[nH]c(-c2cccc(NC(=O)[C@H]3CC=CC[C@@H]3C(=O)[O-])c2)n1	ZINC000055149704	506686833	/nfs/dbraw/zinc/68/68/33/506686833.db2.gz	CTUCCGRJKBUESQ-HOTGVXAUSA-N	-1	0	367.405	2.605	50	0		FFAARM
CCOc1ccccc1NC(=O)[C@@H](Cc1ccccc1OC)c1nnn[n-]1	ZINC000009434462	506696914	/nfs/dbraw/zinc/69/69/14/506696914.db2.gz	OQHBWCSZIAZJEK-AWEZNQCLSA-N	-1	0	367.409	2.572	50	0		FFAARM
Cc1nn(-c2ccccc2)c2[nH]c3nc(=O)[n-]c(=O)c-3c(-c3ccccc3)c12	ZINC000009547796	506702597	/nfs/dbraw/zinc/70/25/97/506702597.db2.gz	SBXFFKVHQMNBNK-UHFFFAOYSA-N	-1	0	369.384	2.926	50	0		FFAARM
COc1ccccc1S(=O)(=O)[N-]c1cccc(OCCn2cccn2)c1	ZINC000055631044	506807336	/nfs/dbraw/zinc/80/73/36/506807336.db2.gz	OQTCYVVZDOMUAR-UHFFFAOYSA-N	-1	0	373.434	2.772	50	0		FFAARM
O=C([O-])CCC(=O)N1N=C(c2ccco2)C[C@H]1c1ccc2nccnc2c1	ZINC000012420829	506862223	/nfs/dbraw/zinc/86/22/23/506862223.db2.gz	MLXUNUBGKQTERH-INIZCTEOSA-N	-1	0	364.361	2.765	50	0		FFAARM
CS(=O)(=O)[N-]c1ccccc1C(=O)OCCOc1cccc(Cl)c1	ZINC000023043217	507326372	/nfs/dbraw/zinc/32/63/72/507326372.db2.gz	IEAMCLKWLIWYTA-UHFFFAOYSA-N	-1	0	369.826	2.947	50	0		FFAARM
Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)[C@H]1CC=CC[C@@H]1C(=O)[O-]	ZINC000051185999	507748764	/nfs/dbraw/zinc/74/87/64/507748764.db2.gz	CHMPNBBRLRVAKS-HOTGVXAUSA-N	-1	0	358.438	2.986	50	0		FFAARM
C[C@@H](Cn1cccn1)C(=O)N1CCC(Cc2cccc(C(=O)[O-])c2)CC1	ZINC000072149438	507760569	/nfs/dbraw/zinc/76/05/69/507760569.db2.gz	OYTYPUGRIYVYID-HNNXBMFYSA-N	-1	0	355.438	2.699	50	0		FFAARM
Cc1ccc(-c2cc(CN3CCn4nc(CCC(=O)[O-])cc4C3)on2)cc1	ZINC000072158633	507763900	/nfs/dbraw/zinc/76/39/00/507763900.db2.gz	RMLJGFLMTQLMQB-UHFFFAOYSA-N	-1	0	366.421	2.880	50	0		FFAARM
COc1ccc(O[C@H]2C[C@@H](C(=O)[O-])N(C(=O)OC(C)(C)C)C2)cc1OC	ZINC000072233826	507770787	/nfs/dbraw/zinc/77/07/87/507770787.db2.gz	OFUMMYODBHGCBE-STQMWFEESA-N	-1	0	367.398	2.545	50	0		FFAARM
CC1(C)OC(=O)C2=C1NC(=O)C[C@H]2c1ccc(-c2ccc(C(=O)[O-])cc2)o1	ZINC000072325994	507775837	/nfs/dbraw/zinc/77/58/37/507775837.db2.gz	SPZFZOGMPKCMEZ-LBPRGKRZSA-N	-1	0	367.357	2.838	50	0	biogenic	FFAARM
O=C([O-])c1ccnc(-c2ccnc(NC[C@@H]3OCCc4ccccc43)n2)c1	ZINC000072418635	507786440	/nfs/dbraw/zinc/78/64/40/507786440.db2.gz	UGDMXCGCZNKZLZ-SFHVURJKSA-N	-1	0	362.389	2.963	50	0		FFAARM
Cc1ccn2c(c1)n[n-]/c2=N\C(=O)c1nn(-c2ccccc2C)c2c1CCC2	ZINC000079071541	507930721	/nfs/dbraw/zinc/93/07/21/507930721.db2.gz	KNIWSUDMYVFOIE-UHFFFAOYSA-N	-1	0	372.432	3.273	50	0		FFAARM
COCc1ccc(C(=O)N2C[C@@H](c3ccc(F)cc3)[C@H](C(=O)[O-])C2)s1	ZINC000091876825	508021051	/nfs/dbraw/zinc/02/10/51/508021051.db2.gz	INYVERAJESYTGF-LSDHHAIUSA-N	-1	0	363.410	2.974	50	0		FFAARM
O=C([O-])[C@@H]1Cc2c([nH]c3ccccc32)CN1C(=O)c1cn2ccsc2n1	ZINC000095353410	508174178	/nfs/dbraw/zinc/17/41/78/508174178.db2.gz	LWZBJKFWOVLCAH-HNNXBMFYSA-N	-1	0	366.402	2.529	50	0		FFAARM
Cc1noc(C)c1[C@H](C(=O)[O-])N1CCN(C/C=C/c2ccccc2)CC1	ZINC000095358644	508175433	/nfs/dbraw/zinc/17/54/33/508175433.db2.gz	XIXVVQMQJJIMQN-MBNRZODZSA-N	-1	0	355.438	2.748	50	0		FFAARM
CSc1ccccc1[C@H](C(=O)[O-])N1CCN(Cc2ccccn2)CC1	ZINC000095360128	508176036	/nfs/dbraw/zinc/17/60/36/508176036.db2.gz	ONLWQBKYCJLFDQ-GOSISDBHSA-N	-1	0	357.479	2.747	50	0		FFAARM
Cc1cccc(C)c1OC1CN(C(=O)c2cc(=O)n(-c3ccccc3)[n-]2)C1	ZINC000095366624	508177825	/nfs/dbraw/zinc/17/78/25/508177825.db2.gz	GYBXSLMGERDXFD-UHFFFAOYSA-N	-1	0	363.417	2.686	50	0		FFAARM
CC1=C(C(=O)N2CCC[C@H](c3ccc(C(=O)[O-])cc3)C2)SC2=NCCN12	ZINC000095380761	508181174	/nfs/dbraw/zinc/18/11/74/508181174.db2.gz	ZTSYHDBCPOIPEB-HNNXBMFYSA-N	-1	0	371.462	2.741	50	0		FFAARM
CC[C@@](NC(=O)Cn1ccc(=O)c2ccccc21)(C(=O)[O-])c1ccccc1	ZINC000095424613	508185047	/nfs/dbraw/zinc/18/50/47/508185047.db2.gz	VFHYWZIUMFUSMG-NRFANRHFSA-N	-1	0	364.401	2.508	50	0		FFAARM
CCOC(=O)c1oc([N-]S(=O)(=O)c2cccc(Cl)c2C)nc1C	ZINC000095455174	508186386	/nfs/dbraw/zinc/18/63/86/508186386.db2.gz	MYBKMJSNUFNUDT-UHFFFAOYSA-N	-1	0	358.803	2.922	50	0		FFAARM
Cn1cc([C@H]2SCC(=O)Nc3c2cnn3-c2ccc(C(=O)[O-])cc2)cn1	ZINC000095472487	508188532	/nfs/dbraw/zinc/18/85/32/508188532.db2.gz	ORRLOZCDRVJJSX-OAHLLOKOSA-N	-1	0	369.406	2.728	50	0		FFAARM
O=C([O-])COc1cccc(NC(=O)c2ccccc2OC[C@@H]2CCCO2)c1	ZINC000095956941	508199457	/nfs/dbraw/zinc/19/94/57/508199457.db2.gz	MDKBLUUSWVSUEZ-INIZCTEOSA-N	-1	0	371.389	2.960	50	0		FFAARM
COc1ccc(C(=O)N2CCS[C@H]3CCCC[C@H]32)cc1OCC(=O)[O-]	ZINC000095989969	508200895	/nfs/dbraw/zinc/20/08/95/508200895.db2.gz	SPPXFQRKUYDBCN-CJNGLKHVSA-N	-1	0	365.451	2.659	50	0		FFAARM
CC[C@H](C)C(=O)N1CCc2nc3cc(-c4ccccc4)[n-]n3c(=O)c2C1	ZINC000097161242	508220690	/nfs/dbraw/zinc/22/06/90/508220690.db2.gz	HNYLDHBIVJWPFV-ZDUSSCGKSA-N	-1	0	350.422	2.620	50	0		FFAARM
Cc1cccc(C(=O)N(Cc2nn3c([n-]2)nc(C)cc3=O)c2ccccc2)c1	ZINC000101582275	508248756	/nfs/dbraw/zinc/24/87/56/508248756.db2.gz	OZRIOMYXTIDQQU-UHFFFAOYSA-N	-1	0	373.416	2.881	50	0		FFAARM
CN(C[C@@H]1CCCO1)C(=O)c1nn(-c2ccccc2C(F)(F)F)cc1[O-]	ZINC000102897511	508288855	/nfs/dbraw/zinc/28/88/55/508288855.db2.gz	LIGPURHXFOOPQR-NSHDSACASA-N	-1	0	369.343	2.848	50	0		FFAARM
CN(Cc1cccc(-n2cccn2)c1)C(=O)c1cc(=O)n(-c2ccccc2)[n-]1	ZINC000077469835	508319959	/nfs/dbraw/zinc/31/99/59/508319959.db2.gz	WJKXQGMJKICSSZ-UHFFFAOYSA-N	-1	0	373.416	2.624	50	0		FFAARM
O=C(c1cc(=O)n(-c2ccccc2)[n-]1)N1CCCC[C@H]1c1nccs1	ZINC000216442328	509261453	/nfs/dbraw/zinc/26/14/53/509261453.db2.gz	SHDYAFKDECODJG-HNNXBMFYSA-N	-1	0	354.435	2.990	50	0		FFAARM
COc1ccc(S(=O)(=O)[N-]c2nnc3ccccn32)c(Cl)c1Cl	ZINC000225427103	509372942	/nfs/dbraw/zinc/37/29/42/509372942.db2.gz	OKGXLPFYSWNVMR-UHFFFAOYSA-N	-1	0	373.221	2.846	50	0		FFAARM
Cc1nc([N-]S(=O)(=O)c2cc(Cl)ccc2Br)no1	ZINC000225531125	509376216	/nfs/dbraw/zinc/37/62/16/509376216.db2.gz	QZHGFASDYXDIAC-UHFFFAOYSA-N	-1	0	352.597	2.595	50	0		FFAARM
CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)NCc1cccc(C(=O)[O-])c1	ZINC000236583966	509461018	/nfs/dbraw/zinc/46/10/18/509461018.db2.gz	ZUDNFGWYRLOZAT-IBGZPJMESA-N	-1	0	366.417	2.537	50	0		FFAARM
CC(C)C[C@@H](NC(=O)c1ccc(CN2C[C@H](C)O[C@@H](C)C2)cc1)C(=O)[O-]	ZINC000236602852	509462280	/nfs/dbraw/zinc/46/22/80/509462280.db2.gz	NKEILEYWIPSLQD-RLFYNMQTSA-N	-1	0	362.470	2.525	50	0		FFAARM
CCc1ccc(-c2nc(C)c(C(=O)N3CCO[C@@H](C(=O)[O-])C3)s2)cc1	ZINC000236992798	509548180	/nfs/dbraw/zinc/54/81/80/509548180.db2.gz	TXAYKJULHHYHLM-CQSZACIVSA-N	-1	0	360.435	2.607	50	0		FFAARM
Cc1cc(N2CCC(N(C)C(=O)c3cccc(C(=O)[O-])c3)CC2)nc(C)n1	ZINC000237290298	509613836	/nfs/dbraw/zinc/61/38/36/509613836.db2.gz	HSLSSHWTPKIGOP-UHFFFAOYSA-N	-1	0	368.437	2.533	50	0		FFAARM
C[C@@H](CC(=O)N1CCO[C@H](CC(=O)[O-])C1)c1ccccc1C(F)(F)F	ZINC000237335691	509624957	/nfs/dbraw/zinc/62/49/57/509624957.db2.gz	YTXHGXRYPXMVLD-NWDGAFQWSA-N	-1	0	359.344	2.901	50	0		FFAARM
C[C@@H](Oc1ccc(F)cc1Br)C(=O)N1CCC[C@H](C(=O)[O-])C1	ZINC000237485742	509658880	/nfs/dbraw/zinc/65/88/80/509658880.db2.gz	BHYUUTHVFAXUDA-ZJUUUORDSA-N	-1	0	374.206	2.679	50	0		FFAARM
O=C([O-])[C@@H](CNC(=O)CNc1ccccc1Cl)Oc1ccc(F)cc1	ZINC000170592158	509673543	/nfs/dbraw/zinc/67/35/43/509673543.db2.gz	FJZGNTYRIMPKCN-OAHLLOKOSA-N	-1	0	366.776	2.539	50	0		FFAARM
Cc1csc(-c2cccc(C(=O)N(CC(=O)[O-])C3CCOCC3)c2)n1	ZINC000237668384	509706807	/nfs/dbraw/zinc/70/68/07/509706807.db2.gz	FOBQEMFXCQYGRI-UHFFFAOYSA-N	-1	0	360.435	2.824	50	0		FFAARM
Cc1cc(C(=O)N[C@@](C)(COc2ccccc2)C(=O)[O-])nn1C(C)(C)C	ZINC000170671715	509711412	/nfs/dbraw/zinc/71/14/12/509711412.db2.gz	LFUHGTDQDZJZJM-IBGZPJMESA-N	-1	0	359.426	2.599	50	0		FFAARM
Cc1ccc2cc(C(=O)N(CCC(=O)[O-])C[C@@H]3CCCO3)c(C)nc2c1	ZINC000237887223	509762886	/nfs/dbraw/zinc/76/28/86/509762886.db2.gz	UFERAIMKVVJIHF-INIZCTEOSA-N	-1	0	356.422	2.948	50	0		FFAARM
O=C([O-])CCN(C(=O)c1ccc(-n2cccc2)c(F)c1)C1CCOCC1	ZINC000238078754	509816564	/nfs/dbraw/zinc/81/65/64/509816564.db2.gz	DTRXWIIUHNICDU-UHFFFAOYSA-N	-1	0	360.385	2.712	50	0		FFAARM
CC(C)(C)c1cccc([N-]S(=O)(=O)c2ccc3c(c2)C(=O)NCC3)c1O	ZINC000187083372	510045838	/nfs/dbraw/zinc/04/58/38/510045838.db2.gz	LXYOANQCWHVIMQ-UHFFFAOYSA-N	-1	0	374.462	2.776	50	0		FFAARM
CC(C)C[C@H](NC(=O)c1ccc(CN2C[C@H](C)O[C@@H](C)C2)cc1)C(=O)[O-]	ZINC000185317169	510803294	/nfs/dbraw/zinc/80/32/94/510803294.db2.gz	NKEILEYWIPSLQD-MPGHIAIKSA-N	-1	0	362.470	2.525	50	0		FFAARM
Cc1oc(CNC(=O)C2(c3cccc(F)c3)CCOCC2)cc1C(=O)[O-]	ZINC000299753331	511668252	/nfs/dbraw/zinc/66/82/52/511668252.db2.gz	XVKWCFRUBCMWBL-UHFFFAOYSA-N	-1	0	361.369	2.790	50	0		FFAARM
O=C([O-])c1ccc(CCNC(=O)[C@@H]2C[C@@H]2c2ccc3c(c2)OCCO3)cc1	ZINC000299748762	511668285	/nfs/dbraw/zinc/66/82/85/511668285.db2.gz	ICEBUTZXBQDAQE-IAGOWNOFSA-N	-1	0	367.401	2.618	50	0		FFAARM
Cc1cc(Cl)ccc1O[C@H](C)C(=O)N(CCC(=O)[O-])C1CCOCC1	ZINC000299753620	511668462	/nfs/dbraw/zinc/66/84/62/511668462.db2.gz	YUVUTPHLRKSOBD-CYBMUJFWSA-N	-1	0	369.845	2.898	50	0		FFAARM
COc1ccccc1OCc1ccc(C(=O)N2CC[C@@](C)(C(=O)[O-])C2)o1	ZINC000408513499	513083727	/nfs/dbraw/zinc/08/37/27/513083727.db2.gz	HATLOCVMNPPCGD-LJQANCHMSA-N	-1	0	359.378	2.804	50	0		FFAARM
Cc1nc(-c2ccc(C(=O)N3[C@@H]4CCCC[C@H]4C[C@H]3C(=O)[O-])cc2)n[nH]1	ZINC000408513824	513084709	/nfs/dbraw/zinc/08/47/09/513084709.db2.gz	SWSNDZJHLOZNPE-XHSDSOJGSA-N	-1	0	354.410	2.638	50	0		FFAARM
Cc1cccc([C@H](NC(=O)N(Cc2cnn(C)c2)CC(C)C)C(=O)[O-])c1	ZINC000426444456	513942362	/nfs/dbraw/zinc/94/23/62/513942362.db2.gz	FLGQCESRESZLRZ-KRWDZBQOSA-N	-1	0	358.442	2.722	50	0		FFAARM
O=C([O-])[C@@]12CN(C(=O)c3ccc(CO)o3)C[C@@H]1C[C@@H](c1ccccc1)CC2	ZINC000426737528	514028622	/nfs/dbraw/zinc/02/86/22/514028622.db2.gz	PKKLUYSHYYBMEG-QYWGDWMGSA-N	-1	0	369.417	2.883	50	0		FFAARM
CC(=O)N[C@@H](CC(=O)N1CCC[C@H](CCC(=O)[O-])C1)c1ccc(C)cc1	ZINC000236687367	519682769	/nfs/dbraw/zinc/68/27/69/519682769.db2.gz	KYGPMXZNLGZWOR-AEFFLSMTSA-N	-1	0	360.454	2.666	50	0		FFAARM
CCC[C@@H](C)c1cc([N-]S(=O)(=O)c2ccc(O)c(C(=O)OC)c2)n[nH]1	ZINC000079106629	520675541	/nfs/dbraw/zinc/67/55/41/520675541.db2.gz	YYCXEQAFGXLOSI-SNVBAGLBSA-N	-1	0	367.427	2.606	50	0		FFAARM
O=C([O-])CCN(C[C@H]1CCCO1)C(=O)/C=C\c1cccc2cccnc12	ZINC000606441557	521068322	/nfs/dbraw/zinc/06/83/22/521068322.db2.gz	LLNTUQXXGFKTJB-XZVRFQMRSA-N	-1	0	354.406	2.730	50	0		FFAARM
O=C([O-])CCN(C[C@@H]1CCCO1)C(=O)/C=C\c1cccc2cccnc12	ZINC000606441555	521069241	/nfs/dbraw/zinc/06/92/41/521069241.db2.gz	LLNTUQXXGFKTJB-JJEJIETFSA-N	-1	0	354.406	2.730	50	0		FFAARM
COc1cc2c(cc1OC)[C@H](CC(=O)[O-])N(C(=O)CCc1ccco1)CC2	ZINC000277593324	523045960	/nfs/dbraw/zinc/04/59/60/523045960.db2.gz	GXTBWUBBVJLHMO-INIZCTEOSA-N	-1	0	373.405	2.830	50	0		FFAARM
COc1ccccc1[C@@H]1CN(C(=O)c2cccn2C2CC2)C[C@H]1C(=O)[O-]	ZINC000091626100	524761971	/nfs/dbraw/zinc/76/19/71/524761971.db2.gz	UTYSAPMKQKRMFL-JKSUJKDBSA-N	-1	0	354.406	2.772	50	0		FFAARM
COc1ccc(OC)c2c1cc(C(=O)NC[C@H]1CC[C@H](C(=O)[O-])CC1)n2C	ZINC000238923853	524922639	/nfs/dbraw/zinc/92/26/39/524922639.db2.gz	PODWZCWMESZPGN-JOCQHMNTSA-N	-1	0	374.437	2.816	50	0		FFAARM
Cc1oc(CN(C)C(=O)CC[C@@H]2Cc3ccccc3NC2=O)cc1C(=O)[O-]	ZINC000268924647	526767124	/nfs/dbraw/zinc/76/71/24/526767124.db2.gz	DBCCXNPBGACLCF-CQSZACIVSA-N	-1	0	370.405	2.836	50	0		FFAARM
O=C([O-])C[C@H]1CN(C(=O)c2ccccc2OCc2ccc(F)cc2)CCO1	ZINC000269034186	527636043	/nfs/dbraw/zinc/63/60/43/527636043.db2.gz	NRTNRTNJNLCWRF-INIZCTEOSA-N	-1	0	373.380	2.720	50	0		FFAARM
CCC(NCc1ccco1)=C1C(=O)[N-]C(=O)N(c2ccccc2C)C1=O	ZINC000101086415	535226669	/nfs/dbraw/zinc/22/66/69/535226669.db2.gz	CLMAVEJNEMMXBW-JQIJEIRASA-N	-1	0	353.378	2.625	50	0		FFAARM
COc1ccc(S(=O)(=O)N2CCCc3ccc(F)cc32)cc1C(=O)[O-]	ZINC000055601086	536869304	/nfs/dbraw/zinc/86/93/04/536869304.db2.gz	AUJBLASIRWKZJQ-UHFFFAOYSA-N	-1	0	365.382	2.674	50	0		FFAARM
O=C([O-])C1(NC(=O)CCc2nc(-c3ccc(F)cc3)no2)CCCCC1	ZINC000084421747	571085348	/nfs/dbraw/zinc/08/53/48/571085348.db2.gz	DPXCKVMAWUYCBP-UHFFFAOYSA-N	-1	0	361.373	2.712	50	0		FFAARM
O=C([O-])[C@H]1CC[C@H](NS(=O)(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000575442730	571151978	/nfs/dbraw/zinc/15/19/78/571151978.db2.gz	OQAGRMJUDXFAPZ-HOMQSWHASA-N	-1	0	351.346	2.627	50	0		FFAARM
Cc1ccc(-n2ncc3c2CCC[C@H]3NC(=O)c2cc(=O)[nH][n-]2)cc1C	ZINC000091986947	571197729	/nfs/dbraw/zinc/19/77/29/571197729.db2.gz	OMUNRJUMSYQOAQ-OAHLLOKOSA-N	-1	0	351.410	2.725	50	0		FFAARM
C[C@H](C(=O)[O-])[C@H](NC(=O)CN1C(=O)CCc2ccccc21)c1ccccc1	ZINC000262539604	601172164	/nfs/dbraw/zinc/17/21/64/601172164.db2.gz	RAEMYMUTEXOFLF-XOBRGWDASA-N	-1	0	366.417	2.544	50	0		FFAARM
O=C([O-])C1(C(=O)N[C@H]2CSCc3ccc(Br)cc32)CC1	ZINC000585094071	729982362	/nfs/dbraw/zinc/98/23/62/729982362.db2.gz	NDCBIWIMBOXTND-NSHDSACASA-N	-1	0	356.241	2.718	50	0		FFAARM
Cc1ccc(-n2[n-]c(C(=O)N[C@@H](CC(F)(F)F)C3CC3)cc2=O)cc1	ZINC000888092663	734011118	/nfs/dbraw/zinc/01/11/18/734011118.db2.gz	OQKBTGXONUAPQM-AWEZNQCLSA-N	-1	0	353.344	2.935	50	0		FFAARM
COc1ccc(S(=O)(=O)[N-]C(=O)/C=C(\C)c2ccncc2)c(C)c1C	ZINC000584907902	845947516	/nfs/dbraw/zinc/94/75/16/845947516.db2.gz	GAWZINJOOYZTRA-VAWYXSNFSA-N	-1	0	360.435	2.615	50	0		FFAARM
Cc1ccc(-n2[n-]c(C(=O)N[C@@H]3CCC[C@H](OC(F)F)C3)cc2=O)cc1	ZINC000888092752	976545921	/nfs/dbraw/zinc/54/59/21/976545921.db2.gz	ZIKCQLJSMSFYDV-OCCSQVGLSA-N	-1	0	365.380	2.754	50	0		FFAARM
Cc1cc(C)nc([N-]S(=O)(=O)c2ccc(NC(=O)[C@H](C)C3CC3)cc2)n1	ZINC000888093342	976555489	/nfs/dbraw/zinc/55/54/89/976555489.db2.gz	BWHURBXHOGJOGN-CYBMUJFWSA-N	-1	0	374.466	2.879	50	0		FFAARM
Cc1ccc(N2CCC(Oc3ccc4c(c3)OCO4)(C(=O)[O-])CC2)nc1	ZINC000072436215	1019897228	/nfs/dbraw/zinc/89/72/28/1019897228.db2.gz	UUXYJXQRAMYRST-UHFFFAOYSA-N	-1	0	356.378	2.621	50	0		FFAARM
COc1ccc(-c2ccccc2)cc1N1C(=O)[C@@H]2C[C@H]1CN2CCC(=O)[O-]	ZINC000077355232	1020665448	/nfs/dbraw/zinc/66/54/48/1020665448.db2.gz	BFVYAKUSAOYXIA-WMZOPIPTSA-N	-1	0	366.417	2.626	50	0		FFAARM
C[C@@H](NC(=O)Nc1ccc(-c2ncon2)cc1)[C@@H]1C[C@H](C(=O)[O-])C1(C)C	ZINC000653537774	1024936673	/nfs/dbraw/zinc/93/66/73/1024936673.db2.gz	FYFIUYWWDPHJIK-DDTOSNHZSA-N	-1	0	358.398	2.994	50	0		FFAARM
O=C([O-])[C@H]1CCCCN1C(=O)Cc1csc(Cc2ccc(F)cc2)n1	ZINC000128606492	210066776	/nfs/dbraw/zinc/06/67/76/210066776.db2.gz	IWPULIKPRJFPQN-OAHLLOKOSA-N	-1	0	362.426	2.881	50	0		FFAARM
O=C([O-])Cn1ccc(NC(=O)[C@@H]2C[C@@H]2c2ccccc2OC(F)(F)F)n1	ZINC000122720877	210060545	/nfs/dbraw/zinc/06/05/45/210060545.db2.gz	KWMVQTQGRNTUOG-GHMZBOCLSA-N	-1	0	369.299	2.609	50	0		FFAARM
COCC(=O)Nc1cc2ncn(Cc3ccc(F)cc3)c2c(C(=O)[O-])c1	ZINC000299793726	210033790	/nfs/dbraw/zinc/03/37/90/210033790.db2.gz	HWQGTGGUZYYSLZ-UHFFFAOYSA-N	-1	0	357.341	2.507	50	0		FFAARM
Cc1ncc(C(=O)[N-]S(=O)(=O)c2cc3c(c(Cl)c2)O[C@@H](C)C3)s1	ZINC000225393595	222836555	/nfs/dbraw/zinc/83/65/55/222836555.db2.gz	YQOAMOVMTJQYCW-ZETCQYMHSA-N	-1	0	372.855	2.547	50	0		FFAARM
O=C([O-])[C@@]12CCC(=O)N1c1ccccc1-c1nc(-c3cccc(F)c3)nn12	ZINC000225401724	222838116	/nfs/dbraw/zinc/83/81/16/222838116.db2.gz	TWPVTAJDSCAFHV-IBGZPJMESA-N	-1	0	364.336	2.629	50	0		FFAARM
CC(C)[S@@](=O)c1ccc(C(=O)N2Cc3ccccc3C[C@H]2C(=O)[O-])cc1	ZINC000236700366	222903836	/nfs/dbraw/zinc/90/38/36/222903836.db2.gz	YNYMCDXUNWAQFN-HFJWLAOPSA-N	-1	0	371.458	2.854	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)c1cc(N2CCCC2=O)ccc1F)c1ccccc1	ZINC000238170271	222914605	/nfs/dbraw/zinc/91/46/05/222914605.db2.gz	WPWPFBXXHKMJFL-QGZVFWFLSA-N	-1	0	370.380	2.898	50	0		FFAARM
COc1c(Br)c(C)sc1C(=O)N1CC[C@](C)(C(=O)[O-])C1	ZINC000237277476	222907091	/nfs/dbraw/zinc/90/70/91/222907091.db2.gz	YZSFIPOQLJBLIY-ZDUSSCGKSA-N	-1	0	362.245	2.764	50	0		FFAARM
Cc1ccc(NS(=O)(=O)c2ccc(N3CCCC3=O)cc2)c(C(=O)[O-])c1	ZINC000058369003	212006167	/nfs/dbraw/zinc/00/61/67/212006167.db2.gz	LFMQFTPBMOZGQE-UHFFFAOYSA-N	-1	0	374.418	2.621	50	0		FFAARM
O=C([O-])CN(CCc1ccc(Cl)cc1Cl)C(=O)C[C@H]1CCOC1	ZINC000299751676	211833477	/nfs/dbraw/zinc/83/34/77/211833477.db2.gz	RGNRQOFYGHKXQZ-LLVKDONJSA-N	-1	0	360.237	2.876	50	0		FFAARM
CCS(=O)(=O)c1ccc([N-]S(=O)(=O)c2cc(F)ccc2F)cc1	ZINC000014097564	220106331	/nfs/dbraw/zinc/10/63/31/220106331.db2.gz	IRGOIZVDVHWTDJ-UHFFFAOYSA-N	-1	0	361.391	2.559	50	0		FFAARM
C[C@@H]1C[C@@H]1C(=O)N[C@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)[O-]	ZINC000299747992	211825962	/nfs/dbraw/zinc/82/59/62/211825962.db2.gz	FSLHKMSHTJQJMU-FDLBOYPASA-N	-1	0	365.227	2.698	50	0		FFAARM
CC(C)c1ccc([C@@H]2CC(c3c([O-])n(C)c(=S)n(C)c3=O)=NN2)cc1	ZINC000015834678	220166655	/nfs/dbraw/zinc/16/66/55/220166655.db2.gz	LNCGEALFZWDGPJ-ZDUSSCGKSA-N	-1	0	358.467	2.721	50	0		FFAARM
O=C1[N-]C(=O)N(Cc2ccccc2)C(=O)C1=C1C[C@H](c2cccs2)NN1	ZINC000017028173	211175050	/nfs/dbraw/zinc/17/50/50/211175050.db2.gz	WEARVMAIYSDXDH-GMXMXKFQSA-N	-1	0	368.418	2.660	50	0		FFAARM
Cc1c2cc(F)ccc2oc1C(=O)[N-]N1C(=O)N[C@@](C)(c2ccco2)C1=O	ZINC000014094478	211073744	/nfs/dbraw/zinc/07/37/44/211073744.db2.gz	HDPFBBURIXNHEV-SFHVURJKSA-N	-1	0	371.324	2.585	50	0		FFAARM
COc1ccc([C@@H](CC(=O)[O-])NC(=O)c2ccc(OC)cc2OC)cc1	ZINC000013187456	211028492	/nfs/dbraw/zinc/02/84/92/211028492.db2.gz	XMEBSLHKBQBLCM-MRXNPFEDSA-N	-1	0	359.378	2.658	50	0		FFAARM
Cc1ccccc1Cn1[nH][n-]c2c(=O)n(-c3ccc(F)c(F)c3)c(=O)c1=2	ZINC000006770593	210699548	/nfs/dbraw/zinc/69/95/48/210699548.db2.gz	WPCAHZSGHCNMNV-CVEARBPZSA-N	-1	0	356.332	2.767	50	0		FFAARM
Cn1cc(Br)cc1C(=O)N1[C@@H]2CCCC[C@H]2C[C@H]1C(=O)[O-]	ZINC000252368053	251309072	/nfs/dbraw/zinc/30/90/72/251309072.db2.gz	IWTBQHFADKVOPH-NDMJEZRESA-N	-1	0	355.232	2.646	50	0		FFAARM
Cc1ccc(CN(CC(=O)[O-])S(=O)(=O)c2ccc(Cl)cc2)cc1	ZINC000004664511	210548974	/nfs/dbraw/zinc/54/89/74/210548974.db2.gz	VIIFDWILKLMFFC-UHFFFAOYSA-N	-1	0	353.827	2.924	50	0		FFAARM
COc1ccc(-c2n[n-]c(Nc3ccc(OC)c(OC)c3)nc2=O)cc1	ZINC000019689578	220285635	/nfs/dbraw/zinc/28/56/35/220285635.db2.gz	GXVOIACURWNWQP-UHFFFAOYSA-N	-1	0	354.366	2.601	50	0		FFAARM
CCC(C)(C)[C@@H]1CCc2c(sc(NC(=O)/C=C/C(=O)[O-])c2C(N)=O)C1	ZINC000002092958	210379424	/nfs/dbraw/zinc/37/94/24/210379424.db2.gz	RMGAEXNAOYRMGV-QROSGCPLSA-N	-1	0	364.467	2.967	50	0		FFAARM
Cn1c2ccc(S(=O)(=O)[N-]c3cnc4ccccc4c3)cc2sc1=O	ZINC000001424660	210351198	/nfs/dbraw/zinc/35/11/98/210351198.db2.gz	CVUFUVNDBOOHII-UHFFFAOYSA-N	-1	0	371.443	2.949	50	0		FFAARM
COc1ccc(OC)c([N-]S(=O)(=O)c2cc(OC)ccc2OC)c1	ZINC000001118248	210319797	/nfs/dbraw/zinc/31/97/97/210319797.db2.gz	GKOZTNKJEAJSQO-UHFFFAOYSA-N	-1	0	353.396	2.522	50	0		FFAARM
COc1ccc(NC(=O)c2ccccc2NC(=O)CCC(=O)[O-])c(OC)c1	ZINC000000991838	210298361	/nfs/dbraw/zinc/29/83/61/210298361.db2.gz	YNEDSNIFSBLGNN-UHFFFAOYSA-N	-1	0	372.377	2.759	50	0		FFAARM
CC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccc(C(F)(F)F)cn2)cc1	ZINC000001034303	210304311	/nfs/dbraw/zinc/30/43/11/210304311.db2.gz	ROQVACBBGKWBBC-UHFFFAOYSA-N	-1	0	359.329	2.860	50	0		FFAARM
COc1ccc([N-]S(=O)(=O)c2ccc(OC)c(OC)c2)c(OC)c1	ZINC000000885125	210286214	/nfs/dbraw/zinc/28/62/14/210286214.db2.gz	DIPREGAPCFFUGL-UHFFFAOYSA-N	-1	0	353.396	2.522	50	0		FFAARM
COc1ccc(-c2csc3ncn([C@H](C)C(=O)[O-])c(=O)c23)cc1OC	ZINC000000958735	210296108	/nfs/dbraw/zinc/29/61/08/210296108.db2.gz	RNZDYHBUDJWLCY-SECBINFHSA-N	-1	0	360.391	2.788	50	0		FFAARM
CCc1ccc(OCC(=O)Nc2cc(S(=O)(=O)CC)ccc2[O-])cc1	ZINC000000952708	210295657	/nfs/dbraw/zinc/29/56/57/210295657.db2.gz	LMNTYFKGKUFFPP-UHFFFAOYSA-N	-1	0	363.435	2.766	50	0		FFAARM
Cc1ccc(C)c([N-]S(=O)(=O)c2cc(Br)cnc2N)c1	ZINC000020761088	220340502	/nfs/dbraw/zinc/34/05/02/220340502.db2.gz	CXXSZFPVZXJVOH-UHFFFAOYSA-N	-1	0	356.245	2.844	50	0		FFAARM
C[C@@H](Cc1ccccc1F)NC(=O)c1cc(F)ccc1[N-]S(C)(=O)=O	ZINC000056146830	221078522	/nfs/dbraw/zinc/07/85/22/221078522.db2.gz	IGXCZJKTYIZGID-NSHDSACASA-N	-1	0	368.405	2.697	50	0		FFAARM
COC(=O)[C@@H]([N-]S(=O)(=O)c1ccc(Cl)cc1F)c1ccccc1	ZINC000058265484	221111433	/nfs/dbraw/zinc/11/14/33/221111433.db2.gz	JMPRCWCCSSCARO-AWEZNQCLSA-N	-1	0	357.790	2.672	50	0		FFAARM
Cc1cc(S(=O)(=O)Nc2ccccc2Cl)ccc1OCC(=O)[O-]	ZINC000058377192	221117087	/nfs/dbraw/zinc/11/70/87/221117087.db2.gz	CDZCGLQSEGYSBN-UHFFFAOYSA-N	-1	0	355.799	2.913	50	0		FFAARM
Cc1ccc(-n2ncc3c2[nH]c(=O)c(C(=O)Nc2ccccc2)c3[O-])cc1	ZINC000065249968	221187604	/nfs/dbraw/zinc/18/76/04/221187604.db2.gz	UNWTYDBWSIVTQP-UHFFFAOYSA-N	-1	0	360.373	2.980	50	0		FFAARM
CC1(C)[C@@H](C(=O)[O-])[C@@H]1C(=O)Nc1ccccc1C(=O)Nc1nccs1	ZINC000071286568	221340519	/nfs/dbraw/zinc/34/05/19/221340519.db2.gz	FXUARFZWLTWCJT-VXGBXAGGSA-N	-1	0	359.407	2.691	50	0		FFAARM
CC1(C)[C@H](C(=O)[O-])[C@@H]1C(=O)Nc1ccccc1C(=O)Nc1nccs1	ZINC000071286572	221340601	/nfs/dbraw/zinc/34/06/01/221340601.db2.gz	FXUARFZWLTWCJT-NEPJUHHUSA-N	-1	0	359.407	2.691	50	0		FFAARM
CC(=O)Nc1c(C)ccc(NC(=O)C[C@]2(C(=O)[O-])CCSC2)c1C	ZINC000071846852	221382617	/nfs/dbraw/zinc/38/26/17/221382617.db2.gz	XGIJPCQHAHZRKW-QGZVFWFLSA-N	-1	0	350.440	2.798	50	0		FFAARM
O=C([O-])c1cc(-c2cccnc2)cc(S(=O)(=O)NCc2ccco2)c1	ZINC000072146681	221424590	/nfs/dbraw/zinc/42/45/90/221424590.db2.gz	CXFRFOYWTXDLCI-UHFFFAOYSA-N	-1	0	358.375	2.518	50	0		FFAARM
O=C([O-])c1cccnc1N1CCC[C@]2(CCC(=O)N(C3CCCC3)C2)C1	ZINC000077470219	132186332	/nfs/dbraw/zinc/18/63/32/132186332.db2.gz	XLWRUKAWZFOVGY-FQEVSTJZSA-N	-1	0	357.454	2.931	50	0		FFAARM
O=C(c1ccc2[n-]c(=S)oc2c1)N1CCN(c2ccc(O)cc2)CC1	ZINC000131831041	132251475	/nfs/dbraw/zinc/25/14/75/132251475.db2.gz	TUXUXCXWMAXWOL-UHFFFAOYSA-N	-1	0	355.419	2.785	50	0		FFAARM
CCOc1ccc(-c2ccnc(NCc3cnn(C)c3C)n2)cc1C(=O)[O-]	ZINC000077320260	221606458	/nfs/dbraw/zinc/60/64/58/221606458.db2.gz	XHRYQLPYHLDKDH-UHFFFAOYSA-N	-1	0	367.409	2.895	50	0		FFAARM
CC(C)c1ccn(C2(C(=O)[O-])CC[NH+](Cc3ccccc3C(=O)[O-])CC2)n1	ZINC000077418987	221623137	/nfs/dbraw/zinc/62/31/37/221623137.db2.gz	FOJQZRBJJKTQTC-UHFFFAOYSA-N	-1	0	371.437	2.781	50	0		FFAARM
CSc1ncccc1C(=O)N1C[C@@H](c2ccc(F)cc2)[C@H](C(=O)[O-])C1	ZINC000091770395	221794869	/nfs/dbraw/zinc/79/48/69/221794869.db2.gz	OVGWXDDIABVIKC-LSDHHAIUSA-N	-1	0	360.410	2.883	50	0		FFAARM
COc1cc(CCC(=O)N[C@@H](C(=O)[O-])c2ccccc2F)cc(OC)c1	ZINC000095989760	221986534	/nfs/dbraw/zinc/98/65/34/221986534.db2.gz	CQHUJXQZACTVAK-GOSISDBHSA-N	-1	0	361.369	2.718	50	0		FFAARM
COC(=O)C[C@H](c1ccc(C(=O)[O-])cc1)c1c2[nH]snc-2ccc1=O	ZINC000096232348	222092944	/nfs/dbraw/zinc/09/29/44/222092944.db2.gz	AMWHDUXFCSAZHT-LLVKDONJSA-N	-1	0	358.375	2.790	50	0		FFAARM
O=C([O-])Cn1nc(C2CCCC2)nc1-c1cccc(Cn2cccn2)c1	ZINC000097370395	222177905	/nfs/dbraw/zinc/17/79/05/222177905.db2.gz	MNHKTAXXAUSHLP-UHFFFAOYSA-N	-1	0	351.410	2.932	50	0		FFAARM
O=C(/C=C\c1ccc2c(c1)OCO2)[N-]S(=O)(=O)c1ccc(Cl)s1	ZINC000098053837	222222152	/nfs/dbraw/zinc/22/21/52/222222152.db2.gz	QZLGPVPUYUZWSF-DJWKRKHSSA-N	-1	0	371.823	2.649	50	0		FFAARM
COc1ccc(-n2c(=O)c3[n-][nH]n(Cc4cc(C)ccc4C)c=3c2=O)cc1	ZINC000101167328	222264974	/nfs/dbraw/zinc/26/49/74/222264974.db2.gz	NCBVPFXHKRDSBD-ZWKOTPCHSA-N	-1	0	364.405	2.805	50	0		FFAARM
O=c1c2[n-][nH]n(Cc3cccc(Cl)c3)c=2c(=O)n1-c1ccc(F)cc1	ZINC000101167057	222265731	/nfs/dbraw/zinc/26/57/31/222265731.db2.gz	MRIWLHKSNCGDJN-HUUCEWRRSA-N	-1	0	358.760	2.973	50	0		FFAARM
COc1cccc(Cn2[nH][n-]c3c(=O)n(-c4ccccc4Cl)c(=O)c2=3)c1	ZINC000101418588	222274122	/nfs/dbraw/zinc/27/41/22/222274122.db2.gz	XASPKVNCZUBUGH-JKSUJKDBSA-N	-1	0	370.796	2.842	50	0		FFAARM
Cc1ccccc1CCNC(=O)c1ccc2c(c1)[n-]c(=S)n(C)c2=O	ZINC000102177984	222290925	/nfs/dbraw/zinc/29/09/25/222290925.db2.gz	MMGXJYCYWGCVRY-UHFFFAOYSA-N	-1	0	353.447	2.503	50	0		FFAARM
O=S(=O)([N-]c1cccc(-n2cnnn2)c1)c1cc(Cl)ccc1Cl	ZINC000005486341	506443715	/nfs/dbraw/zinc/44/37/15/506443715.db2.gz	KEBBNEXYBVFSEU-UHFFFAOYSA-N	-1	0	370.221	2.770	50	0		FFAARM
CC(N[C@@H](C)c1ccccc1)=C1C(=O)[N-]C(=O)N(Cc2ccccc2)C1=O	ZINC000001276434	506256535	/nfs/dbraw/zinc/25/65/35/506256535.db2.gz	CAUIGXDAFLGOLN-ZWPWWNDZSA-N	-1	0	363.417	2.890	50	0		FFAARM
COc1ccc(CNC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)[O-])cc1	ZINC000002121484	506271586	/nfs/dbraw/zinc/27/15/86/506271586.db2.gz	NPFJVWLMNUUKRR-SFHVURJKSA-N	-1	0	367.405	2.672	50	0	biogenic	FFAARM
CN(Cc1nc(=O)c2sccc2[n-]1)C(=O)NCCc1ccccc1F	ZINC000032794873	506295400	/nfs/dbraw/zinc/29/54/00/506295400.db2.gz	AMGQIBBHQBFVDV-UHFFFAOYSA-N	-1	0	360.414	2.508	50	0		FFAARM
O=C(Nc1ccc(S(=O)(=O)[N-]c2ncccn2)cc1)c1ccccc1F	ZINC000002989255	506305968	/nfs/dbraw/zinc/30/59/68/506305968.db2.gz	BFZDDYUQGDOPSW-UHFFFAOYSA-N	-1	0	372.381	2.669	50	0		FFAARM
CCc1ccc(C(=O)COc2ccc(C[C@H]3SC(=O)[N-]C3=O)cc2)nc1	ZINC000003784715	506350023	/nfs/dbraw/zinc/35/00/23/506350023.db2.gz	IRNJSRAGRIZIHD-QGZVFWFLSA-N	-1	0	370.430	2.800	50	0	investigational	FFAARM
CCCCCCOC(=O)C[C@H](C(=O)OCCCCCC)S(=O)(=O)[O-]	ZINC000004065045	506356917	/nfs/dbraw/zinc/35/69/17/506356917.db2.gz	SOSQXPIKTBUEKF-CQSZACIVSA-N	-1	0	366.476	2.880	50	0		FFAARM
O=C([O-])CN(CC(=O)NCc1ccc(C(F)(F)F)cc1)c1ccccc1	ZINC000034926525	506373819	/nfs/dbraw/zinc/37/38/19/506373819.db2.gz	ONZGLYIOTKDIMY-UHFFFAOYSA-N	-1	0	366.339	2.913	50	0		FFAARM
CC[C@H](Sc1nnc(C)c(=O)[n-]1)C(=O)Nc1nc2c(s1)CCCC2	ZINC000004386122	506374259	/nfs/dbraw/zinc/37/42/59/506374259.db2.gz	ARSBPNUDPIWNTN-JTQLQIEISA-N	-1	0	365.484	2.730	50	0		FFAARM
Cc1ccc(C)c(Cn2[nH][n-]c3c(=O)n(-c4ccc(F)cc4)c(=O)c2=3)c1	ZINC000004483487	506377624	/nfs/dbraw/zinc/37/76/24/506377624.db2.gz	XUJUBVXBJAEIIF-SJORKVTESA-N	-1	0	352.369	2.936	50	0		FFAARM
COc1ccc(C)cc1S(=O)(=O)N(CC(=O)[O-])c1ccc(C)c(C)c1	ZINC000004648726	506386634	/nfs/dbraw/zinc/38/66/34/506386634.db2.gz	ROCKQVSGLDJEJQ-UHFFFAOYSA-N	-1	0	363.435	2.900	50	0		FFAARM
CC(=O)c1cn(CC(=O)NCC2CCC(C(=O)[O-])CC2)c2ccccc12	ZINC000036353887	506401454	/nfs/dbraw/zinc/40/14/54/506401454.db2.gz	CHIPAZMYAJZORL-UHFFFAOYSA-N	-1	0	356.422	2.851	50	0		FFAARM
Cc1cccc(N2CCN(Cc3nc(=O)c4sccc4[n-]3)CC2)c1C	ZINC000036389656	506404378	/nfs/dbraw/zinc/40/43/78/506404378.db2.gz	ZRWDGEWMTICNDV-UHFFFAOYSA-N	-1	0	354.479	2.924	50	0		FFAARM
CC[C@H](C)[C@@H](NC(=O)Cc1csc(-c2cccc(OC)c2)n1)C(=O)[O-]	ZINC000036580005	506406853	/nfs/dbraw/zinc/40/68/53/506406853.db2.gz	MXBZDJYAFAKPQJ-MEDUHNTESA-N	-1	0	362.451	2.977	50	0		FFAARM
Cc1cc(C)cc(N2C[C@H](C(=O)Nc3ccc(C(=O)[O-])cc3)CC2=O)c1	ZINC000005028134	506415496	/nfs/dbraw/zinc/41/54/96/506415496.db2.gz	SLRXALMNCVOLIJ-OAHLLOKOSA-N	-1	0	352.390	2.993	50	0		FFAARM
CCOc1ccc(Cc2nnc(Nc3ccc(OC)cc3)[n-]c2=O)cc1	ZINC000005154415	506426364	/nfs/dbraw/zinc/42/63/64/506426364.db2.gz	YMIVWGYZLGOLQR-UHFFFAOYSA-N	-1	0	352.394	2.907	50	0		FFAARM
CCCC[C@H](NC(=O)[C@@H](C)Oc1ccc2c(C)cc(=O)oc2c1)C(=O)[O-]	ZINC000005235510	506430256	/nfs/dbraw/zinc/43/02/56/506430256.db2.gz	CKGWKEONMUYSQY-DOMZBBRYSA-N	-1	0	361.394	2.628	50	0		FFAARM
O=C(Nc1nncs1)c1cccc([N-]S(=O)(=O)c2cccs2)c1	ZINC000040145327	506474573	/nfs/dbraw/zinc/47/45/73/506474573.db2.gz	COXOCPVWURLESQ-UHFFFAOYSA-N	-1	0	366.449	2.653	50	0		FFAARM
Cc1oc2c(c1C)c(C)cc1oc(=O)c(CC(=O)NCCC(=O)[O-])c(C)c21	ZINC000006624051	506491723	/nfs/dbraw/zinc/49/17/23/506491723.db2.gz	PHSPWMUCCFDUJA-UHFFFAOYSA-N	-1	0	371.389	2.906	50	0	biogenic	FFAARM
CCN(CC)C(=O)c1cccc([N-]S(=O)(=O)c2c(C)noc2C)c1	ZINC000007054782	506530371	/nfs/dbraw/zinc/53/03/71/506530371.db2.gz	LMZYIEHVDTZFLK-UHFFFAOYSA-N	-1	0	351.428	2.574	50	0		FFAARM
O=C(NC[C@@H]1CCCO1)c1ccccc1[N-]S(=O)(=O)Cc1ccccc1	ZINC000007728492	506585922	/nfs/dbraw/zinc/58/59/22/506585922.db2.gz	NRDYQUCAFULNBC-INIZCTEOSA-N	-1	0	374.462	2.537	50	0		FFAARM
C[C@@H]1Oc2ccc([N-]S(=O)(=O)c3ccc(F)c(F)c3F)cc2NC1=O	ZINC000007729328	506586126	/nfs/dbraw/zinc/58/61/26/506586126.db2.gz	MFGPBAGVGIFKFG-ZETCQYMHSA-N	-1	0	372.324	2.624	50	0		FFAARM
O=S(=O)([N-]c1ccc(C(F)(F)F)cn1)c1ccc2c(c1)OCCO2	ZINC000007782533	506589714	/nfs/dbraw/zinc/58/97/14/506589714.db2.gz	ZGKQYBOXPIIWSH-UHFFFAOYSA-N	-1	0	360.313	2.672	50	0		FFAARM
CCCCCCn1nc(C(=O)[N-]C2=NCCS2)c2ccccc2c1=O	ZINC000008778420	506668731	/nfs/dbraw/zinc/66/87/31/506668731.db2.gz	GOBONJNAQDYYBF-UHFFFAOYSA-N	-1	0	358.467	2.809	50	0		FFAARM
O=C1Cc2cc([N-]S(=O)(=O)c3ccccc3Br)ccc2N1	ZINC000011027630	506762614	/nfs/dbraw/zinc/76/26/14/506762614.db2.gz	USSSZRUFSHWPAL-UHFFFAOYSA-N	-1	0	367.224	2.745	50	0		FFAARM
COc1cc(C)c(C(C)C)cc1S(=O)(=O)N1CCC(C(=O)[O-])CC1	ZINC000011566065	506781205	/nfs/dbraw/zinc/78/12/05/506781205.db2.gz	UYDWPQRFRSHZHZ-UHFFFAOYSA-N	-1	0	355.456	2.612	50	0		FFAARM
O=S(=O)([N-]c1cccc2c1OCCO2)c1c(Cl)nc2ccccn21	ZINC000055685413	506825426	/nfs/dbraw/zinc/82/54/26/506825426.db2.gz	HEUSFAFDLFCDGW-UHFFFAOYSA-N	-1	0	365.798	2.560	50	0		FFAARM
CC(=O)[C@@H]1[C@H](c2ccc(C(F)(F)F)cc2)NC(=O)N[C@@]1(O)C(F)(F)F	ZINC000012377541	506856156	/nfs/dbraw/zinc/85/61/56/506856156.db2.gz	XTKAMUGCTADIQP-SCVCMEIPSA-N	-1	0	370.249	2.515	50	0		FFAARM
Cc1oc(-c2ccccc2)nc1CSc1nc2c(nc[nH]c2=O)n1C	ZINC000012372656	506856209	/nfs/dbraw/zinc/85/62/09/506856209.db2.gz	XQBJXYUIRHAXBZ-UHFFFAOYSA-N	-1	0	353.407	2.912	50	0	biogenic,in-vitro	FFAARM
Cc1nn(CC(=O)[O-])c2nc(-c3cnn(C)c3C)cc(C(F)(F)F)c12	ZINC000012395246	506859944	/nfs/dbraw/zinc/85/99/44/506859944.db2.gz	ZXLQIIFQXJTSAD-UHFFFAOYSA-N	-1	0	353.304	2.552	50	0		FFAARM
Cc1ccc(Cl)cc1N1CCN(C(=O)[C@H]2CC=CC[C@@H]2C(=O)[O-])CC1	ZINC000017074677	507114586	/nfs/dbraw/zinc/11/45/86/507114586.db2.gz	QCRHNPNJUYZFQQ-HOTGVXAUSA-N	-1	0	362.857	2.964	50	0		FFAARM
O=S(=O)([N-]c1ccccc1-n1cnnn1)c1cc(Cl)ccc1Cl	ZINC000047328520	507308519	/nfs/dbraw/zinc/30/85/19/507308519.db2.gz	IQEGXKWBFRJFSJ-UHFFFAOYSA-N	-1	0	370.221	2.770	50	0		FFAARM
CCc1nc2sc([C@H](c3ccccc3F)N3CCOCC3)c([O-])n2n1	ZINC000022854206	507315659	/nfs/dbraw/zinc/31/56/59/507315659.db2.gz	KCRAKJPRXCWRDI-AWEZNQCLSA-N	-1	0	362.430	2.620	50	0		FFAARM
Cc1nc2sc([C@H](c3ccc(Cl)cc3)N3CCOCC3)c([O-])n2n1	ZINC000023156954	507335085	/nfs/dbraw/zinc/33/50/85/507335085.db2.gz	PWUZSMRXWXHJHZ-ZDUSSCGKSA-N	-1	0	364.858	2.880	50	0		FFAARM
CCS(=O)(=O)c1ccc([O-])c(NC(=O)c2ccc(Br)o2)c1	ZINC000024153030	507394811	/nfs/dbraw/zinc/39/48/11/507394811.db2.gz	QZNXEXBDGDVKHG-UHFFFAOYSA-N	-1	0	374.212	2.794	50	0		FFAARM
O=C([O-])c1cc(-c2ccoc2)cc(S(=O)(=O)NCc2ccccn2)c1	ZINC000072133743	507755464	/nfs/dbraw/zinc/75/54/64/507755464.db2.gz	XOGHOWIMUFOOIG-UHFFFAOYSA-N	-1	0	358.375	2.518	50	0		FFAARM
C[C@H](Cn1cccn1)C(=O)N1CCC(Cc2cccc(C(=O)[O-])c2)CC1	ZINC000072149439	507759363	/nfs/dbraw/zinc/75/93/63/507759363.db2.gz	OYTYPUGRIYVYID-OAHLLOKOSA-N	-1	0	355.438	2.699	50	0		FFAARM
O=C([O-])CCc1cc2n(n1)CCN(C(=O)c1ccccc1C(F)(F)F)C2	ZINC000072156184	507763071	/nfs/dbraw/zinc/76/30/71/507763071.db2.gz	NZLPIPWZEBJVEO-UHFFFAOYSA-N	-1	0	367.327	2.575	50	0		FFAARM
Cc1c[nH]c(C(=O)N2CCC(C(=O)[O-])(n3ccc(C(C)(C)C)n3)CC2)c1	ZINC000072418867	507786376	/nfs/dbraw/zinc/78/63/76/507786376.db2.gz	LDKUMGDTKJKKNS-UHFFFAOYSA-N	-1	0	358.442	2.533	50	0		FFAARM
COc1ccccc1OC1(C(=O)[O-])CCN(C(=O)C[C@H]2C=CCC2)CC1	ZINC000072430752	507789969	/nfs/dbraw/zinc/78/99/69/507789969.db2.gz	BKISCCBLBAKXCX-HNNXBMFYSA-N	-1	0	359.422	2.876	50	0		FFAARM
Cc1c(Cl)c(C(=O)N2CC[C@@H](Cc3ccc(C(=O)[O-])cc3)C2)nn1C	ZINC000072429624	507789987	/nfs/dbraw/zinc/78/99/87/507789987.db2.gz	JXNRNFAJPQNFCO-ZDUSSCGKSA-N	-1	0	361.829	2.785	50	0		FFAARM
COc1ccc(C(=O)N2CCC(Oc3ccccc3C)(C(=O)[O-])CC2)o1	ZINC000072462986	507793821	/nfs/dbraw/zinc/79/38/21/507793821.db2.gz	VMRRJTNXJXDJAQ-UHFFFAOYSA-N	-1	0	359.378	2.735	50	0		FFAARM
Cc1cc2cc(C(=O)N3CCC(C(=O)[O-])(n4ccnc4)CC3)ccc2o1	ZINC000072462815	507794078	/nfs/dbraw/zinc/79/40/78/507794078.db2.gz	NVTZBLSRMNUWLB-UHFFFAOYSA-N	-1	0	353.378	2.654	50	0		FFAARM
CC(C)c1cccc(-n2cc([O-])c(C(=O)NCCCn3cccn3)n2)c1	ZINC000078875723	507914158	/nfs/dbraw/zinc/91/41/58/507914158.db2.gz	MILCKEPXUGFFOZ-UHFFFAOYSA-N	-1	0	353.426	2.718	50	0		FFAARM
COc1ccccc1[N-]S(=O)(=O)c1c[nH]c(-c2nnc(C3CC3)o2)c1	ZINC000075349593	508100653	/nfs/dbraw/zinc/10/06/53/508100653.db2.gz	PEUWWJOKMNHAAT-UHFFFAOYSA-N	-1	0	360.395	2.752	50	0		FFAARM
O=C([O-])c1cccc([C@@H]2CCCN(C(=O)c3nnc4n3CCCCC4)C2)c1	ZINC000095362462	508176777	/nfs/dbraw/zinc/17/67/77/508176777.db2.gz	ASYZCHGBYDFVIZ-MRXNPFEDSA-N	-1	0	368.437	2.723	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)CCCc2ccc(Cl)cc2)C[C@H]1c1ncc[nH]1	ZINC000095499719	508190662	/nfs/dbraw/zinc/19/06/62/508190662.db2.gz	UDVLHMJJFKVLCI-HUUCEWRRSA-N	-1	0	361.829	2.713	50	0		FFAARM
O=C([O-])[C@@H](NC(=O)c1cccc(-n2cccn2)c1)c1ccc(F)c(F)c1	ZINC000095989907	508200937	/nfs/dbraw/zinc/20/09/37/508200937.db2.gz	KSIPGPMXMLECKX-INIZCTEOSA-N	-1	0	357.316	2.706	50	0		FFAARM
COC(=O)[C@@]([N-]c1nccs1)(NC(=O)c1ccccc1C)C(F)(F)F	ZINC000096579831	508214437	/nfs/dbraw/zinc/21/44/37/508214437.db2.gz	HYNXJUAPEUZTAK-AWEZNQCLSA-N	-1	0	373.356	2.725	50	0		FFAARM
O=C(C1CCCC1)N1CCc2nc3cc(-c4ccccc4)[n-]n3c(=O)c2C1	ZINC000097124513	508219724	/nfs/dbraw/zinc/21/97/24/508219724.db2.gz	WOWFOEPSFSYIQS-UHFFFAOYSA-N	-1	0	362.433	2.765	50	0		FFAARM
Cc1ccc(F)c(OC2(C(=O)[O-])CCN(Cc3cnc(C)nc3)CC2)c1	ZINC000082106752	508225732	/nfs/dbraw/zinc/22/57/32/508225732.db2.gz	WRTZTFZMUKONOI-UHFFFAOYSA-N	-1	0	359.401	2.731	50	0		FFAARM
Cc1ncsc1CCN(C)c1nccc(-c2cc(C(=O)[O-])ccn2)n1	ZINC000077440527	508316133	/nfs/dbraw/zinc/31/61/33/508316133.db2.gz	VEIYTDWWNKSXSL-UHFFFAOYSA-N	-1	0	355.423	2.681	50	0		FFAARM
Cc1nn(C)c([N-]S(=O)(=O)c2cccc(C)c2Br)c1C	ZINC000158435064	508703322	/nfs/dbraw/zinc/70/33/22/508703322.db2.gz	CIAUPTARSYXIHW-UHFFFAOYSA-N	-1	0	358.261	2.909	50	0		FFAARM
Cc1cc(C(=O)NCc2nc(C(=O)[O-])cs2)cc(C)c1OC(F)F	ZINC000124140210	508787551	/nfs/dbraw/zinc/78/75/51/508787551.db2.gz	KMILZHPHLQHHNY-UHFFFAOYSA-N	-1	0	356.350	2.990	50	0		FFAARM
Cn1nc(C(=O)[O-])c2c1CCN(Cc1ccc([C@@H]3CCCCO3)s1)C2	ZINC000215075982	509245121	/nfs/dbraw/zinc/24/51/21/509245121.db2.gz	GZTVIBPEWFMOQP-HNNXBMFYSA-N	-1	0	361.467	2.980	50	0		FFAARM
COc1ccc2c(c1OC)C(=O)O[C@@H]2CC(=O)Nc1ccc(C(=O)[O-])cc1	ZINC000217680596	509271242	/nfs/dbraw/zinc/27/12/42/509271242.db2.gz	VOTYVCPRWVFKQU-CQSZACIVSA-N	-1	0	371.345	2.642	50	0	biogenic	FFAARM
C[C@@H]1Cc2cccc3c2n1c(=O)c(C(=O)NCc1ccc(F)cc1)c3[O-]	ZINC000170624678	509683143	/nfs/dbraw/zinc/68/31/43/509683143.db2.gz	RMTOXLCFDKCNMA-LLVKDONJSA-N	-1	0	352.365	2.893	50	0		FFAARM
COc1ccc(CNC(=O)c2c([O-])c3cccc4c3n(c2=O)[C@H](C)C4)cc1	ZINC000170624699	509683633	/nfs/dbraw/zinc/68/36/33/509683633.db2.gz	ORXCZQVCOZDLMS-GFCCVEGCSA-N	-1	0	364.401	2.763	50	0		FFAARM
O=C(c1ccc2c(=O)[nH]c(=S)[n-]c2c1)N1CCS[C@@H]2CCCC[C@H]21	ZINC000170656852	509702963	/nfs/dbraw/zinc/70/29/63/509702963.db2.gz	PMTQRYJXNAMOOZ-ZIAGYGMSSA-N	-1	0	361.492	2.712	50	0		FFAARM
Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)N1CC[C@H](C(=O)[O-])C1	ZINC000237669602	509706854	/nfs/dbraw/zinc/70/68/54/509706854.db2.gz	NKXCACOJJKYVMU-AWEZNQCLSA-N	-1	0	361.829	2.748	50	0		FFAARM
O=C([O-])[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc(Cn2cccn2)cc1	ZINC000237983838	509791490	/nfs/dbraw/zinc/79/14/90/509791490.db2.gz	LGLFETURCKJNKR-BZSNNMDCSA-N	-1	0	353.422	2.789	50	0		FFAARM
O=C([O-])CC[C@H]1CCCN(C(=O)COc2ccc(Br)cc2)C1	ZINC000238002324	509796370	/nfs/dbraw/zinc/79/63/70/509796370.db2.gz	GAPBGPVVOFAQKP-GFCCVEGCSA-N	-1	0	370.243	2.931	50	0		FFAARM
O=C([O-])CN(C(=O)/C=C/c1ccc(Br)s1)C1CCOCC1	ZINC000238106459	509821298	/nfs/dbraw/zinc/82/12/98/509821298.db2.gz	VKXRXFWZVHUCAN-DUXPYHPUSA-N	-1	0	374.256	2.616	50	0		FFAARM
COc1ccc(C[N@@H+]2CC[C@@](C(=O)[O-])(c3ccccc3)C2)cc1C(=O)[O-]	ZINC000252482708	509840349	/nfs/dbraw/zinc/84/03/49/509840349.db2.gz	DMHYBKXKBCSCGF-FQEVSTJZSA-N	-1	0	355.390	2.622	50	0		FFAARM
CC(C)c1ccc(CCC(=O)[N-]S(=O)(=O)c2ncccc2F)cc1	ZINC000241383356	509843863	/nfs/dbraw/zinc/84/38/63/509843863.db2.gz	MUQCMJNCTDCUDC-UHFFFAOYSA-N	-1	0	350.415	2.782	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)[C@H]2CC=CC[C@@H]2c2nc3ccccc3s2)CCO1	ZINC000263046938	510534629	/nfs/dbraw/zinc/53/46/29/510534629.db2.gz	WKCUTVWKQUVJGC-YDHLFZDLSA-N	-1	0	372.446	2.658	50	0		FFAARM
COc1ccc2c(c1)C[C@H](C(C)C)CN2C(=O)c1cnc(C(=O)[O-])cn1	ZINC000263115347	510567059	/nfs/dbraw/zinc/56/70/59/510567059.db2.gz	DTNWCFHABJPKFT-ZDUSSCGKSA-N	-1	0	355.394	2.659	50	0		FFAARM
Cc1oc(CN(C)C(=O)C[C@H]2Sc3ccccc3NC2=O)cc1C(=O)[O-]	ZINC000299750598	511668384	/nfs/dbraw/zinc/66/83/84/511668384.db2.gz	OAOAFNFCRFOWMH-OAHLLOKOSA-N	-1	0	374.418	2.748	50	0		FFAARM
Cc1c(C(=O)[O-])cccc1S(=O)(=O)N1C[C@H]2CCC(=O)c3cccc1c32	ZINC000274283521	511780123	/nfs/dbraw/zinc/78/01/23/511780123.db2.gz	ILTBNRYCSAQZIQ-GFCCVEGCSA-N	-1	0	371.414	2.962	50	0		FFAARM
O=C([O-])c1csc(S(=O)(=O)N2C[C@H]3CCC(=O)c4cccc2c43)c1	ZINC000274306443	511787684	/nfs/dbraw/zinc/78/76/84/511787684.db2.gz	PGHLBIQJJGKUBQ-SECBINFHSA-N	-1	0	363.416	2.715	50	0		FFAARM
Cc1ccc(CCC(=O)N2CCC[C@H](c3ccn(CC(=O)[O-])n3)C2)cc1	ZINC000426373560	513918511	/nfs/dbraw/zinc/91/85/11/513918511.db2.gz	BVSNNBIRDMILGH-KRWDZBQOSA-N	-1	0	355.438	2.615	50	0		FFAARM
CC[C@@H]1CCN(C(=O)c2cn(CCc3ccccc3)cc(C(=O)[O-])c2=O)C1	ZINC000426511632	513965509	/nfs/dbraw/zinc/96/55/09/513965509.db2.gz	IQZKTIXEPKQPDN-OAHLLOKOSA-N	-1	0	368.433	2.661	50	0		FFAARM
O=C([O-])[C@@]12CN(C(=O)c3ccc(=O)[nH]c3)C[C@@H]1C[C@@H](c1ccccc1)CC2	ZINC000426584015	513987436	/nfs/dbraw/zinc/98/74/36/513987436.db2.gz	LVCXLOAGRHWJGP-WJPUGNRLSA-N	-1	0	366.417	2.898	50	0		FFAARM
O=C([O-])[C@H](CNC(=O)[C@@H]1CC=CCC1)Oc1ccc(Br)cc1	ZINC000573252677	518576887	/nfs/dbraw/zinc/57/68/87/518576887.db2.gz	DKMOPKPPNQYRMS-RISCZKNCSA-N	-1	0	368.227	2.754	50	0		FFAARM
CC(C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@H]1CC[C@H](C(=O)[O-])CC1	ZINC000252383323	519797785	/nfs/dbraw/zinc/79/77/85/519797785.db2.gz	IEOLDSBHYKJJDA-MGPQQGTHSA-N	-1	0	356.463	2.543	50	0		FFAARM
CCOc1cc(/C=C/C(=O)N2CCC[C@@H]2C(=O)[O-])cc(Cl)c1OC	ZINC000269104873	520615325	/nfs/dbraw/zinc/61/53/25/520615325.db2.gz	CAVOBAPHBWXXRC-KTRBRXNASA-N	-1	0	353.802	2.836	50	0		FFAARM
C[C@H](Oc1ccc(NC(=O)[C@@H]2OCCc3ccccc32)cc1F)C(=O)[O-]	ZINC000630258901	522744742	/nfs/dbraw/zinc/74/47/42/522744742.db2.gz	VBYZBSYGGZLDFJ-APPDUMDISA-N	-1	0	359.353	2.930	50	0		FFAARM
COc1ccc(C(NC(=O)[C@H]2C[C@H]2C(=O)[O-])c2ccc(OC)cc2)cc1	ZINC000299753609	523796372	/nfs/dbraw/zinc/79/63/72/523796372.db2.gz	YUFIDRRBKHGYJX-DLBZAZTESA-N	-1	0	355.390	2.630	50	0		FFAARM
C[C@@H]1CC[C@@H](CCC(=O)N[C@@H](Cc2c[nH]c3cc(F)ccc23)C(=O)[O-])O1	ZINC000237532903	524585910	/nfs/dbraw/zinc/58/59/10/524585910.db2.gz	PUHCAAQJQWXZCP-WHCBVINPSA-N	-1	0	362.401	2.767	50	0		FFAARM
O=C([O-])[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)CC[C@H]1Cc2ccccc2NC1=O	ZINC000268935939	526292512	/nfs/dbraw/zinc/29/25/12/526292512.db2.gz	HKNIJECRIHRKRW-ATLSCFEFSA-N	-1	0	370.449	2.822	50	0		FFAARM
O=C([O-])C[C@@H]1CN(C(=O)CCc2cccc(OC3CCCC3)c2)CCO1	ZINC000269045021	527630485	/nfs/dbraw/zinc/63/04/85/527630485.db2.gz	SCTIQZLWVWUCGV-GOSISDBHSA-N	-1	0	361.438	2.643	50	0		FFAARM
CCc1cnc(C)nc1N1CCC(Oc2ccccc2OC)(C(=O)[O-])CC1	ZINC000082107121	536019891	/nfs/dbraw/zinc/01/98/91/536019891.db2.gz	VXFDJYPIGMBSNP-UHFFFAOYSA-N	-1	0	371.437	2.859	50	0		FFAARM
COc1ccccc1OC1(C(=O)[O-])CCN(c2ncnc(C)c2C)CC1	ZINC000082099616	537087930	/nfs/dbraw/zinc/08/79/30/537087930.db2.gz	XVKWIFGHOUIZJL-UHFFFAOYSA-N	-1	0	357.410	2.605	50	0		FFAARM
COc1ccc(Br)cc1S(=O)(=O)[N-]c1cccc(C)n1	ZINC000000863568	571133428	/nfs/dbraw/zinc/13/34/28/571133428.db2.gz	AKTQEJCPSWXCIZ-UHFFFAOYSA-N	-1	0	357.229	2.962	50	0		FFAARM
CS(=O)(=O)[C@@H]1CCC[C@H](NC(=O)c2ccc3[n-]c(=S)oc3c2)C1	ZINC000073930087	571138977	/nfs/dbraw/zinc/13/89/77/571138977.db2.gz	SFBPURUEVAYNSH-WDEREUQCSA-N	-1	0	354.453	2.576	50	0		FFAARM
O=[N+]([O-])c1cc(Cl)cc(C=NNC(=S)NCc2ccccc2)c1[O-]	ZINC000254818099	729627048	/nfs/dbraw/zinc/62/70/48/729627048.db2.gz	CVCIOBZCALSBDS-UHFFFAOYSA-N	-1	0	364.814	2.952	50	0		FFAARM
C[C@H](C(=O)[O-])C(=O)NCc1ccc(Br)cc1C(F)(F)F	ZINC000263550872	729691929	/nfs/dbraw/zinc/69/19/29/729691929.db2.gz	KSPQLUVZNNFEFC-LURJTMIESA-N	-1	0	354.122	2.805	50	0		FFAARM
Cc1nn(C)c(Cl)c1/C=C\C(=O)N1[C@@H]2CCCC[C@H]2C[C@H]1C(=O)[O-]	ZINC000323934440	729755879	/nfs/dbraw/zinc/75/58/79/729755879.db2.gz	AYEUTBUGBGOVDZ-JTURPGPFSA-N	-1	0	351.834	2.639	50	0		FFAARM
C[C@H]1Oc2c(cccc2C(=O)N2CC[C@@H](C(=O)[O-])c3ccccc32)NC1=O	ZINC000669435602	984589721	/nfs/dbraw/zinc/58/97/21/984589721.db2.gz	LHXICFSQTQVXBD-DGCLKSJQSA-N	-1	0	366.373	2.625	50	0		FFAARM
COc1cc(-c2nc(CN3CCC[C@@H]3c3n[nH]c(=O)[n-]3)c(C)o2)ccc1F	ZINC000011949700	987792423	/nfs/dbraw/zinc/79/24/23/987792423.db2.gz	ADDWQDMXQLFVTB-CQSZACIVSA-N	-1	0	373.388	2.546	50	0		FFAARM
N#C/C(=C/c1ccc2c(c1)OCCO2)C(=O)Nc1ccc(C(=O)[O-])cc1	ZINC000096663321	1012257895	/nfs/dbraw/zinc/25/78/95/1012257895.db2.gz	WYVXWZNQJXMDPS-ZROIWOOFSA-N	-1	0	350.330	2.702	50	0		FFAARM
O=C([O-])[C@@]1(CCCc2ccccc2)CCCN(C(=O)c2ccc(=O)[nH]c2)C1	ZINC000071750215	1019683455	/nfs/dbraw/zinc/68/34/55/1019683455.db2.gz	SYKMVULXHMYLCO-NRFANRHFSA-N	-1	0	368.433	2.705	50	0		FFAARM
Cc1ccc(C(=O)[O-])c(N2CCC[C@@]3(CCC(=O)N(CC4CC4)C3)C2)n1	ZINC000077535068	1020674434	/nfs/dbraw/zinc/67/44/34/1020674434.db2.gz	JHGLPKLADSFELY-HXUWFJFHSA-N	-1	0	357.454	2.707	50	0		FFAARM
CC[C@H](c1ccccn1)N(C)S(=O)(=O)c1cc(C(=O)[O-])ccc1OC	ZINC001506399331	1059491197	/nfs/dbraw/zinc/49/11/97/1059491197.db2.gz	LZDIFACUNFLLJA-CQSZACIVSA-N	-1	0	364.423	2.560	50	0		FFAARM
O=C([O-])c1cc2nc(-c3ccc4c(c3)OCO4)cc(C(F)(F)F)n2n1	ZINC000000721098	210266032	/nfs/dbraw/zinc/26/60/32/210266032.db2.gz	BONASGVJJHRBTP-UHFFFAOYSA-N	-1	0	351.240	2.842	50	0		FFAARM
Cc1cc(S(=O)(=O)[N-]c2cc(Cl)ccc2C(N)=O)cc(C)c1F	ZINC000170640735	222611043	/nfs/dbraw/zinc/61/10/43/222611043.db2.gz	ODZOTEABFMKKLQ-UHFFFAOYSA-N	-1	0	356.806	2.996	50	0		FFAARM
Cc1c2ccc(O)cc2oc(=O)c1CCC(=O)NCCCCCC(=O)[O-]	ZINC000002097100	210226930	/nfs/dbraw/zinc/22/69/30/210226930.db2.gz	YYOJQKKWRYBICR-UHFFFAOYSA-N	-1	0	361.394	2.501	50	0	biogenic	FFAARM
Cc1ccc(C(C)(C)NC(=O)CC[C@]2(CCC(=O)[O-])CCC(=O)N2)cc1	ZINC000219263716	222695865	/nfs/dbraw/zinc/69/58/65/222695865.db2.gz	QNLZWOKKPMHHPK-HXUWFJFHSA-N	-1	0	360.454	2.640	50	0		FFAARM
O=C([O-])[C@H]1Cc2ccccc2CN1C(=O)c1ccc(C(F)(F)F)nc1	ZINC000192683349	210083101	/nfs/dbraw/zinc/08/31/01/210083101.db2.gz	AHZKLVOSUYJUFS-CYBMUJFWSA-N	-1	0	350.296	2.752	50	0		FFAARM
C[C@H]1CCc2c(sc3nnn(Cc4ccc(C(=O)[O-])cc4)c(=O)c32)C1	ZINC000000958793	219348098	/nfs/dbraw/zinc/34/80/98/219348098.db2.gz	LJKCOHIXHKGEGB-JTQLQIEISA-N	-1	0	355.419	2.724	50	0		FFAARM
O=C(CSc1nc([O-])cc(=O)n1-c1ccccc1)Nc1ccccc1	ZINC000001288533	219394372	/nfs/dbraw/zinc/39/43/72/219394372.db2.gz	XBQGNDKCPUFBHD-UHFFFAOYSA-N	-1	0	353.403	2.669	50	0		FFAARM
CCc1ccc(-c2nc(C)c(C(=O)N3CCO[C@H](CC(=O)[O-])C3)s2)cc1	ZINC000236992916	222904655	/nfs/dbraw/zinc/90/46/55/222904655.db2.gz	TYECPOWZCIAJJH-OAHLLOKOSA-N	-1	0	374.462	2.997	50	0		FFAARM
O=C([O-])CCN(C(=O)[C@@H]1C[C@@H]1c1ccccc1Cl)C1CCOCC1	ZINC000238068316	222913321	/nfs/dbraw/zinc/91/33/21/222913321.db2.gz	NOZDHAGARZLPEM-HUUCEWRRSA-N	-1	0	351.830	2.926	50	0		FFAARM
Cc1nc(-c2cccc(Cl)c2)sc1C(=O)N1CCO[C@H](C(=O)[O-])C1	ZINC000237695225	222909899	/nfs/dbraw/zinc/90/98/99/222909899.db2.gz	ATFDRNVDRCKBAQ-LBPRGKRZSA-N	-1	0	366.826	2.698	50	0		FFAARM
COc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)[O-])c2)cc1OC	ZINC000013348971	220064465	/nfs/dbraw/zinc/06/44/65/220064465.db2.gz	XSEMNBQOHCNIPF-UHFFFAOYSA-N	-1	0	351.380	2.511	50	0		FFAARM
COc1ccc2oc(C(=O)N(CCC(=O)[O-])C3CCOCC3)c(C)c2c1	ZINC000299747757	211826182	/nfs/dbraw/zinc/82/61/82/211826182.db2.gz	DYMDJVMIUVAKHP-UHFFFAOYSA-N	-1	0	361.394	2.846	50	0		FFAARM
NC(=O)c1cc(S(=O)(=O)[N-]c2ccccc2C(F)(F)F)cs1	ZINC000016624523	220189227	/nfs/dbraw/zinc/18/92/27/220189227.db2.gz	UPLYEESGDGXYQH-UHFFFAOYSA-N	-1	0	350.343	2.667	50	0		FFAARM
Cc1nn2c(ncc3c(=O)n(CCC(=O)[O-])ccc32)c1-c1ccc(F)cc1	ZINC000040396972	211743051	/nfs/dbraw/zinc/74/30/51/211743051.db2.gz	OCZPWSYIHMIIKK-UHFFFAOYSA-N	-1	0	366.352	2.633	50	0		FFAARM
CC1(C)OC(=O)C2=C1NC(=O)C[C@@H]2c1ccc(-c2ccc(C(=O)[O-])cc2)o1	ZINC000072325996	211686306	/nfs/dbraw/zinc/68/63/06/211686306.db2.gz	SPZFZOGMPKCMEZ-GFCCVEGCSA-N	-1	0	367.357	2.838	50	0	biogenic	FFAARM
Cc1cn2c(nc(C)c(S(=O)(=O)[N-]c3cc(C)ccc3C)c2=O)s1	ZINC000020921871	211298538	/nfs/dbraw/zinc/29/85/38/211298538.db2.gz	RXLMUPNYEJLJBS-UHFFFAOYSA-N	-1	0	363.464	2.790	50	0		FFAARM
O=c1ccc(-c2ccc(S(=O)(=O)[N-]c3ccc(Cl)cc3)s2)n[nH]1	ZINC000020574705	211288583	/nfs/dbraw/zinc/28/85/83/211288583.db2.gz	XBXOFFAHZWRFKJ-UHFFFAOYSA-N	-1	0	367.839	2.953	50	0		FFAARM
O=C([O-])[C@@H]1CC=CC[C@H]1C(=O)Nc1sccc1C(=O)NCc1ccco1	ZINC000017076582	211179649	/nfs/dbraw/zinc/17/96/49/211179649.db2.gz	RHNLMMNMLNXGEK-CHWSQXEVSA-N	-1	0	374.418	2.877	50	0		FFAARM
COc1cccc(CCC(=O)NCCc2ccc(C(=O)[O-])cc2)c1OC	ZINC000013443203	211034105	/nfs/dbraw/zinc/03/41/05/211034105.db2.gz	KRSHPNMVKYWSEG-UHFFFAOYSA-N	-1	0	357.406	2.694	50	0		FFAARM
COc1ccc(S(=O)(=O)Nc2ccc(C(=O)[O-])cc2SC)cc1	ZINC000013278850	211029431	/nfs/dbraw/zinc/02/94/31/211029431.db2.gz	GEGYIOPBXKAVFB-UHFFFAOYSA-N	-1	0	353.421	2.916	50	0		FFAARM
CCCN1C(=O)S/C(=C/c2ccc(O[C@H](C)C(=O)[O-])c(OC)c2)C1=O	ZINC000004694882	210553987	/nfs/dbraw/zinc/55/39/87/210553987.db2.gz	NDRFJICXDODMNS-GMROUXNLSA-N	-1	0	365.407	2.993	50	0		FFAARM
O=C(CSC1=Nc2ccc(Cl)cc2S(=O)(=O)[N-]1)NC1CCCC1	ZINC000009762016	210346525	/nfs/dbraw/zinc/34/65/25/210346525.db2.gz	DXEYDTKIFYNKSV-UHFFFAOYSA-N	-1	0	373.887	2.602	50	0		FFAARM
CC(C)COC(=O)c1cccc(N2C(=O)c3ccc(C(=O)[O-])cc3C2=O)c1	ZINC000000850618	210280829	/nfs/dbraw/zinc/28/08/29/210280829.db2.gz	MCEBSQBVQAIQLY-UHFFFAOYSA-N	-1	0	367.357	2.998	50	0		FFAARM
CCc1ccc(OCC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)[O-])cc1	ZINC000000790601	210271526	/nfs/dbraw/zinc/27/15/26/210271526.db2.gz	JVNJFKIJZXDEBC-IBGZPJMESA-N	-1	0	366.417	2.921	50	0	biogenic	FFAARM
O=C([O-])c1c(NC(=O)Cn2c(=O)oc3ccccc32)sc2c1CCCC2	ZINC000000809694	210273614	/nfs/dbraw/zinc/27/36/14/210273614.db2.gz	ZTBKGHGBQOFXSB-UHFFFAOYSA-N	-1	0	372.402	2.872	50	0		FFAARM
C[C@@H]1CN([C@@H](c2sc3ncnn3c2[O-])c2cccc(F)c2)C[C@@H](C)O1	ZINC000022609564	220391189	/nfs/dbraw/zinc/39/11/89/220391189.db2.gz	VCWKKHRFLOLDAF-JTNHKYCSSA-N	-1	0	362.430	2.834	50	0		FFAARM
COC(=O)C1=C(C)N(CC(C)C)C(=S)N[C@@H]1c1ccc(C(=O)[O-])cc1	ZINC000058202161	221106114	/nfs/dbraw/zinc/10/61/14/221106114.db2.gz	DNXCQSGADNVQEC-OAHLLOKOSA-N	-1	0	362.451	2.719	50	0		FFAARM
Cc1ccc([N-]S(=O)(=O)c2cc(-c3ccc(=O)n(C)n3)cs2)cc1	ZINC000065128958	221171010	/nfs/dbraw/zinc/17/10/10/221171010.db2.gz	MCGXIQLOZWBLGH-UHFFFAOYSA-N	-1	0	361.448	2.618	50	0		FFAARM
O=C([O-])CSc1nnc(CCc2ccccc2O)n1-c1ccccc1	ZINC000065407514	221214740	/nfs/dbraw/zinc/21/47/40/221214740.db2.gz	HFUPVIVGHSBESO-UHFFFAOYSA-N	-1	0	355.419	2.935	50	0		FFAARM
Cc1cccc(N2CCC(N3CCn4nc(C(=O)[O-])cc4C3)CC2)c1C	ZINC000065409008	221215911	/nfs/dbraw/zinc/21/59/11/221215911.db2.gz	RJZBIBSZXAREMP-UHFFFAOYSA-N	-1	0	354.454	2.683	50	0		FFAARM
O=C([O-])c1nnn(Cc2ccc(Br)cc2)c1-c1ccncc1	ZINC000070457017	221332767	/nfs/dbraw/zinc/33/27/67/221332767.db2.gz	MGHMWNPZTBESMQ-UHFFFAOYSA-N	-1	0	359.183	2.849	50	0		FFAARM
CC1(C)[C@H](C(=O)Nc2ccccc2C(=O)NCc2ccco2)[C@@H]1C(=O)[O-]	ZINC000071286469	221340707	/nfs/dbraw/zinc/34/07/07/221340707.db2.gz	NOFWFTOHAHKXJQ-LSDHHAIUSA-N	-1	0	356.378	2.505	50	0		FFAARM
O=C([O-])c1ccccc1[C@@H]1CCN(C(=O)c2ccccc2-c2nc[nH]n2)C1	ZINC000072171587	221446725	/nfs/dbraw/zinc/44/67/25/221446725.db2.gz	MISPIGBDLXCRRO-CYBMUJFWSA-N	-1	0	362.389	2.800	50	0		FFAARM
C[C@@H]1CN(c2ccc(NC(=O)CC(C)(C)C(=O)[O-])cc2F)C[C@@H](C)O1	ZINC000170627452	132265229	/nfs/dbraw/zinc/26/52/29/132265229.db2.gz	CHVUDGZQFRLNAV-VXGBXAGGSA-N	-1	0	352.406	2.879	50	0		FFAARM
COc1ccc(C(=O)[O-])cc1S(=O)(=O)N1CCCc2cc(C)ccc21	ZINC000013262367	132377735	/nfs/dbraw/zinc/37/77/35/132377735.db2.gz	HRMUFARNCXIHDO-UHFFFAOYSA-N	-1	0	361.419	2.843	50	0		FFAARM
Cc1ccc(OC2(C(=O)[O-])CCN(c3ncnc4[nH]ccc43)CC2)cc1	ZINC000072407540	136145145	/nfs/dbraw/zinc/14/51/45/136145145.db2.gz	SOSAOGOOKYRDEH-UHFFFAOYSA-N	-1	0	352.394	2.769	50	0		FFAARM
O=c1c2[n-][nH]n(Cc3ccccc3F)c=2c(=O)n1-c1ccc(F)c(F)c1	ZINC000101168180	222265734	/nfs/dbraw/zinc/26/57/34/222265734.db2.gz	QXDPHBZEKHPVHZ-HUUCEWRRSA-N	-1	0	360.295	2.597	50	0		FFAARM
O=C([O-])c1ccc(C(=O)NC[C@H](c2cccnc2)N2CCCCC2)s1	ZINC000097642169	222201917	/nfs/dbraw/zinc/20/19/17/222201917.db2.gz	IGDFAEODFACYJK-CQSZACIVSA-N	-1	0	359.451	2.798	50	0		FFAARM
O=C(NC12CC3CC(CC(C3)C1)C2)c1c([O-])c2cccc3c2n(c1=O)CC3	ZINC000100326532	222241927	/nfs/dbraw/zinc/24/19/27/222241927.db2.gz	VACHZEWEAFGCQR-UHFFFAOYSA-N	-1	0	364.445	2.962	50	0		FFAARM
O=C(NCc1cccc(F)c1)c1c([O-])c2cccc3c2n(c1=O)CCC3	ZINC000100613718	222248415	/nfs/dbraw/zinc/24/84/15/222248415.db2.gz	CTSWZSXOQBXOAY-UHFFFAOYSA-N	-1	0	352.365	2.722	50	0		FFAARM
CCOc1cccc(NC(=O)c2ccc3c(c2)[n-]c(=S)n(C)c3=O)c1	ZINC000103686477	222340706	/nfs/dbraw/zinc/34/07/06/222340706.db2.gz	DVCUYGVEJIWGBJ-UHFFFAOYSA-N	-1	0	355.419	2.873	50	0		FFAARM
CCOc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccc(C)cc4)c=3c2=O)cc1	ZINC000101417756	222274009	/nfs/dbraw/zinc/27/40/09/222274009.db2.gz	VKSHFEONZXWLGA-ROUUACIJSA-N	-1	0	364.405	2.887	50	0		FFAARM
CCOc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccc(F)cc4)c=3c2=O)cc1	ZINC000101417809	222274098	/nfs/dbraw/zinc/27/40/98/222274098.db2.gz	CBWKXJJKOMGWPP-SJORKVTESA-N	-1	0	368.368	2.718	50	0		FFAARM
CCn1c(=O)c2ccc(C(=O)N[C@H](C)c3ccncc3)cc2[n-]c1=S	ZINC000102169956	222291349	/nfs/dbraw/zinc/29/13/49/222291349.db2.gz	XHDNYSRVEXZLIX-LLVKDONJSA-N	-1	0	354.435	2.591	50	0		FFAARM
Cc1cc2ncc(C(=O)N(Cc3sccc3C)CC(C)C)c(=O)n2[n-]1	ZINC000102327657	222293850	/nfs/dbraw/zinc/29/38/50/222293850.db2.gz	NHFAPIIYWNHAJR-UHFFFAOYSA-N	-1	0	358.467	2.999	50	0		FFAARM
O=C(N[C@@H]1CCO[C@@]2(CCSC2)C1)c1ccc2[n-]c(=S)oc2c1	ZINC000157438558	222554089	/nfs/dbraw/zinc/55/40/89/222554089.db2.gz	ZNWKKRSHXMEFKM-BZNIZROVSA-N	-1	0	350.465	2.901	50	0		FFAARM
CC[C@@H](C)[C@H](NC(=O)N1CCc2c3cc(OC)ccc3[nH]c2C1)C(=O)[O-]	ZINC000032646476	506273329	/nfs/dbraw/zinc/27/33/29/506273329.db2.gz	UCSFIIWHBINDLY-DIFFPNOSSA-N	-1	0	359.426	2.744	50	0		FFAARM
CC(C)C[C@H](NS(=O)(=O)c1cccc2c1cccc2N(C)C)C(=O)[O-]	ZINC000002579059	506282791	/nfs/dbraw/zinc/28/27/91/506282791.db2.gz	XBMQRPDOXIPUFG-HNNXBMFYSA-N	-1	0	364.467	2.683	50	0		FFAARM
CC(=O)OC[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)[O-]	ZINC000002555093	506283217	/nfs/dbraw/zinc/28/32/17/506283217.db2.gz	HSGIKRPBGCJRDB-SFHVURJKSA-N	-1	0	369.373	2.541	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)OCC2c3ccccc3-c3ccccc32)CCO1	ZINC000002570038	506283250	/nfs/dbraw/zinc/28/32/50/506283250.db2.gz	TUZVFPRISNDQLQ-SFHVURJKSA-N	-1	0	353.374	2.721	50	0		FFAARM
COc1ccccc1Cn1c(SCC(=O)[O-])nc2ccccc2c1=O	ZINC000002628569	506285335	/nfs/dbraw/zinc/28/53/35/506285335.db2.gz	IAOHSOLPIVDWSR-UHFFFAOYSA-N	-1	0	356.403	2.630	50	0		FFAARM
C[C@H](c1ccccc1)N1C(=O)C[C@H](Sc2ncccc2C(=O)[O-])C1=O	ZINC000002879553	506299582	/nfs/dbraw/zinc/29/95/82/506299582.db2.gz	OZFMZIOAGPZXNE-RISCZKNCSA-N	-1	0	356.403	2.761	50	0		FFAARM
O=S(=O)([N-]c1ccccc1OC(F)F)c1ccc2c(c1)OCCO2	ZINC000003359513	506323720	/nfs/dbraw/zinc/32/37/20/506323720.db2.gz	HQJJXVRCLDSLJQ-UHFFFAOYSA-N	-1	0	357.334	2.860	50	0		FFAARM
O=C([O-])[C@H](Cc1ccccc1)NS(=O)(=O)c1c(Cl)cccc1Cl	ZINC000003887424	506351677	/nfs/dbraw/zinc/35/16/77/506351677.db2.gz	QNWDZDYRTQIGQP-ZDUSSCGKSA-N	-1	0	374.245	2.968	50	0		FFAARM
CS(=O)(=O)c1nc2ccc([N-]S(=O)(=O)c3cccs3)cc2s1	ZINC000033298971	506354383	/nfs/dbraw/zinc/35/43/83/506354383.db2.gz	AVYZIHQAUWFMPC-UHFFFAOYSA-N	-1	0	374.490	2.562	50	0		FFAARM
O=C([O-])CCCN1C(=O)[C@@H]2[C@@H](C1=O)C1c3ccccc3C2c2ccccc21	ZINC000004134935	506360869	/nfs/dbraw/zinc/36/08/69/506360869.db2.gz	NNUJYUGKZMAOCH-GUMHCPJTSA-N	-1	0	361.397	2.743	50	0		FFAARM
O=C([O-])[C@H]1CCCC[C@@H]1C(=O)NCCc1csc(-c2cccnc2)n1	ZINC000004167053	506364120	/nfs/dbraw/zinc/36/41/20/506364120.db2.gz	IFNJJJMFBFRHGX-GJZGRUSLSA-N	-1	0	359.451	2.755	50	0		FFAARM
O=C1N[C@@]([N-]c2nccs2)(C(F)(F)F)C(=O)N1CCc1ccccc1	ZINC000004301869	506370039	/nfs/dbraw/zinc/37/00/39/506370039.db2.gz	QRSJJXZBGGJTJF-CQSZACIVSA-N	-1	0	370.356	2.813	50	0		FFAARM
CC(C)[C@@H](NC(=O)/C(=C\c1cccs1)NC(=O)c1ccccc1)C(=O)[O-]	ZINC000004698228	506388671	/nfs/dbraw/zinc/38/86/71/506388671.db2.gz	JQSRGQIYYVCSDD-RBFDBLARSA-N	-1	0	372.446	2.744	50	0		FFAARM
CCOC(=O)Cc1csc([N-]S(=O)(=O)Cc2ccccc2Cl)n1	ZINC000004742328	506391862	/nfs/dbraw/zinc/39/18/62/506391862.db2.gz	PPUGWFPIMXQHGE-UHFFFAOYSA-N	-1	0	374.871	2.844	50	0		FFAARM
Cc1cccc(C(=O)[O-])c1NS(=O)(=O)c1ccc2c(c1)OCCCO2	ZINC000036833345	506420043	/nfs/dbraw/zinc/42/00/43/506420043.db2.gz	KXTFIEWJMGYOSB-UHFFFAOYSA-N	-1	0	363.391	2.655	50	0		FFAARM
O=C([O-])C[C@]1(C(=O)NCc2ccccc2)CC(c2ccccc2Cl)=NO1	ZINC000005451610	506444748	/nfs/dbraw/zinc/44/47/48/506444748.db2.gz	UDHUJNJILLNDIT-IBGZPJMESA-N	-1	0	372.808	2.994	50	0		FFAARM
Cc1ccc([N-]S(=O)(=O)c2cc(Br)cnc2N)cc1F	ZINC000006800712	506508930	/nfs/dbraw/zinc/50/89/30/506508930.db2.gz	ZPXAGNIZUSWDNB-UHFFFAOYSA-N	-1	0	360.208	2.675	50	0		FFAARM
COc1ccc(Cc2n[n-]c(Nc3ccc(F)cc3)nc2=O)cc1OC	ZINC000009169372	506685379	/nfs/dbraw/zinc/68/53/79/506685379.db2.gz	XRGWAAYTVGEXBA-UHFFFAOYSA-N	-1	0	356.357	2.656	50	0		FFAARM
O=C(CSCc1nc(=O)c2sccc2[n-]1)N1CCc2ccccc21	ZINC000009608707	506705479	/nfs/dbraw/zinc/70/54/79/506705479.db2.gz	ZLTJKMOPQHDGGY-UHFFFAOYSA-N	-1	0	357.460	2.807	50	0		FFAARM
O=C([O-])COc1ccccc1CN(Cc1ccccn1)C[C@@H]1CCCO1	ZINC000055413989	506746901	/nfs/dbraw/zinc/74/69/01/506746901.db2.gz	XBLUINGJMCYSJD-SFHVURJKSA-N	-1	0	356.422	2.726	50	0		FFAARM
Cn1cc(S(=O)(=O)[N-]c2cccc(Oc3ccccc3)c2)cc1C(N)=O	ZINC000044667787	506872224	/nfs/dbraw/zinc/87/22/24/506872224.db2.gz	HEFNRMJOGKHHFW-UHFFFAOYSA-N	-1	0	371.418	2.717	50	0		FFAARM
O=C([O-])[C@@H]1C2CCC(CC2)[C@H]1C(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000017073975	507115574	/nfs/dbraw/zinc/11/55/74/507115574.db2.gz	GKGMJZXJBUDAIZ-VKYMVXLJSA-N	-1	0	358.438	2.599	50	0		FFAARM
Cc1cc(C)cc(NS(=O)(=O)c2cc3c(c(C(=O)[O-])c2)OCCO3)c1	ZINC000057115861	507174190	/nfs/dbraw/zinc/17/41/90/507174190.db2.gz	LQABXWPDLPYRPB-UHFFFAOYSA-N	-1	0	363.391	2.574	50	0		FFAARM
O=c1nc(CN2CCN(c3ccccc3Cl)CC2)[n-]c2ccsc21	ZINC000025777231	507533454	/nfs/dbraw/zinc/53/34/54/507533454.db2.gz	ICLSUIGTKFNISP-UHFFFAOYSA-N	-1	0	360.870	2.960	50	0		FFAARM
Cc1ccc(C(=O)N2CCCn3nc(CCC(=O)[O-])cc3C2)cc1Cl	ZINC000072431038	507789611	/nfs/dbraw/zinc/78/96/11/507789611.db2.gz	IUBFURVWHYENHH-UHFFFAOYSA-N	-1	0	361.829	2.908	50	0		FFAARM
O=C([O-])C1(Oc2cccc(F)c2)CCN(C(=O)NC2CCCC2)CC1	ZINC000072447730	507793289	/nfs/dbraw/zinc/79/32/89/507793289.db2.gz	WSWXKJQSUUYKIZ-UHFFFAOYSA-N	-1	0	350.390	2.776	50	0		FFAARM
CC(C)[C@@H](NC(=O)c1c(F)cccc1F)C(=O)[N-]OCc1ccccc1	ZINC000031615815	507820784	/nfs/dbraw/zinc/82/07/84/507820784.db2.gz	VLHUWBXAPGAUIV-QGZVFWFLSA-N	-1	0	362.376	2.967	50	0		FFAARM
O=C(NC[C@H]1CCCO1)c1nn(-c2ccccc2C(F)(F)F)cc1[O-]	ZINC000072615558	507831557	/nfs/dbraw/zinc/83/15/57/507831557.db2.gz	MQPUBVBVGMXDRZ-SNVBAGLBSA-N	-1	0	355.316	2.506	50	0		FFAARM
CC[C@@]1(C(=O)[O-])CCCN(C(=O)Cc2cc3c(cc2Cl)OCCO3)C1	ZINC000091412242	507983406	/nfs/dbraw/zinc/98/34/06/507983406.db2.gz	NYWAIXWXYBNQTC-GOSISDBHSA-N	-1	0	367.829	2.757	50	0		FFAARM
COc1ccc(C(=O)N2C[C@@H](c3ccccc3C)[C@H](C(=O)[O-])C2)c(O)c1	ZINC000091664630	508000353	/nfs/dbraw/zinc/00/03/53/508000353.db2.gz	AKDPENXBHZIEHN-DLBZAZTESA-N	-1	0	355.390	2.650	50	0		FFAARM
Cc1oc(-c2cc[nH]n2)cc1S(=O)(=O)[N-]c1ccc2c(c1)OCCO2	ZINC000075518935	508113139	/nfs/dbraw/zinc/11/31/39/508113139.db2.gz	PGYJIZQCSLIQHK-UHFFFAOYSA-N	-1	0	361.379	2.550	50	0		FFAARM
Cc1nc(N(C)C)ncc1C(=O)N1CCC[C@H](c2ccc(C(=O)[O-])cc2)C1	ZINC000095354661	508174859	/nfs/dbraw/zinc/17/48/59/508174859.db2.gz	IDWGXVFZRIBFJZ-INIZCTEOSA-N	-1	0	368.437	2.569	50	0		FFAARM
O=C([O-])CCc1cc2n(n1)CCCN(Cc1c[nH]c(CC3CCCC3)n1)C2	ZINC000095383159	508181423	/nfs/dbraw/zinc/18/14/23/508181423.db2.gz	IKMWGBQGHPUFJW-UHFFFAOYSA-N	-1	0	371.485	2.762	50	0		FFAARM
CCn1cc(S(=O)(=O)[N-]c2ccccc2NCC(F)(F)F)nc1C	ZINC000095453673	508186603	/nfs/dbraw/zinc/18/66/03/508186603.db2.gz	IHRYUIBHQWIGCZ-UHFFFAOYSA-N	-1	0	362.377	2.986	50	0		FFAARM
COC(=O)c1[n-]c(=NC(=O)c2cc(-c3ccco3)[nH]n2)sc1C(C)C	ZINC000095474214	508188502	/nfs/dbraw/zinc/18/85/02/508188502.db2.gz	UPFPOYNWDWBHLV-UHFFFAOYSA-N	-1	0	360.395	3.289	50	0		FFAARM
O=C([O-])[C@@H](Cc1ccncc1)NC(=O)c1csc(Cc2ccccc2)n1	ZINC000095517475	508194212	/nfs/dbraw/zinc/19/42/12/508194212.db2.gz	RETIIOQHNCUAIE-OAHLLOKOSA-N	-1	0	367.430	2.555	50	0		FFAARM
O=C([O-])[C@H](Cc1ccccc1)NC(=O)c1cc(-c2ccccc2F)n[nH]1	ZINC000095528226	508196317	/nfs/dbraw/zinc/19/63/17/508196317.db2.gz	SYVOGABKZLGKFB-KRWDZBQOSA-N	-1	0	353.353	2.642	50	0		FFAARM
COc1cc(CCC(=O)N[C@H](C(=O)[O-])c2ccccc2F)cc(OC)c1	ZINC000095989759	508200613	/nfs/dbraw/zinc/20/06/13/508200613.db2.gz	CQHUJXQZACTVAK-SFHVURJKSA-N	-1	0	361.369	2.718	50	0		FFAARM
[O-]c1c([C@H](c2ccc(F)c(Cl)c2)N2CCOCC2)sc2ncnn12	ZINC000218513067	509278983	/nfs/dbraw/zinc/27/89/83/509278983.db2.gz	FMYHXYWCWHSJFX-LBPRGKRZSA-N	-1	0	368.821	2.711	50	0		FFAARM
CC(C)(C(=O)[O-])n1cc(I)c2cnc(Cl)nc21	ZINC000219086981	509285141	/nfs/dbraw/zinc/28/51/41/509285141.db2.gz	RQWIOSWUEKBWKO-UHFFFAOYSA-N	-1	0	365.558	2.509	50	0		FFAARM
O=C([O-])c1ccc(O[C@@H]2CCOC[C@H]2NC(=O)CCc2ccccc2)cc1	ZINC000222470549	509317476	/nfs/dbraw/zinc/31/74/76/509317476.db2.gz	SQKMQLBQFNIUGI-RTBURBONSA-N	-1	0	369.417	2.670	50	0		FFAARM
CC(C)(CC(=O)N[C@@H]1CCN(c2ccccc2Br)C1)C(=O)[O-]	ZINC000236794981	509504236	/nfs/dbraw/zinc/50/42/36/509504236.db2.gz	JIPUVQBDXRFVLA-LLVKDONJSA-N	-1	0	369.259	2.645	50	0		FFAARM
CCn1cc(CC(=O)N(CCC(=O)[O-])C2CCOCC2)c2ccccc21	ZINC000236943935	509537988	/nfs/dbraw/zinc/53/79/88/509537988.db2.gz	FVZBGYOSJKVQJI-UHFFFAOYSA-N	-1	0	358.438	2.686	50	0		FFAARM
CC[C@@H](C)N(CC(=O)[O-])C(=O)c1ccc(CN2C[C@@H](C)O[C@@H](C)C2)cc1	ZINC000237061685	509562285	/nfs/dbraw/zinc/56/22/85/509562285.db2.gz	FMMZQOGSPVUYJX-OAGGEKHMSA-N	-1	0	362.470	2.621	50	0		FFAARM
COCCn1c(C)c(C)c2cc(C(=O)N3CC[C@](C)(C(=O)[O-])C3)ccc21	ZINC000237133839	509579846	/nfs/dbraw/zinc/57/98/46/509579846.db2.gz	MCHGIQCSSSCPEO-FQEVSTJZSA-N	-1	0	358.438	2.841	50	0		FFAARM
COc1ccc([C@H]2CCCCCN2C(=O)CN2CCC[C@H]2C(=O)[O-])cc1	ZINC000237370649	509633588	/nfs/dbraw/zinc/63/35/88/509633588.db2.gz	SBAGCOZGVRZKAK-MSOLQXFVSA-N	-1	0	360.454	2.688	50	0		FFAARM
CCOC(=O)CN(Cc1cc(=O)oc2cc([O-])c(Cl)cc12)C1CC1	ZINC000170619497	509683552	/nfs/dbraw/zinc/68/35/52/509683552.db2.gz	ZISBOMQLYUDTBW-UHFFFAOYSA-N	-1	0	351.786	2.680	50	0		FFAARM
C[C@H](Oc1ccc(F)cc1Br)C(=O)N1CCC[C@H](C(=O)[O-])C1	ZINC000237637154	509697378	/nfs/dbraw/zinc/69/73/78/509697378.db2.gz	BHYUUTHVFAXUDA-UWVGGRQHSA-N	-1	0	374.206	2.679	50	0		FFAARM
Cc1noc(C)c1COc1cccc(C(=O)N2CCC[C@@H](C(=O)[O-])C2)c1	ZINC000237640771	509699770	/nfs/dbraw/zinc/69/97/70/509699770.db2.gz	RWQQZNUFYYIUNU-OAHLLOKOSA-N	-1	0	358.394	2.807	50	0		FFAARM
Cc1nn(-c2ccccc2)cc1CCCNC(=O)c1cccc(C(=O)[O-])n1	ZINC000170671356	509711437	/nfs/dbraw/zinc/71/14/37/509711437.db2.gz	ZXURFQATUYXALD-UHFFFAOYSA-N	-1	0	364.405	2.637	50	0		FFAARM
Cc1nc(-c2cccc(C(=O)N3[C@H](C(=O)[O-])C[C@@H]4CCCC[C@@H]43)c2)no1	ZINC000237698070	509713518	/nfs/dbraw/zinc/71/35/18/509713518.db2.gz	NFJURMYHIGVHLG-RCBQFDQVSA-N	-1	0	355.394	2.903	50	0		FFAARM
O=C([O-])[C@H]1CN(C(=O)CCCc2cc(Cl)sc2Cl)CCO1	ZINC000237965248	509787551	/nfs/dbraw/zinc/78/75/51/509787551.db2.gz	IQHAERKOUJIUBI-SECBINFHSA-N	-1	0	352.239	2.690	50	0		FFAARM
O=C([O-])C1CCC(NC(=O)[C@H]2CCCCN2Cc2ccc(F)cc2)CC1	ZINC000238013228	509798936	/nfs/dbraw/zinc/79/89/36/509798936.db2.gz	PKXPDMOUSCQFRS-VMWRSERWSA-N	-1	0	362.445	2.940	50	0		FFAARM
O=C([O-])[C@@H]1CCCN1C(=O)/C=C/c1ccc(OCc2cccnc2)cc1	ZINC000238077693	509816390	/nfs/dbraw/zinc/81/63/90/509816390.db2.gz	GMKRLBXAPQTTLA-HKMNZKMDSA-N	-1	0	352.390	2.749	50	0		FFAARM
O=C([O-])[C@H]1CN(C(=O)c2cn(Cc3ccccc3)c3ccccc23)CCO1	ZINC000238143448	509827503	/nfs/dbraw/zinc/82/75/03/509827503.db2.gz	AKEXRYUDGSQVCB-LJQANCHMSA-N	-1	0	364.401	2.615	50	0		FFAARM
Cc1nc(CC(C)C)oc1C(=O)[N-]S(=O)(=O)Cc1ccc(F)cc1	ZINC000252494611	509844244	/nfs/dbraw/zinc/84/42/44/509844244.db2.gz	NZSVEFLCFQVINR-UHFFFAOYSA-N	-1	0	354.403	2.580	50	0		FFAARM
O=C([N-]S(=O)(=O)Cc1ccc(Cl)c(F)c1)c1sccc1F	ZINC000253418361	509880543	/nfs/dbraw/zinc/88/05/43/509880543.db2.gz	MZNPEJRJLAOROL-UHFFFAOYSA-N	-1	0	351.783	2.940	50	0		FFAARM
COc1ccc(S(=O)(=O)[N-]C(=O)/C=C\c2cnc(C)s2)c(C)c1C	ZINC000255161937	509919937	/nfs/dbraw/zinc/91/99/37/509919937.db2.gz	XJKXMZFGHPFJSD-YVMONPNESA-N	-1	0	366.464	2.595	50	0		FFAARM
COc1cc2c(cc1OC)CN(C(=O)CCc1ccc(C(=O)[O-])cc1)CC2	ZINC000262086287	510172202	/nfs/dbraw/zinc/17/22/02/510172202.db2.gz	HNGNSTJFGJDPKF-UHFFFAOYSA-N	-1	0	369.417	2.920	50	0		FFAARM
COc1ccc(CCC(=O)N2Cc3ccccc3C[C@H]2C(=O)[O-])cc1OC	ZINC000262410076	510272395	/nfs/dbraw/zinc/27/23/95/510272395.db2.gz	NWOQLXFVYYTQDM-KRWDZBQOSA-N	-1	0	369.417	2.675	50	0		FFAARM
Cc1cc(C(=O)N2CC[C@@H](C(=O)[O-])C2)c2ccc(Br)cc2n1	ZINC000178259015	510513546	/nfs/dbraw/zinc/51/35/46/510513546.db2.gz	XSUNORDWGRYGHI-SNVBAGLBSA-N	-1	0	363.211	2.852	50	0		FFAARM
O=C([O-])C1CCC(NC(=O)N2CCO[C@H](c3ccc(F)cc3)C2)CC1	ZINC000263483643	510720858	/nfs/dbraw/zinc/72/08/58/510720858.db2.gz	OQYBUPSLEMWSIR-BCLQGDPASA-N	-1	0	350.390	2.552	50	0		FFAARM
O=C([O-])CCN(CCO)C(=O)OCC1c2ccccc2-c2ccccc21	ZINC000307720811	511767672	/nfs/dbraw/zinc/76/76/72/511767672.db2.gz	PNAIQQVUQMQJTD-UHFFFAOYSA-N	-1	0	355.390	2.705	50	0		FFAARM
O=C([O-])c1csc(S(=O)(=O)N2C[C@@H]3CCC(=O)c4cccc2c43)c1	ZINC000274306447	511788425	/nfs/dbraw/zinc/78/84/25/511788425.db2.gz	PGHLBIQJJGKUBQ-VIFPVBQESA-N	-1	0	363.416	2.715	50	0		FFAARM
Cc1[nH]nc(-c2ccsc2)c1CC(=O)N[C@H](Cc1ccccc1)C(=O)[O-]	ZINC000409413451	513102603	/nfs/dbraw/zinc/10/26/03/513102603.db2.gz	MGEBJOWOQWWZFL-MRXNPFEDSA-N	-1	0	369.446	2.801	50	0		FFAARM
Cc1cccc([C@@H](NC(=O)N(Cc2cnn(C)c2)CC(C)C)C(=O)[O-])c1	ZINC000426444457	513941637	/nfs/dbraw/zinc/94/16/37/513941637.db2.gz	FLGQCESRESZLRZ-QGZVFWFLSA-N	-1	0	358.442	2.722	50	0		FFAARM
CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)NC1CCC(C(=O)[O-])CC1	ZINC000268946535	519480603	/nfs/dbraw/zinc/48/06/03/519480603.db2.gz	XFKYREQMICXFBB-HTWSVDAQSA-N	-1	0	356.422	2.710	50	0		FFAARM
C[C@@H]1C[C@H](C(=O)Nc2cccc(NC(=O)c3cccs3)c2)O[C@H]1C(=O)[O-]	ZINC000630106010	522621384	/nfs/dbraw/zinc/62/13/84/522621384.db2.gz	GUWPBMBYAUPDQE-WDBKCZKBSA-N	-1	0	374.418	2.817	50	0		FFAARM
CCOc1cc(C(=O)N2CCCC(F)(F)CC2)ccc1OCC(=O)[O-]	ZINC000630241083	522729336	/nfs/dbraw/zinc/72/93/36/522729336.db2.gz	KPQUWSAIFVFTTE-UHFFFAOYSA-N	-1	0	357.353	2.810	50	0		FFAARM
COCCC[C@]1(C(=O)[O-])CCCN(C(=O)Cc2ccc3[nH]c(C)nc3c2)C1	ZINC000091650363	523494869	/nfs/dbraw/zinc/49/48/69/523494869.db2.gz	PGPQAGLVLZLRGP-HXUWFJFHSA-N	-1	0	373.453	2.534	50	0		FFAARM
O=C([O-])[C@@H]1CCCN1C(=O)c1ccc(-c2ccc3c(c2)OCCO3)s1	ZINC000262716776	526274434	/nfs/dbraw/zinc/27/44/34/526274434.db2.gz	SGOYRBJOEYECEX-LBPRGKRZSA-N	-1	0	359.403	2.876	50	0		FFAARM
O=C([O-])[C@@H]1CCCN1Cc1nc(-c2cc(Br)cs2)no1	ZINC000262685401	526276237	/nfs/dbraw/zinc/27/62/37/526276237.db2.gz	XSAFYGBTUSIGGN-QMMMGPOBSA-N	-1	0	358.217	2.610	50	0		FFAARM
O=C([O-])COc1cccc(CNC(=O)[C@H]2C[C@H]2c2ccc(F)cc2F)c1	ZINC000238021487	527618455	/nfs/dbraw/zinc/61/84/55/527618455.db2.gz	UNCIWMATWHYULM-HOTGVXAUSA-N	-1	0	361.344	2.848	50	0		FFAARM
COC(=O)C[C@H](c1ccccc1Cl)c1c(=O)nc2ccccn2c1[O-]	ZINC000205975810	570555325	/nfs/dbraw/zinc/55/53/25/570555325.db2.gz	ZEFDTADPADDORD-GFCCVEGCSA-N	-1	0	358.781	2.749	50	0		FFAARM
O=C(NC[C@@H]1COc2ccccc2C1)c1ccc2c(c1)[n-]c(=S)[nH]c2=O	ZINC000047060438	570879266	/nfs/dbraw/zinc/87/92/66/570879266.db2.gz	JTAQMVJKWIMXDV-LLVKDONJSA-N	-1	0	367.430	2.979	50	0		FFAARM
COc1ccc2c(c1)ncc(C(=O)NC[C@H]1COc3ccccc3C1)c2O	ZINC000083970193	571063469	/nfs/dbraw/zinc/06/34/69/571063469.db2.gz	BRYQJFOHEQNISC-ZDUSSCGKSA-N	-1	0	364.401	2.518	50	0		FFAARM
Cc1nn(-c2ccc(C)cc2)c(C)c1S(=O)(=O)[N-]c1cc(C)ccn1	ZINC000064947025	571134962	/nfs/dbraw/zinc/13/49/62/571134962.db2.gz	IWAZKUHGSMYWBN-UHFFFAOYSA-N	-1	0	356.451	3.302	50	0		FFAARM
CCCC[C@H]1Oc2ccc(S(=O)(=O)[N-]c3nccs3)cc2NC1=O	ZINC000252479524	571279955	/nfs/dbraw/zinc/27/99/55/571279955.db2.gz	BHBNAAVDJODLEH-CYBMUJFWSA-N	-1	0	367.452	2.834	50	0		FFAARM
CC(C)(C)c1ccc([C@H](CC(=O)[O-])NC(=O)c2cnn3cccnc23)cc1	ZINC000262515401	600392730	/nfs/dbraw/zinc/39/27/30/600392730.db2.gz	LFHZCBHXXAUOLQ-INIZCTEOSA-N	-1	0	366.421	2.973	50	0		FFAARM
COc1ccc(S(=O)(=O)[N-]C(=O)/C=C/c2cnc(C)s2)c(C)c1C	ZINC000117539592	728578768	/nfs/dbraw/zinc/57/87/68/728578768.db2.gz	XJKXMZFGHPFJSD-VMPITWQZSA-N	-1	0	366.464	2.595	50	0		FFAARM
O=C([O-])[C@@H](NC(=O)[C@H]1C[C@H]1c1cccc(C(F)(F)F)c1)[C@@H]1CCCOC1	ZINC000262705300	939066896	/nfs/dbraw/zinc/06/68/96/939066896.db2.gz	AKOKVMLNINLOGP-UNQGMJICSA-N	-1	0	371.355	2.805	50	0		FFAARM
CC(C)Oc1nn(C)c2ccc(NC(=O)[C@@H]3CC=CC[C@H]3C(=O)[O-])cc12	ZINC000675028340	971520821	/nfs/dbraw/zinc/52/08/21/971520821.db2.gz	PQMPRBTYZUIJHX-ZIAGYGMSSA-N	-1	0	357.410	2.966	50	0		FFAARM
O=C([O-])c1cc2ncc(-c3cc(F)ccc3OC[C@@H]3CCCO3)cn2n1	ZINC000874969892	990783987	/nfs/dbraw/zinc/78/39/87/990783987.db2.gz	HVPSSOLMGGPVAE-ZDUSSCGKSA-N	-1	0	357.341	2.791	50	0		FFAARM
O=C([O-])c1ccc2nc(/C=C/c3cnc(N4CCOCC4)nc3)ccc2c1	ZINC000124777166	1012565475	/nfs/dbraw/zinc/56/54/75/1012565475.db2.gz	QMGHHRHHRXLSKM-DAFODLJHSA-N	-1	0	362.389	2.730	50	0		FFAARM
Cc1c(C(=O)N[C@H]2C[C@@H](C(=O)[O-])c3ccccc32)cnn1C1CCOCC1	ZINC000653327133	1024901118	/nfs/dbraw/zinc/90/11/18/1024901118.db2.gz	RBCQQMZHALPHJU-AEFFLSMTSA-N	-1	0	369.421	2.586	50	0		FFAARM
COc1cc(N[C@H]2CCCN(C(=O)C3(C(=O)[O-])CC=CC3)C2)cc(OC)c1	ZINC000663044806	1026583845	/nfs/dbraw/zinc/58/38/45/1026583845.db2.gz	BTBJITSLOMKDTM-AWEZNQCLSA-N	-1	0	374.437	2.528	50	0		FFAARM
CCC[C@]1(C(=O)[O-])CN(C(=O)Cc2cccc3ccccc32)CC[C@H]1O	ZINC001529101360	1062161624	/nfs/dbraw/zinc/16/16/24/1062161624.db2.gz	FXCLKQWZMLUPET-NQIIRXRSSA-N	-1	0	355.434	2.847	50	0		FFAARM
COC(=O)c1c(N)n(-c2cccc(C(=O)[O-])c2)c2nc3ccccc3nc21	ZINC000000636264	210255340	/nfs/dbraw/zinc/25/53/40/210255340.db2.gz	OMHDIPFTJIERSD-UHFFFAOYSA-N	-1	0	362.345	2.641	50	0		FFAARM
COC(=O)C1CCN(Cc2cc(=O)oc3cc([O-])c(Cl)cc23)CC1	ZINC000020573361	210236016	/nfs/dbraw/zinc/23/60/16/210236016.db2.gz	LDDPLNSDAUNYRZ-UHFFFAOYSA-N	-1	0	351.786	2.537	50	0		FFAARM
O=C([O-])[C@H](Cc1ccccc1)NC(=O)CSc1ccc(F)c(F)c1	ZINC000170100020	210174338	/nfs/dbraw/zinc/17/43/38/210174338.db2.gz	VHMQBFOZFXRCPK-HNNXBMFYSA-N	-1	0	351.374	2.869	50	0		FFAARM
CC[C@H](C)Oc1ccccc1/C=C/C(=O)N(CC(=O)[O-])C1CCOCC1	ZINC000328594781	210110406	/nfs/dbraw/zinc/11/04/06/210110406.db2.gz	BLVUDWQARLAJAO-HVHJFMEUSA-N	-1	0	361.438	2.969	50	0		FFAARM
CCCc1c(C(=O)N2CCC[C@@H](C(=O)[O-])C2)cnn1Cc1ccccc1	ZINC000136116152	210090333	/nfs/dbraw/zinc/09/03/33/210090333.db2.gz	PJVVDJXNMPMXRO-MRXNPFEDSA-N	-1	0	355.438	2.821	50	0		FFAARM
Cc1nc(C(=O)N2CCC[C@H](C(=O)[O-])C2)nn1-c1ccccc1C(C)C	ZINC000136129302	210089940	/nfs/dbraw/zinc/08/99/40/210089940.db2.gz	WWPDKAPRXOBGEK-AWEZNQCLSA-N	-1	0	356.426	2.636	50	0		FFAARM
Cc1nc(COc2cccc(C(=O)N3CCC[C@H](C(=O)[O-])C3)c2)cs1	ZINC000133061591	210071387	/nfs/dbraw/zinc/07/13/87/210071387.db2.gz	RWTURHFTXOECDT-AWEZNQCLSA-N	-1	0	360.435	2.967	50	0		FFAARM
O=C([O-])C1[C@H](c2ccccc2)C(C(=O)N2CCOCC2)[C@H]1c1ccccc1	ZINC000000897609	219337847	/nfs/dbraw/zinc/33/78/47/219337847.db2.gz	FMUMEDHFYUKQRJ-UVHRUJRTSA-N	-1	0	365.429	2.743	50	0		FFAARM
O=C([O-])c1ccc(NC2=C(Cl)C(=O)N(CCc3ccccc3)C2=O)cc1	ZINC000000938533	219343814	/nfs/dbraw/zinc/34/38/14/219343814.db2.gz	SDFUFIVPJRVFRW-UHFFFAOYSA-N	-1	0	370.792	2.859	50	0		FFAARM
COc1ccc(Cl)cc1N1CC[C@H](NC(=O)CC(C)(C)C(=O)[O-])C1	ZINC000237102806	222905633	/nfs/dbraw/zinc/90/56/33/222905633.db2.gz	BIZWRTQKWBPHCV-LBPRGKRZSA-N	-1	0	354.834	2.544	50	0		FFAARM
Cc1nc(-c2ccc(C)cc2C)sc1C(=O)N1CCO[C@H](C(=O)[O-])C1	ZINC000237759666	222910596	/nfs/dbraw/zinc/91/05/96/222910596.db2.gz	RTVINNYSDKBKCI-AWEZNQCLSA-N	-1	0	360.435	2.661	50	0		FFAARM
O=C([O-])CC[C@H]1CCCCN1C(=O)CC[C@@H]1Cc2ccccc2NC1=O	ZINC000237982147	222912576	/nfs/dbraw/zinc/91/25/76/222912576.db2.gz	FZGRPNQENUMDAS-HZPDHXFCSA-N	-1	0	358.438	2.824	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)C1CCOCC1)c1ccc(Br)cc1	ZINC000238092654	222913965	/nfs/dbraw/zinc/91/39/65/222913965.db2.gz	BKBQVFXSLUZUHU-CYBMUJFWSA-N	-1	0	356.216	2.508	50	0		FFAARM
CC(=O)c1ccc(S(=O)(=O)N[C@H](CC(=O)[O-])c2ccc(F)cc2)cc1	ZINC000012859584	220037333	/nfs/dbraw/zinc/03/73/33/220037333.db2.gz	FENPYBGSTPNCEM-MRXNPFEDSA-N	-1	0	365.382	2.523	50	0		FFAARM
COc1cc(C)c(NS(=O)(=O)c2ccc(C)c(C(=O)[O-])c2)cc1OC	ZINC000013349558	220064615	/nfs/dbraw/zinc/06/46/15/220064615.db2.gz	MTCGYYNUFIIFLU-UHFFFAOYSA-N	-1	0	365.407	2.820	50	0		FFAARM
CC(=O)c1ccc(S(=O)(=O)N[C@H](CC(=O)[O-])c2ccc(C)cc2)cc1	ZINC000013348174	220064752	/nfs/dbraw/zinc/06/47/52/220064752.db2.gz	DGDLKGFBONLVDQ-QGZVFWFLSA-N	-1	0	361.419	2.692	50	0		FFAARM
COc1ccc(/C=C/C(=O)[O-])cc1S(=O)(=O)Nc1ccc(F)cc1F	ZINC000013367355	220066200	/nfs/dbraw/zinc/06/62/00/220066200.db2.gz	IQJYLXPXPYNRKQ-XVNBXDOJSA-N	-1	0	369.345	2.872	50	0		FFAARM
O=C([O-])COc1cccc(CNC(=O)[C@H]2SCCc3ccccc32)c1	ZINC000299750385	211833211	/nfs/dbraw/zinc/83/32/11/211833211.db2.gz	NHZZMWWDBCKXHH-SFHVURJKSA-N	-1	0	357.431	2.797	50	0		FFAARM
O=C([O-])[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H]1CCOc2ccccc21	ZINC000299742878	211821887	/nfs/dbraw/zinc/82/18/87/211821887.db2.gz	JBHXTLUKQBVRSR-AEFFLSMTSA-N	-1	0	364.401	2.846	50	0		FFAARM
COC(=O)c1ccc(S(=O)(=O)[N-]c2cnc3c(cnn3C(C)C)c2)cc1	ZINC000032098031	211543905	/nfs/dbraw/zinc/54/39/05/211543905.db2.gz	LXBYVEPSWKLPRZ-UHFFFAOYSA-N	-1	0	374.422	2.600	50	0		FFAARM
Cc1noc(C)c1S(=O)(=O)[N-]c1ccc(NC(=O)c2ccco2)cc1	ZINC000023397701	211387585	/nfs/dbraw/zinc/38/75/85/211387585.db2.gz	JEUXVXAFSPFXRZ-UHFFFAOYSA-N	-1	0	361.379	2.938	50	0		FFAARM
CCOc1ccccc1[N-]S(=O)(=O)c1cc2c(cc1C)NC(=O)CO2	ZINC000020491702	211283222	/nfs/dbraw/zinc/28/32/22/211283222.db2.gz	DJNHGXVLOMYUSU-UHFFFAOYSA-N	-1	0	362.407	2.525	50	0		FFAARM
Cc1ccc(C)c(N2C(=O)C[C@H](Sc3ncccc3C(=O)[O-])C2=O)c1	ZINC000019881889	211259090	/nfs/dbraw/zinc/25/90/90/211259090.db2.gz	MLFBMSCZWHSUBW-AWEZNQCLSA-N	-1	0	356.403	2.821	50	0		FFAARM
COc1ccc(OC)c([C@@H](C)NC(=O)COc2cccc(C(=O)[O-])c2)c1	ZINC000013419278	211032036	/nfs/dbraw/zinc/03/20/36/211032036.db2.gz	NMXBHASRROCAGP-GFCCVEGCSA-N	-1	0	359.378	2.658	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)Cc1ccc(N2CCCC2=O)cc1)c1cccs1	ZINC000013389954	211032146	/nfs/dbraw/zinc/03/21/46/211032146.db2.gz	MVKKZUXRPFXZHV-OAHLLOKOSA-N	-1	0	372.446	2.750	50	0		FFAARM
CNC(=O)Nc1ccc2sc([N-]S(=O)(=O)c3ccccc3)nc2c1	ZINC000013361438	211030060	/nfs/dbraw/zinc/03/00/60/211030060.db2.gz	GHLIRVXNZXOUDY-UHFFFAOYSA-N	-1	0	362.436	2.848	50	0		FFAARM
COc1ccc(OC)c([C@H](C)NC(=O)COc2ccc(C(=O)[O-])cc2)c1	ZINC000013413696	211032797	/nfs/dbraw/zinc/03/27/97/211032797.db2.gz	PJTZNUTURASZCY-LBPRGKRZSA-N	-1	0	359.378	2.658	50	0		FFAARM
O=C([O-])[C@H](Cc1c[nH]c2ccccc12)NC(=O)NCc1cccc(F)c1F	ZINC000013236831	211028874	/nfs/dbraw/zinc/02/88/74/211028874.db2.gz	DQTKMDMKJTWHDB-INIZCTEOSA-N	-1	0	373.359	2.941	50	0		FFAARM
COc1ccccc1[N-]S(=O)(=O)c1ccc(C(=O)N2CCCC2)s1	ZINC000009807564	210853502	/nfs/dbraw/zinc/85/35/02/210853502.db2.gz	XTTMPAVAWCFXDV-UHFFFAOYSA-N	-1	0	366.464	2.794	50	0		FFAARM
Cc1c(C(=O)[O-])sc2[nH]c(C=Cc3ccc4c(c3)OCCO4)nc(=O)c12	ZINC000005903160	210648414	/nfs/dbraw/zinc/64/84/14/210648414.db2.gz	GDYXLPUSKYYJKL-HWKANZROSA-N	-1	0	370.386	2.933	50	0		FFAARM
CN1CC(=O)N=C1[N-]P(=O)(OCc1ccccc1)OCc1ccccc1	ZINC000002311877	210389901	/nfs/dbraw/zinc/38/99/01/210389901.db2.gz	FFEFFWWQHCAWCF-UHFFFAOYSA-N	-1	0	373.349	2.946	50	0		FFAARM
O=C([O-])CCCNC(=O)/C(=C\c1ccccc1F)NC(=O)c1ccccc1	ZINC000002257390	210386816	/nfs/dbraw/zinc/38/68/16/210386816.db2.gz	BVTFZQQRVTYKRG-GHRIWEEISA-N	-1	0	370.380	2.578	50	0		FFAARM
CCOc1ccc([C@@H](CC(=O)[O-])NS(=O)(=O)c2ccc(C)cc2)cc1	ZINC000001131372	210323078	/nfs/dbraw/zinc/32/30/78/210323078.db2.gz	FSTMZBGKAUYQOV-QGZVFWFLSA-N	-1	0	363.435	2.888	50	0		FFAARM
CCS(=O)(=O)c1ccc([O-])c(NC(=O)Nc2ccccc2OC)c1	ZINC000001032436	210303396	/nfs/dbraw/zinc/30/33/96/210303396.db2.gz	FDHSVPOOCWINQT-UHFFFAOYSA-N	-1	0	350.396	2.838	50	0		FFAARM
Cc1ccc(C)c(S(=O)(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)[O-])c1	ZINC000000811628	210274694	/nfs/dbraw/zinc/27/46/94/210274694.db2.gz	PQDKVOGGOLWGRX-QGZVFWFLSA-N	-1	0	372.446	2.759	50	0	biogenic,in-vitro	FFAARM
O=C([O-])[C@H]1CC=CC[C@H]1C(=O)Nc1cccc(C(=O)N2CCCCC2)c1	ZINC000000794643	210270615	/nfs/dbraw/zinc/27/06/15/210270615.db2.gz	XMSLPTJAWDQIRU-SJORKVTESA-N	-1	0	356.422	2.918	50	0		FFAARM
CC1=Nc2nc(NC(=O)CCC(=O)[O-])nn2[C@H](c2ccc(Cl)cc2)C1	ZINC000000780260	210268691	/nfs/dbraw/zinc/26/86/91/210268691.db2.gz	SPGMFGKWYCTDTN-LBPRGKRZSA-N	-1	0	361.789	2.654	50	0		FFAARM
CCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C(=O)[O-])[C@H](C)CC	ZINC000025664095	220495161	/nfs/dbraw/zinc/49/51/61/220495161.db2.gz	IYVYOUHROQHPGA-KBMXLJTQSA-N	-1	0	364.442	2.697	50	0		FFAARM
C[C@]1(C(=O)[O-])CCN(C(=O)CCOc2cccc(Br)c2)C1	ZINC000062913227	221140663	/nfs/dbraw/zinc/14/06/63/221140663.db2.gz	GTAGGALGBOIOQT-HNNXBMFYSA-N	-1	0	356.216	2.541	50	0		FFAARM
Cc1ccc([N-]S(=O)(=O)c2cc3[nH]c(=O)[nH]c3cc2Cl)cc1C	ZINC000064976585	221160109	/nfs/dbraw/zinc/16/01/09/221160109.db2.gz	FFUASIPBMLFVFW-UHFFFAOYSA-N	-1	0	351.815	2.927	50	0		FFAARM
Cc1ccc([N-]S(=O)(=O)c2cc(-c3ccc(=O)[nH]n3)cs2)c(C)c1	ZINC000065119339	221171017	/nfs/dbraw/zinc/17/10/17/221171017.db2.gz	FCNSRPFVWQBBLS-UHFFFAOYSA-N	-1	0	361.448	2.916	50	0		FFAARM
Cc1ccc([N-]S(=O)(=O)c2cc3n(c2)CCN(CC(C)C)C3=O)cc1	ZINC000065254803	221189135	/nfs/dbraw/zinc/18/91/35/221189135.db2.gz	WMTWRBLKJUABFQ-UHFFFAOYSA-N	-1	0	361.467	2.709	50	0		FFAARM
CC(C)N1CCn2cc(S(=O)(=O)[N-]c3cccc(Cl)c3)cc2C1=O	ZINC000065254773	221189229	/nfs/dbraw/zinc/18/92/29/221189229.db2.gz	BIIIDJDXJRURHK-UHFFFAOYSA-N	-1	0	367.858	2.807	50	0		FFAARM
O=C([O-])c1cccnc1CN1CCC[C@@H]1c1nc(-c2ccncc2)no1	ZINC000065425744	221217167	/nfs/dbraw/zinc/21/71/67/221217167.db2.gz	ZUPWMPKQNVIJKY-OAHLLOKOSA-N	-1	0	351.366	2.562	50	0		FFAARM
Cc1ccc(-c2nc(N[C@H](C)c3nnn[n-]3)ncc2-c2ccc(N)nc2)cc1	ZINC000065469499	221222930	/nfs/dbraw/zinc/22/29/30/221222930.db2.gz	JPVSLTDNGLHBHQ-GFCCVEGCSA-N	-1	0	373.424	2.782	50	0		FFAARM
Cc1ccc(CN2C[C@H](C(=O)Nc3cccc(C(=O)[O-])c3)CC2=O)cc1	ZINC000067244976	221249817	/nfs/dbraw/zinc/24/98/17/221249817.db2.gz	GXUQFQABKJEQKB-MRXNPFEDSA-N	-1	0	352.390	2.680	50	0		FFAARM
CC(C)c1nc(CNC(=O)c2ccc(-c3cccc(C(=O)[O-])c3)nc2)no1	ZINC000067821694	221291326	/nfs/dbraw/zinc/29/13/26/221291326.db2.gz	BYQFBZJCBZGSKS-UHFFFAOYSA-N	-1	0	366.377	2.883	50	0		FFAARM
C[C@H](c1nnc(SCC(=O)[O-])n1-c1cccc(Cl)c1)n1ccnc1	ZINC000067840183	221292937	/nfs/dbraw/zinc/29/29/37/221292937.db2.gz	VKVWHHPCEFZXKC-SNVBAGLBSA-N	-1	0	363.830	2.903	50	0		FFAARM
Cc1n[nH]c(C)c1[C@@H](NC(=O)CCc1nc2ccccc2s1)C(=O)[O-]	ZINC000067954623	221307695	/nfs/dbraw/zinc/30/76/95/221307695.db2.gz	MEFBWZWODYWTQV-MRXNPFEDSA-N	-1	0	358.423	2.511	50	0		FFAARM
COc1cc(NC(=O)[C@@H]2[C@@H](C(=O)[O-])C2(C)C)ccc1-c1ccc(CO)o1	ZINC000071281937	221338474	/nfs/dbraw/zinc/33/84/74/221338474.db2.gz	VRFQOPXZDFOKBE-HOTGVXAUSA-N	-1	0	359.378	2.743	50	0		FFAARM
O=C(c1cc(=O)n(-c2ccccc2)[n-]1)N1CCO[C@H](c2ccc(F)cc2)C1	ZINC000071775569	221375129	/nfs/dbraw/zinc/37/51/29/221375129.db2.gz	CYIFRPABBDKSOW-SFHVURJKSA-N	-1	0	367.380	2.518	50	0		FFAARM
Cc1ccc(OC2(C(=O)[O-])CCN(C(=O)c3ccncc3F)CC2)cc1	ZINC000072432158	221523651	/nfs/dbraw/zinc/52/36/51/221523651.db2.gz	GGUJZYYXEYMTRE-UHFFFAOYSA-N	-1	0	358.369	2.668	50	0		FFAARM
O=C([O-])c1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCCCC1	ZINC000003331300	132385154	/nfs/dbraw/zinc/38/51/54/132385154.db2.gz	VZMZTMZQLSMEJE-UHFFFAOYSA-N	-1	0	352.456	2.550	50	0		FFAARM
O=C([O-])[C@@H]1CC2(CN1C(=O)C1CC1)CCN(c1nccc3occc31)CC2	ZINC000072439643	136147603	/nfs/dbraw/zinc/14/76/03/136147603.db2.gz	FSVSPZWPZGVHLI-HNNXBMFYSA-N	-1	0	369.421	2.510	50	0		FFAARM
COCC[C@@]1(C(=O)[O-])CCCN(C(=O)CCCc2ccc(F)cc2)C1	ZINC000091755529	221794246	/nfs/dbraw/zinc/79/42/46/221794246.db2.gz	WZFLWXNKKCFLCI-IBGZPJMESA-N	-1	0	351.418	2.878	50	0		FFAARM
Cc1ccccc1[C@@H]1CN(C(=O)c2ccc3nccnc3c2)C[C@H]1C(=O)[O-]	ZINC000091943755	221816061	/nfs/dbraw/zinc/81/60/61/221816061.db2.gz	APYOGPUTHATKDZ-DLBZAZTESA-N	-1	0	361.401	2.879	50	0		FFAARM
COc1ccc(/C=C\C(=O)[O-])cc1S(=O)(=O)Nc1ccccc1F	ZINC000096742786	222129394	/nfs/dbraw/zinc/12/93/94/222129394.db2.gz	ZJFDESXYWKTMQT-CLFYSBASSA-N	-1	0	351.355	2.733	50	0		FFAARM
CCOc1ccc(N[C@H]2CC(=O)N(c3cccc(C(=O)[O-])c3)C2=O)cc1	ZINC000101274960	222266053	/nfs/dbraw/zinc/26/60/53/222266053.db2.gz	KCWHBKNMEQOJJT-INIZCTEOSA-N	-1	0	354.362	2.528	50	0		FFAARM
COc1cccc(NC(=O)c2c([O-])c3cccc4c3n(c2=O)CCC4)c1	ZINC000100298324	222240819	/nfs/dbraw/zinc/24/08/19/222240819.db2.gz	OUKJZZCBHCHUDY-UHFFFAOYSA-N	-1	0	350.374	2.914	50	0		FFAARM
O=c1c2[n-][nH]n(Cc3ccccc3Cl)c=2c(=O)n1-c1ccc(F)cc1	ZINC000101167826	222264681	/nfs/dbraw/zinc/26/46/81/222264681.db2.gz	RAELTFMPEFUALW-CABCVRRESA-N	-1	0	358.760	2.973	50	0		FFAARM
COCc1ccccc1NC(=O)c1ccc2c(c1)[n-]c(=S)n(C)c2=O	ZINC000103695391	222341381	/nfs/dbraw/zinc/34/13/81/222341381.db2.gz	PVKBXMIDIQZZBP-UHFFFAOYSA-N	-1	0	355.419	2.621	50	0		FFAARM
CCn1c(=O)c2ccc(C(=O)NCc3ccccc3F)cc2[n-]c1=S	ZINC000102176683	222290606	/nfs/dbraw/zinc/29/06/06/222290606.db2.gz	VGGSKABYBPEIHI-UHFFFAOYSA-N	-1	0	357.410	2.774	50	0		FFAARM
CCn1c(=O)c2ccc(C(=O)NCc3cccc(F)c3)cc2[n-]c1=S	ZINC000103063533	222319902	/nfs/dbraw/zinc/31/99/02/222319902.db2.gz	DUGGFLAEJINIBY-UHFFFAOYSA-N	-1	0	357.410	2.774	50	0		FFAARM
Cc1ccc(NS(=O)(=O)c2ccc(OCC(=O)[O-])cc2)c(Cl)c1	ZINC000032585896	506267086	/nfs/dbraw/zinc/26/70/86/506267086.db2.gz	OGQPQYKLISZOQY-UHFFFAOYSA-N	-1	0	355.799	2.913	50	0		FFAARM
CCOc1cc(/C=C2\SC(=O)N(C(C)C)C2=O)ccc1OCC(=O)[O-]	ZINC000002099817	506272647	/nfs/dbraw/zinc/27/26/47/506272647.db2.gz	DMYBNYPQJQOIKP-ZSOIEALJSA-N	-1	0	365.407	2.993	50	0		FFAARM
CC1=C(C)C[C@H](C(=O)[O-])[C@H](C(=O)Nc2sc3c(c2C(N)=O)CCC3)C1	ZINC000002821382	506296265	/nfs/dbraw/zinc/29/62/65/506296265.db2.gz	ZSIOQPWHGGVIDW-NEPJUHHUSA-N	-1	0	362.451	2.721	50	0		FFAARM
COCCCNC(=O)CCCCCn1c(=O)c2ccccc2[n-]c1=S	ZINC000002970317	506304740	/nfs/dbraw/zinc/30/47/40/506304740.db2.gz	BXIJMCHGVIHKRA-UHFFFAOYSA-N	-1	0	363.483	2.772	50	0		FFAARM
Cc1ccc(S(=O)(=O)[N-]C(=O)OC(C(F)(F)F)C(F)(F)F)cc1	ZINC000003149150	506310662	/nfs/dbraw/zinc/31/06/62/506310662.db2.gz	DMIFSFIBQCHQHI-UHFFFAOYSA-N	-1	0	365.251	2.903	50	0		FFAARM
O=C([O-])C1CCN(C(=O)N2C[C@H](c3ccccc3)Oc3cccnc32)CC1	ZINC000032918870	506312549	/nfs/dbraw/zinc/31/25/49/506312549.db2.gz	NPDZFXDZGFQORH-QGZVFWFLSA-N	-1	0	367.405	2.938	50	0		FFAARM
O=C([O-])[C@@H]1CC=CC[C@H]1C(=O)NCCc1csc(-c2cccnc2)n1	ZINC000004167062	506363550	/nfs/dbraw/zinc/36/35/50/506363550.db2.gz	FHDIIOLXXLEGLF-HUUCEWRRSA-N	-1	0	357.435	2.531	50	0		FFAARM
O=C([O-])CCCCCC[C@H]1C(=O)NC(=O)N1CC[C@@H](O)C1CCCCC1	ZINC000004257979	506368537	/nfs/dbraw/zinc/36/85/37/506368537.db2.gz	ZIDQIOZJEJFMOH-JKSUJKDBSA-N	-1	0	368.474	2.663	50	0	in-vitro	FFAARM
COC(=O)C[C@@H](NC(=O)C1=C(C(=O)[O-])CCCC1)c1cccc(C)c1C	ZINC000004551227	506382180	/nfs/dbraw/zinc/38/21/80/506382180.db2.gz	GOWYLTYMIOUSNS-QGZVFWFLSA-N	-1	0	359.422	2.979	50	0		FFAARM
COC(=O)C[C@H](NC(=O)C1=C(C(=O)[O-])CCCC1)c1cc(C)ccc1C	ZINC000004679310	506388819	/nfs/dbraw/zinc/38/88/19/506388819.db2.gz	KKJLCEPZVFXOSC-KRWDZBQOSA-N	-1	0	359.422	2.979	50	0		FFAARM
COc1ccc(C(N)=O)cc1[N-]S(=O)(=O)c1cccc2ccccc21	ZINC000035685899	506389409	/nfs/dbraw/zinc/38/94/09/506389409.db2.gz	KKNXRNTZJFADMQ-UHFFFAOYSA-N	-1	0	356.403	2.748	50	0		FFAARM
COC(=O)c1ccc([N-]S(=O)(=O)c2cc(Cl)ccc2OC)cc1	ZINC000004809475	506395845	/nfs/dbraw/zinc/39/58/45/506395845.db2.gz	DNTBUNNTKNTVTP-UHFFFAOYSA-N	-1	0	355.799	2.936	50	0		FFAARM
CC(C)C[C@H](NC(=O)/C(=C\c1ccco1)NC(=O)c1ccccc1)C(=O)[O-]	ZINC000005007853	506414489	/nfs/dbraw/zinc/41/44/89/506414489.db2.gz	ZWMRCGVPIXJDPG-MOKGIYGOSA-N	-1	0	370.405	2.666	50	0		FFAARM
COc1ccc(Nc2nnc(Cc3ccc(F)cc3)c(=O)[n-]2)cc1OC	ZINC000005154459	506426163	/nfs/dbraw/zinc/42/61/63/506426163.db2.gz	UFEUTTATPIHLBI-UHFFFAOYSA-N	-1	0	356.357	2.656	50	0		FFAARM
COc1cc([N-]S(=O)(=O)c2cccs2)ccc1N1CCCC1=O	ZINC000005329391	506435454	/nfs/dbraw/zinc/43/54/54/506435454.db2.gz	UVQPJPCBGLIAGX-UHFFFAOYSA-N	-1	0	352.437	2.684	50	0		FFAARM
CNC(=O)c1cc(S(=O)(=O)[N-]c2cccc(C(F)(F)F)c2)cs1	ZINC000006681545	506496713	/nfs/dbraw/zinc/49/67/13/506496713.db2.gz	LCFQTKCOXZELQT-UHFFFAOYSA-N	-1	0	364.370	2.927	50	0		FFAARM
CC1=C(C)C[C@@H](C(=O)N2CCN(Cc3ccc(F)cc3)CC2)[C@H](C(=O)[O-])C1	ZINC000006699448	506499121	/nfs/dbraw/zinc/49/91/21/506499121.db2.gz	BIWKGQZHLMGLGB-RTBURBONSA-N	-1	0	374.456	2.917	50	0		FFAARM
Cc1csc2nc(C)c(S(=O)(=O)[N-]c3ccc(Cl)cc3)c(=O)n12	ZINC000006823837	506510947	/nfs/dbraw/zinc/51/09/47/506510947.db2.gz	IJVXLVGPWMZRFO-UHFFFAOYSA-N	-1	0	369.855	2.827	50	0		FFAARM
COc1ccc2c(C)c(CCC(=O)N3CCCC[C@H]3C(=O)[O-])c(=O)oc2c1	ZINC000006921940	506517563	/nfs/dbraw/zinc/51/75/63/506517563.db2.gz	TYUFSXIBMQOPIZ-INIZCTEOSA-N	-1	0	373.405	2.508	50	0		FFAARM
COc1cc2c(cc1OC)CN(C(=O)Nc1cccc(C(=O)[O-])c1)CC2	ZINC000008764418	506667859	/nfs/dbraw/zinc/66/78/59/506667859.db2.gz	CFJVNKYWAWFJGK-UHFFFAOYSA-N	-1	0	356.378	2.992	50	0	biogenic	FFAARM
Cc1c(NCc2cccnc2)cccc1C(=O)N1CCC(C(=O)[O-])CC1	ZINC000055152833	506687171	/nfs/dbraw/zinc/68/71/71/506687171.db2.gz	RFPZNDZLOCSSGJ-UHFFFAOYSA-N	-1	0	353.422	2.939	50	0		FFAARM
COc1ccc(CNC(C)=O)cc1S(=O)(=O)[N-]c1cc(C)ccc1C	ZINC000055546059	506774365	/nfs/dbraw/zinc/77/43/65/506774365.db2.gz	GHCUUGQZLUPMPF-UHFFFAOYSA-N	-1	0	362.451	2.749	50	0		FFAARM
O=C([O-])c1cc2c(c(S(=O)(=O)Nc3cc(F)ccc3F)c1)CCC2	ZINC000055555048	506775239	/nfs/dbraw/zinc/77/52/39/506775239.db2.gz	FKBQIROBBKNDBQ-UHFFFAOYSA-N	-1	0	353.346	2.953	50	0		FFAARM
Cc1c(-c2cc(C(F)(F)F)nc(N3CCC[C@H](C(=O)[O-])C3)n2)cnn1C	ZINC000012357717	506853434	/nfs/dbraw/zinc/85/34/34/506853434.db2.gz	FBKHJUWWJBKNBG-JTQLQIEISA-N	-1	0	369.347	2.505	50	0		FFAARM
CC(=O)Nc1ccc(S(=O)(=O)[N-]c2cnc(-c3ccccc3)nc2)cc1	ZINC000012561181	506880670	/nfs/dbraw/zinc/88/06/70/506880670.db2.gz	MZXYEYSPKCZFGX-UHFFFAOYSA-N	-1	0	368.418	2.903	50	0		FFAARM
CCC(NCc1ccc(F)cc1)=C1C(=O)[N-]C(=O)N(c2ccccc2)C1=O	ZINC000020328134	507217471	/nfs/dbraw/zinc/21/74/71/507217471.db2.gz	HQNCTBVCKJHRKV-WUKNDPDISA-N	-1	0	367.380	2.862	50	0		FFAARM
CCC(NCc1ccco1)=C1C(=O)[N-]C(=O)N(c2ccc(C)cc2)C1=O	ZINC000020324764	507217491	/nfs/dbraw/zinc/21/74/91/507217491.db2.gz	IGCNIZRXDNXBIA-FOCLMDBBSA-N	-1	0	353.378	2.625	50	0		FFAARM
CS(=O)(=O)[N-]c1ccccc1C(=O)OCCCC(=O)c1ccccc1	ZINC000023043219	507327087	/nfs/dbraw/zinc/32/70/87/507327087.db2.gz	ZPBUXQNTFSJRNU-UHFFFAOYSA-N	-1	0	361.419	2.878	50	0		FFAARM
CCn1c(C)ccc(C(=O)N2CC[C@H](Cc3cccc(C(=O)[O-])c3)C2)c1=O	ZINC000072157277	507762778	/nfs/dbraw/zinc/76/27/78/507762778.db2.gz	DFDCYRGHFGVGCC-MRXNPFEDSA-N	-1	0	368.433	2.580	50	0		FFAARM
CC(C)(C)[C@H]1CCc2sc(C(=O)NCCCc3n[nH]c(=O)[n-]3)cc2C1	ZINC000072306790	507774416	/nfs/dbraw/zinc/77/44/16/507774416.db2.gz	HTISPNWTPNVPIN-LBPRGKRZSA-N	-1	0	362.499	2.673	50	0		FFAARM
O=C([O-])CCC(=O)N1N=C(c2ccc[nH]2)C[C@H]1c1cccc2nccnc21	ZINC000072314643	507776168	/nfs/dbraw/zinc/77/61/68/507776168.db2.gz	KVYIMHUCJQDULF-INIZCTEOSA-N	-1	0	363.377	2.500	50	0		FFAARM
O=C([O-])CCC(=O)N1N=C(c2ccco2)C[C@@H]1c1cccc2nccnc21	ZINC000072314725	507776279	/nfs/dbraw/zinc/77/62/79/507776279.db2.gz	XDJDNYNZDMUPSX-OAHLLOKOSA-N	-1	0	364.361	2.765	50	0		FFAARM
O=C([O-])CCc1cc2n(n1)CCN(Cc1ccc(-c3cccnc3)cc1)C2	ZINC000072421359	507787584	/nfs/dbraw/zinc/78/75/84/507787584.db2.gz	RVNJYYYHTCZQOP-UHFFFAOYSA-N	-1	0	362.433	2.978	50	0		FFAARM
CCOc1ccc(-c2ccnc(NCCc3c[nH]cn3)n2)cc1C(=O)[O-]	ZINC000072426677	507788715	/nfs/dbraw/zinc/78/87/15/507788715.db2.gz	SKLXADIHIHNUFC-UHFFFAOYSA-N	-1	0	353.382	2.618	50	0		FFAARM
Cc1ccc(F)c(OC2(C(=O)[O-])CCN(C(=O)[C@@H]3CC3(F)F)CC2)c1	ZINC000072428346	507788964	/nfs/dbraw/zinc/78/89/64/507788964.db2.gz	TUFHJDPQODKLIT-NSHDSACASA-N	-1	0	357.328	2.614	50	0		FFAARM
COc1cc2c(cc1CN1CCCn3nc(CCC(=O)[O-])cc3C1)CCC2	ZINC000072432893	507790584	/nfs/dbraw/zinc/79/05/84/507790584.db2.gz	CDXNFFWJJDWMNU-UHFFFAOYSA-N	-1	0	369.465	2.804	50	0		FFAARM
O=C([O-])c1cc(S(=O)(=O)Nc2c(O)cccc2F)cc(F)c1Cl	ZINC000089768192	507863632	/nfs/dbraw/zinc/86/36/32/507863632.db2.gz	LGVOCYPTODDJQZ-UHFFFAOYSA-N	-1	0	363.725	2.823	50	0		FFAARM
CCCO[C@@H]1CCCN(C(=O)c2ccc3c(c2)[n-]c(=S)[nH]c3=O)CC1	ZINC000108461507	507895612	/nfs/dbraw/zinc/89/56/12/507895612.db2.gz	FRTFQRIKMYQWEA-CYBMUJFWSA-N	-1	0	361.467	2.633	50	0		FFAARM
CCNC(=O)c1cccc(NC(=O)c2nn(-c3ccccc3)cc2[O-])c1	ZINC000073446456	507922557	/nfs/dbraw/zinc/92/25/57/507922557.db2.gz	RDCGLBLMQCKXLA-UHFFFAOYSA-N	-1	0	350.378	2.580	50	0		FFAARM
O=C1c2cccc3cc(S(=O)(=O)[O-])cc(c32)C(=O)N1Cc1ccccc1	ZINC000073658765	507943450	/nfs/dbraw/zinc/94/34/50/507943450.db2.gz	SXXUGQBAQSNRGE-UHFFFAOYSA-N	-1	0	367.382	2.883	50	0		FFAARM
Cc1cc(N2CCc3nnc(C(C)C)n3CC2)nc(-c2ccccc2[O-])n1	ZINC000091950533	508027065	/nfs/dbraw/zinc/02/70/65/508027065.db2.gz	YDKCBQREJMEARA-UHFFFAOYSA-N	-1	0	364.453	2.935	50	0		FFAARM
CCC[C@@]1(C(=O)[O-])CCCN(C(=O)c2c(C)nn3c2nc(C)cc3C)C1	ZINC000092037497	508035797	/nfs/dbraw/zinc/03/57/97/508035797.db2.gz	WXLXMXSXHMMIDW-LJQANCHMSA-N	-1	0	358.442	2.762	50	0		FFAARM
Cc1c[nH]c(CN(C)[C@@H](C(=O)[O-])c2ccc(NC(=O)N3CCCC3)cc2)n1	ZINC000095376917	508179598	/nfs/dbraw/zinc/17/95/98/508179598.db2.gz	VHTMSWGPHBRGQM-QGZVFWFLSA-N	-1	0	371.441	2.604	50	0		FFAARM
Cc1nn(C(F)F)c(C)c1CC(=O)N[C@H](CC(=O)[O-])c1cccs1	ZINC000095377503	508179931	/nfs/dbraw/zinc/17/99/31/508179931.db2.gz	VMJWLAIWSFCOPX-LLVKDONJSA-N	-1	0	357.382	2.831	50	0		FFAARM
Cc1nc2ncccn2c1C(=O)N1CCC[C@H](c2ccc(C(=O)[O-])cc2)C1	ZINC000095383104	508181550	/nfs/dbraw/zinc/18/15/50/508181550.db2.gz	UTDSCUBPHFFRMV-INIZCTEOSA-N	-1	0	364.405	2.756	50	0		FFAARM
CCCc1cc(C(=O)N2Cc3[nH]c4ccccc4c3C[C@H]2C(=O)[O-])no1	ZINC000095384025	508182287	/nfs/dbraw/zinc/18/22/87/508182287.db2.gz	NYFSYPOIEXUEFW-KRWDZBQOSA-N	-1	0	353.378	2.760	50	0		FFAARM
CCOc1ccc(NS(=O)(=O)c2ccc(OC)c(CC(=O)[O-])c2)cc1	ZINC000095459929	508186980	/nfs/dbraw/zinc/18/69/80/508186980.db2.gz	SJMKOLADSUYGBA-UHFFFAOYSA-N	-1	0	365.407	2.522	50	0		FFAARM
Cn1cc([C@@H]2SCC(=O)Nc3c2cnn3-c2ccc(C(=O)[O-])cc2)cn1	ZINC000095472488	508188304	/nfs/dbraw/zinc/18/83/04/508188304.db2.gz	ORRLOZCDRVJJSX-HNNXBMFYSA-N	-1	0	369.406	2.728	50	0		FFAARM
COc1nc2c(cc1C(=O)N1CCc3ccccc3[C@H]1CC(=O)[O-])CCC2	ZINC000095512865	508193335	/nfs/dbraw/zinc/19/33/35/508193335.db2.gz	FDGCOLAFSSPRCX-GOSISDBHSA-N	-1	0	366.417	2.793	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)c1ccc(NC(=O)c2cccs2)cc1)C1CC1	ZINC000095970326	508200062	/nfs/dbraw/zinc/20/00/62/508200062.db2.gz	CHYJEKLMTLORRL-AWEZNQCLSA-N	-1	0	358.419	2.984	50	0		FFAARM
CC(=O)c1cc(S(=O)(=O)[N-]c2cnc3n[nH]c(C)c3c2)ccc1Cl	ZINC000095977793	508200133	/nfs/dbraw/zinc/20/01/33/508200133.db2.gz	HRXKJFFDSFFWNS-UHFFFAOYSA-N	-1	0	364.814	2.923	50	0		FFAARM
O=S(=O)([N-]c1cnc(N2CCCC2)nc1)c1ccc(C(F)(F)F)cc1	ZINC000077196695	508285612	/nfs/dbraw/zinc/28/56/12/508285612.db2.gz	BHKWJLBLUCYUTQ-UHFFFAOYSA-N	-1	0	372.372	2.896	50	0		FFAARM
CC(=O)N(c1nc(/C=C2/NC(=S)NC2=O)cs1)c1c(C)cccc1C	ZINC000105417134	508373506	/nfs/dbraw/zinc/37/35/06/508373506.db2.gz	PLKFOECUKGZUQN-NTUHNPAUSA-N	-1	0	372.475	2.790	50	0		FFAARM
C[C@H](Cc1cccc(F)c1)C(=O)N1CCC[C@H](n2cc(C(=O)[O-])cn2)C1	ZINC000153230546	508561221	/nfs/dbraw/zinc/56/12/21/508561221.db2.gz	ACNZSOQUDRAGFD-DYVFJYSZSA-N	-1	0	359.401	2.763	50	0		FFAARM
CC(C)CC(=O)Nc1ccc(C(=O)N2CCCC[C@H]2C(=O)[O-])cc1F	ZINC000159886209	508906469	/nfs/dbraw/zinc/90/64/69/508906469.db2.gz	HCOYKVNEUQUEME-HNNXBMFYSA-N	-1	0	350.390	2.890	50	0		FFAARM
CC(C)[C@@H](NC(=O)[C@@H]1CCN(c2cc(Cl)cc(Cl)c2)C1=O)C(=O)[O-]	ZINC000156333068	509160915	/nfs/dbraw/zinc/16/09/15/509160915.db2.gz	QAHIZXXELNEUIM-QWHCGFSZSA-N	-1	0	373.236	2.572	50	0		FFAARM
O=C(/C=C\c1cc2c(c(Cl)c1)OCO2)[N-]S(=O)(=O)c1cccs1	ZINC000222094382	509310321	/nfs/dbraw/zinc/31/03/21/509310321.db2.gz	RLDPWKQKVWTTBG-ARJAWSKDSA-N	-1	0	371.823	2.649	50	0		FFAARM
O=C([O-])CCC(=O)N1N=C(c2ccco2)C[C@@H]1c1cnc2ccccc2n1	ZINC000225510217	509374276	/nfs/dbraw/zinc/37/42/76/509374276.db2.gz	WRACSHHHGATZRP-MRXNPFEDSA-N	-1	0	364.361	2.765	50	0		FFAARM
CN(C)c1ccc(NS(=O)(=O)c2cc(F)cc(F)c2)c(C(=O)[O-])c1	ZINC000225584104	509376989	/nfs/dbraw/zinc/37/69/89/509376989.db2.gz	MYDQOWCHOPFANG-UHFFFAOYSA-N	-1	0	356.350	2.530	50	0		FFAARM
CN(C)c1ccc([N-]S(=O)(=O)c2cc3c(cc2Cl)CCC3=O)cn1	ZINC000225753165	509387842	/nfs/dbraw/zinc/38/78/42/509387842.db2.gz	YWLPNAKJQXGXIF-UHFFFAOYSA-N	-1	0	365.842	2.731	50	0		FFAARM
C[C@H]1CN(Cc2ccc(C(=O)NC3CCC(C(=O)[O-])CC3)cc2)C[C@H](C)O1	ZINC000237627426	509693562	/nfs/dbraw/zinc/69/35/62/509693562.db2.gz	BGOMWBUOUBRHSJ-GKVPXEHWSA-N	-1	0	374.481	2.669	50	0		FFAARM
Cc1ccc(-n2nnc(C(=O)NC3CCC(C(=O)[O-])CC3)c2C2CC2)cc1	ZINC000170672335	509711667	/nfs/dbraw/zinc/71/16/67/509711667.db2.gz	DNPVTZJXBGGYDS-UHFFFAOYSA-N	-1	0	368.437	2.826	50	0		FFAARM
Cc1[nH]c2ccc(F)cc2c1CC(=O)N(CCC(=O)[O-])C[C@H]1CCCO1	ZINC000237699768	509713793	/nfs/dbraw/zinc/71/37/93/509713793.db2.gz	ZHVJLBHNHNUPLA-CQSZACIVSA-N	-1	0	362.401	2.640	50	0		FFAARM
Cc1nc(COc2cccc(/C=C/C(=O)N3CC[C@@H](C(=O)[O-])C3)c2)cs1	ZINC000237758782	509728122	/nfs/dbraw/zinc/72/81/22/509728122.db2.gz	VAPRWQWJYSLSOV-LLYBFZRZSA-N	-1	0	372.446	2.977	50	0		FFAARM
O=C([O-])[C@@H]1CCN(C(=O)CCCOc2ccccc2Br)C1	ZINC000237947449	509781757	/nfs/dbraw/zinc/78/17/57/509781757.db2.gz	LYBIBKRTIZCOSQ-LLVKDONJSA-N	-1	0	356.216	2.541	50	0		FFAARM
O=C([O-])CC[C@H]1CCCCN1C(=O)c1cccc(CN2CCCC2=O)c1	ZINC000237995873	509794611	/nfs/dbraw/zinc/79/46/11/509794611.db2.gz	SYRVUPCVJSRDLK-QGZVFWFLSA-N	-1	0	358.438	2.669	50	0		FFAARM
O=C([O-])CC[C@H]1CCCCN1C(=O)c1cc(N2CCCC2=O)ccc1F	ZINC000237993330	509794633	/nfs/dbraw/zinc/79/46/33/509794633.db2.gz	ZTVLMXCEHBAUBZ-CYBMUJFWSA-N	-1	0	362.401	2.812	50	0		FFAARM
Cc1onc(OC(F)F)c1[N-]C(=O)c1cnn(-c2ccc(F)cc2)n1	ZINC000253432527	509882573	/nfs/dbraw/zinc/88/25/73/509882573.db2.gz	KXDCEVRTXZCFID-UHFFFAOYSA-N	-1	0	353.260	2.557	50	0		FFAARM
CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)NCc1cc(C(=O)[O-])c(C)o1	ZINC000262992855	510511702	/nfs/dbraw/zinc/51/17/02/510511702.db2.gz	OOFIBGBGXFIXHI-GOSISDBHSA-N	-1	0	368.389	2.867	50	0		FFAARM
CCc1ocnc1C(=O)N(CC(=O)[O-])Cc1cccc(Br)c1	ZINC000263181552	510599626	/nfs/dbraw/zinc/59/96/26/510599626.db2.gz	LQKMROHWLMRPIP-UHFFFAOYSA-N	-1	0	367.199	2.727	50	0		FFAARM
CC(C)n1c2ccccc2nc1[C@H](C)NC(=O)c1cnc(C(=O)[O-])cn1	ZINC000263297946	510650204	/nfs/dbraw/zinc/65/02/04/510650204.db2.gz	SYFNLYYYGUMXQI-NSHDSACASA-N	-1	0	353.382	2.596	50	0		FFAARM
O=C([O-])[C@H]1CN(C(=O)c2ccc(Oc3ccc(F)cc3F)cc2)CCO1	ZINC000408513467	513083559	/nfs/dbraw/zinc/08/35/59/513083559.db2.gz	SAQVZGVFKOVJPQ-MRXNPFEDSA-N	-1	0	363.316	2.683	50	0		FFAARM
O=C([O-])c1cccc(C[C@H]2CCN(C(=O)c3onc4c3CCCC4)C2)c1	ZINC000426701780	514019007	/nfs/dbraw/zinc/01/90/07/514019007.db2.gz	YDKMOHJSYGGQSI-CQSZACIVSA-N	-1	0	354.406	2.956	50	0		FFAARM
O=C([O-])Cn1ccc([C@H]2CCCN(C(=O)c3ccnc4ccccc43)C2)n1	ZINC000426705560	514019386	/nfs/dbraw/zinc/01/93/86/514019386.db2.gz	COQKAGVRQPOLCO-AWEZNQCLSA-N	-1	0	364.405	2.536	50	0		FFAARM
CC(C)CN(C(=O)c1cnc(C(=O)[O-])cn1)[C@@H]1CCCc2cccnc21	ZINC000455780512	514734066	/nfs/dbraw/zinc/73/40/66/514734066.db2.gz	KRLAAMNNIWRXGZ-MRXNPFEDSA-N	-1	0	354.410	2.746	50	0		FFAARM
O=S(=O)([N-]C[C@H](c1ccsc1)n1cccn1)c1c(F)cccc1F	ZINC000575613912	518236453	/nfs/dbraw/zinc/23/64/53/518236453.db2.gz	LRMPSBKSHKNVKV-CQSZACIVSA-N	-1	0	369.418	2.791	50	0		FFAARM
CN(C[C@@H]1OCCN(C)[C@H]1c1ccccc1)C(=O)c1ccc(C(=O)[O-])cc1	ZINC000574039219	518957922	/nfs/dbraw/zinc/95/79/22/518957922.db2.gz	AVMKEVUWHXLVOX-OALUTQOASA-N	-1	0	368.433	2.529	50	0		FFAARM
O=C([O-])[C@H]1CN(C(=O)/C(=C\c2ccc(F)cc2)c2cccs2)CCO1	ZINC000606441352	521068891	/nfs/dbraw/zinc/06/88/91/521068891.db2.gz	PZWFEKKJSPBYNS-BAAYTWLHSA-N	-1	0	361.394	2.740	50	0		FFAARM
COC1CC(C(=O)N[C@H](CC(=O)[O-])c2ccc(Br)cc2)C1	ZINC000630123560	522635245	/nfs/dbraw/zinc/63/52/45/522635245.db2.gz	CUAGJUFQBPLLNP-KGPNIALWSA-N	-1	0	356.216	2.506	50	0		FFAARM
O=C([O-])c1ccc2[nH]c3c(c2c1)CN(C(=O)[C@]12CCC[C@H]1OCC2)CC3	ZINC000630134870	522644939	/nfs/dbraw/zinc/64/49/39/522644939.db2.gz	DPSHCCDVIHFULF-XLIONFOSSA-N	-1	0	354.406	2.710	50	0		FFAARM
Cc1nn(CCC(=O)[O-])c(C)c1NC(=O)[C@@H]1C[C@H]1c1ccc(F)c(F)c1	ZINC000630331947	522795276	/nfs/dbraw/zinc/79/52/76/522795276.db2.gz	RMZPZWJNSVLQNB-QWHCGFSZSA-N	-1	0	363.364	2.995	50	0		FFAARM
O=C([O-])c1cccc2c1CCN(C(=O)c1cccc(N3CCCC3=O)c1)C2	ZINC000621578560	522943833	/nfs/dbraw/zinc/94/38/33/522943833.db2.gz	VHPVFCYBAVMWMX-UHFFFAOYSA-N	-1	0	364.401	2.710	50	0		FFAARM
CN1C(=O)C[C@@H](C(=O)N[C@H](CC(=O)[O-])c2cccs2)c2ccccc21	ZINC000299746322	523699073	/nfs/dbraw/zinc/69/90/73/523699073.db2.gz	WQUOUMIJEYJKJL-CHWSQXEVSA-N	-1	0	358.419	2.530	50	0		FFAARM
COc1ccc(Nc2ccccc2C(=O)N2CCO[C@@H](CC(=O)[O-])C2)cc1	ZINC000269061527	524714651	/nfs/dbraw/zinc/71/46/51/524714651.db2.gz	ZWRDGHZJEQTDKP-INIZCTEOSA-N	-1	0	370.405	2.755	50	0		FFAARM
O=C([O-])c1cccc(CNC(=O)[C@H]2C[C@H]2c2ccc3c(c2)OCCO3)c1	ZINC000299745946	526389566	/nfs/dbraw/zinc/38/95/66/526389566.db2.gz	UFKDTKSPSRUQJR-HOTGVXAUSA-N	-1	0	353.374	2.576	50	0		FFAARM
Cc1ccc(NC(=O)c2c[n-]n3c2nc(C)cc3=O)c(Br)c1	ZINC000102905497	570841379	/nfs/dbraw/zinc/84/13/79/570841379.db2.gz	QYLVZDSOWNBYAB-UHFFFAOYSA-N	-1	0	361.199	2.654	50	0		FFAARM
COc1ccc(C(N)=O)cc1[N-]S(=O)(=O)c1ccccc1C(F)(F)F	ZINC000048355006	570950413	/nfs/dbraw/zinc/95/04/13/570950413.db2.gz	SUHZNPUEPWYIMS-UHFFFAOYSA-N	-1	0	374.340	2.614	50	0		FFAARM
COc1ccc2c(c1)ncc(C(=O)NC[C@@H]1COc3ccccc3C1)c2O	ZINC000083970196	571063455	/nfs/dbraw/zinc/06/34/55/571063455.db2.gz	BRYQJFOHEQNISC-CYBMUJFWSA-N	-1	0	364.401	2.518	50	0		FFAARM
O=C([O-])[C@H]1CN(S(=O)(=O)c2ccc(Cl)nc2Cl)c2ccccc21	ZINC000170633440	571130080	/nfs/dbraw/zinc/13/00/80/571130080.db2.gz	RLFLNZDCJRDYSX-VIFPVBQESA-N	-1	0	373.217	2.766	50	0		FFAARM
Cc1nn(CC(=O)Nc2ccc(Br)cc2)c(C)c1C(=O)[O-]	ZINC000036778157	571149585	/nfs/dbraw/zinc/14/95/85/571149585.db2.gz	WQYJFBVOFUSHMV-UHFFFAOYSA-N	-1	0	352.188	2.599	50	0		FFAARM
Cc1cccc(C[C@@H](CNC(=O)c2ccc3c(c2)CCC(=O)N3)C(=O)[O-])c1	ZINC000123806036	571191147	/nfs/dbraw/zinc/19/11/47/571191147.db2.gz	ZUGOMWKBGGVHHO-KRWDZBQOSA-N	-1	0	366.417	2.553	50	0		FFAARM
CCC1CCC(NC(=O)c2cc(OC)c(OC)cc2F)(C(=O)[O-])CC1	ZINC000262055352	571275981	/nfs/dbraw/zinc/27/59/81/571275981.db2.gz	AOYADQOEYNHABR-UHFFFAOYSA-N	-1	0	353.390	2.996	50	0		FFAARM
CC[C@H](C)N(CC(=O)[O-])C(=O)c1csc(I)c1	ZINC000123378053	728658136	/nfs/dbraw/zinc/65/81/36/728658136.db2.gz	USKRXDZLBUYIPD-ZETCQYMHSA-N	-1	0	367.208	2.678	50	0		FFAARM
CC(C)(C)NC(=O)CN1CCN(Cc2c(Cl)ccc([O-])c2Cl)CC1	ZINC000952987472	740473024	/nfs/dbraw/zinc/47/30/24/740473024.db2.gz	IACHSKBYKUHUNR-UHFFFAOYSA-N	-1	0	374.312	2.731	50	0		FFAARM
Cc1ccc(OC2CCN(C(=O)c3n[n-]c4ccccc4c3=O)CC2)cc1	ZINC000116981047	960551626	/nfs/dbraw/zinc/55/16/26/960551626.db2.gz	AKXICMYBBCOUES-UHFFFAOYSA-N	-1	0	363.417	2.915	50	0		FFAARM
Cc1c(C(=O)[O-])sc2[nH]cnc(=N[C@H]3C[C@@H](CO)c4ccccc43)c12	ZINC000952876053	1011005813	/nfs/dbraw/zinc/00/58/13/1011005813.db2.gz	ZTNFTAHQYOQDIS-GWCFXTLKSA-N	-1	0	355.419	2.753	50	0		FFAARM
Cc1c(C(=O)Nc2ccc(Oc3nn[nH]n3)cc2)n[nH]c1-c1ccccc1	ZINC000952984346	1011039431	/nfs/dbraw/zinc/03/94/31/1011039431.db2.gz	KMFHTADVIQKALJ-UHFFFAOYSA-N	-1	0	361.365	2.943	50	0		FFAARM
O=C(Nc1cccc(N2CCCCC2=O)c1)c1n[n-]c2ccccc2c1=O	ZINC000111563480	1011328480	/nfs/dbraw/zinc/32/84/80/1011328480.db2.gz	WFLXZPFMTQEBJA-UHFFFAOYSA-N	-1	0	362.389	2.692	50	0		FFAARM
O=C([O-])c1ccccc1C1CCN(C(=O)Nc2ccc3ncnn3c2)CC1	ZINC000669507336	1027965537	/nfs/dbraw/zinc/96/55/37/1027965537.db2.gz	WFPVWYXKEKFOIR-UHFFFAOYSA-N	-1	0	365.393	2.839	50	0		FFAARM
Cc1cccc(NC(=O)CC(=O)N[C@@H](CC(=O)[O-])c2ccccc2)c1C	ZINC001506396063	1059489785	/nfs/dbraw/zinc/48/97/85/1059489785.db2.gz	BDQFRVJPZJLISN-KRWDZBQOSA-N	-1	0	354.406	2.964	50	0		FFAARM
CN(C[C@@H]1CCN(c2ccccc2)C1)C(=O)c1[n-]c(=O)nc2ccccc21	ZINC001506427358	1059515483	/nfs/dbraw/zinc/51/54/83/1059515483.db2.gz	XTKPMVMRDWDIQS-HNNXBMFYSA-N	-1	0	362.433	2.934	50	0		FFAARM
O=C([O-])c1cnc(N2CC[C@@](O)(c3ccccc3)[C@H]3CCCC[C@H]32)cn1	ZINC001529187001	1062211118	/nfs/dbraw/zinc/21/11/18/1062211118.db2.gz	NUHVPSSQRUGHPW-XAUMDUMWSA-N	-1	0	353.422	2.832	50	0		FFAARM
CC(=O)[N-]S(=O)(=O)c1ccc(NC(=O)c2ccc(C(C)C)cc2)cc1	ZINC000000669745	210258959	/nfs/dbraw/zinc/25/89/59/210258959.db2.gz	PQHIIPQMNSYZNV-UHFFFAOYSA-N	-1	0	360.435	2.887	50	0		FFAARM
COC(=O)c1c(N)n(-c2ccc(C(=O)[O-])cc2)c2nc3ccccc3nc21	ZINC000000636262	210254735	/nfs/dbraw/zinc/25/47/35/210254735.db2.gz	ZCHXWRCUBRKXLO-UHFFFAOYSA-N	-1	0	362.345	2.641	50	0		FFAARM
COc1cc(N2C(=O)c3ccc(C(=O)[O-])cc3C2=O)c(OC)cc1Cl	ZINC000000629992	210253077	/nfs/dbraw/zinc/25/30/77/210253077.db2.gz	BBBLGNDYZZMVSP-UHFFFAOYSA-N	-1	0	361.737	2.856	50	0		FFAARM
COc1ccc(CC(=O)c2cc(OC)c(OC)cc2CC(=O)[O-])cc1OC	ZINC000001205899	210224000	/nfs/dbraw/zinc/22/40/00/210224000.db2.gz	MGTCSBXFQWXQDZ-UHFFFAOYSA-N	-1	0	374.389	2.774	50	0	biogenic	FFAARM
O=C([O-])c1ccc(O[C@@H]2COCC[C@H]2NC(=O)CCc2ccccc2)cc1	ZINC000219180137	222696375	/nfs/dbraw/zinc/69/63/75/222696375.db2.gz	JGOIGMYNZIGXHR-RTBURBONSA-N	-1	0	369.417	2.670	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)c2cn(Cc3ccccc3)c3ccccc23)CCO1	ZINC000328594726	210109476	/nfs/dbraw/zinc/10/94/76/210109476.db2.gz	AKEXRYUDGSQVCB-IBGZPJMESA-N	-1	0	364.401	2.615	50	0		FFAARM
Cc1nc(COc2cccc(C(=O)N3CCC[C@@H](C(=O)[O-])C3)c2)cs1	ZINC000133061794	210071414	/nfs/dbraw/zinc/07/14/14/210071414.db2.gz	RWTURHFTXOECDT-CQSZACIVSA-N	-1	0	360.435	2.967	50	0		FFAARM
O=C([O-])[C@@H]1CCCN(C(=O)Cc2csc(Cc3ccc(F)cc3)n2)C1	ZINC000128530190	210066893	/nfs/dbraw/zinc/06/68/93/210066893.db2.gz	UUEAHJYXOPXGJN-CYBMUJFWSA-N	-1	0	362.426	2.739	50	0		FFAARM
Cc1ccc2[nH]cc(CCC(=O)N(CCC(=O)[O-])C3CCOCC3)c2c1	ZINC000237859903	222910783	/nfs/dbraw/zinc/91/07/83/222910783.db2.gz	BOMUKWJLROBGDE-UHFFFAOYSA-N	-1	0	358.438	2.891	50	0		FFAARM
O=C([O-])[C@@H]1CCCC[C@@H]1C(=O)NCCc1csc(-c2cccnc2)n1	ZINC000004167056	219551243	/nfs/dbraw/zinc/55/12/43/219551243.db2.gz	IFNJJJMFBFRHGX-LSDHHAIUSA-N	-1	0	359.451	2.755	50	0		FFAARM
CNC(=O)c1cccc(NC(=O)c2ccc3c(c2)[n-]c(=S)[nH]c3=O)c1C	ZINC000063809892	212033435	/nfs/dbraw/zinc/03/34/35/212033435.db2.gz	GSRXKERKQSSPHG-UHFFFAOYSA-N	-1	0	368.418	2.918	50	0		FFAARM
O=C([O-])[C@H]1CC=CC[C@@H]1C(=O)Nc1cccc(I)c1	ZINC000013012563	220054228	/nfs/dbraw/zinc/05/42/28/220054228.db2.gz	HUTIEOAQYBWKQB-RYUDHWBXSA-N	-1	0	371.174	2.897	50	0		FFAARM
COc1ccc(NS(=O)(=O)c2ccc(Cl)c(C(=O)[O-])c2)cc1OC	ZINC000013340839	220064395	/nfs/dbraw/zinc/06/43/95/220064395.db2.gz	WYNWVUXHQBFGRB-UHFFFAOYSA-N	-1	0	371.798	2.856	50	0		FFAARM
Cc1oc(CN(C)C(=O)c2cc(C)ccc2N2CCCC2=O)cc1C(=O)[O-]	ZINC000299751695	211834334	/nfs/dbraw/zinc/83/43/34/211834334.db2.gz	RIEJYXWZTAAMRT-UHFFFAOYSA-N	-1	0	370.405	2.994	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)c2ccc(-c3cccc(Cl)c3)s2)CCO1	ZINC000299750625	211834375	/nfs/dbraw/zinc/83/43/75/211834375.db2.gz	ODFBXEBXWYBAJY-LBPRGKRZSA-N	-1	0	351.811	2.994	50	0		FFAARM
CCS(=O)(=O)c1ccc([N-]S(=O)(=O)c2cccc(Cl)c2)cc1	ZINC000014097492	220106121	/nfs/dbraw/zinc/10/61/21/220106121.db2.gz	AGVYLNDPEIFMKN-UHFFFAOYSA-N	-1	0	359.856	2.934	50	0		FFAARM
Cc1ccc(S(=O)(=O)[N-]c2nc(CCC(=O)NC(C)C)cs2)cc1	ZINC000016848647	220196017	/nfs/dbraw/zinc/19/60/17/220196017.db2.gz	OTJNLJYURROIMY-UHFFFAOYSA-N	-1	0	367.496	2.710	50	0		FFAARM
O=C([O-])CCC(=O)Nc1ccc2[nH]cc([C@@H](C(=O)[O-])[NH+]3CCCCC3)c2c1	ZINC000031819099	211537153	/nfs/dbraw/zinc/53/71/53/211537153.db2.gz	LCCVPSDKNHVBSN-SFHVURJKSA-N	-1	0	373.409	2.583	50	0		FFAARM
COc1ccc(-c2nc(CC(=O)N3CCC[C@H](C(=O)[O-])C3)cs2)cc1	ZINC000020729762	211292855	/nfs/dbraw/zinc/29/28/55/211292855.db2.gz	MOEMNSUGKKKAIB-ZDUSSCGKSA-N	-1	0	360.435	2.684	50	0		FFAARM
Cc1cc(C)c2c(nn3c2nc(-c2ccc4c(c2)OCO4)cc3C(=O)[O-])n1	ZINC000020615719	211291814	/nfs/dbraw/zinc/29/18/14/211291814.db2.gz	PJBNXBKVUPREBI-UHFFFAOYSA-N	-1	0	362.345	2.988	50	0		FFAARM
CCOC(=O)c1c(C)[nH]c(C)c1S(=O)(=O)[N-]c1cccc(OC)c1	ZINC000020574828	211287004	/nfs/dbraw/zinc/28/70/04/211287004.db2.gz	IQNITOMCOOQQFA-UHFFFAOYSA-N	-1	0	352.412	2.618	50	0		FFAARM
O=C([O-])c1ccc(-n2nnnc2S[C@H]2CCc3ccccc3C2=O)cc1	ZINC000019854053	211259256	/nfs/dbraw/zinc/25/92/56/211259256.db2.gz	JQIKWMYIJCMFGO-HNNXBMFYSA-N	-1	0	366.402	2.650	50	0		FFAARM
Cn1cnnc1Sc1ccccc1[N-]S(=O)(=O)c1ccc(F)cc1	ZINC000014095981	211073039	/nfs/dbraw/zinc/07/30/39/211073039.db2.gz	JBRGOZJSHQQCKT-UHFFFAOYSA-N	-1	0	364.427	2.906	50	0		FFAARM
O=C([O-])c1ccc(NC(=O)c2cccc(NC(=O)[C@@H]3CCCO3)c2)cc1	ZINC000013843266	211062625	/nfs/dbraw/zinc/06/26/25/211062625.db2.gz	DRMKYSZOZMGCJZ-INIZCTEOSA-N	-1	0	354.362	2.755	50	0		FFAARM
COc1ccc([C@H](CC(=O)[O-])NC(=O)[C@@H]2COc3ccccc3C2)cc1	ZINC000013427429	211033208	/nfs/dbraw/zinc/03/32/08/211033208.db2.gz	VPVQFLCASGYOGY-RDJZCZTQSA-N	-1	0	355.390	2.579	50	0		FFAARM
Cc1ccc(CNC(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)[O-])cc1	ZINC000013235038	211028055	/nfs/dbraw/zinc/02/80/55/211028055.db2.gz	MDFHEEVKXVMNJK-GOSISDBHSA-N	-1	0	351.406	2.971	50	0		FFAARM
CC(=O)N1CCc2cc(C(=O)Nc3ccc(/C=C/C(=O)[O-])cc3)ccc21	ZINC000012813519	210996498	/nfs/dbraw/zinc/99/64/98/210996498.db2.gz	MNTFUVZWCZSMFT-RUDMXATFSA-N	-1	0	350.374	2.946	50	0		FFAARM
COC(=O)[C@@]([N-]c1nc2ccc(OC)cc2s1)(OC)C(F)(F)F	ZINC000012371494	210947172	/nfs/dbraw/zinc/94/71/72/210947172.db2.gz	ZABXHLJORLQINY-GFCCVEGCSA-N	-1	0	350.318	2.795	50	0		FFAARM
CCOc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccccc4C)c=3c2=O)cc1	ZINC000006770412	210699024	/nfs/dbraw/zinc/69/90/24/210699024.db2.gz	VIOVSNWSXDKUJK-QZTJIDSGSA-N	-1	0	364.405	2.887	50	0		FFAARM
Cc1ccc(C)c(N2C(=O)C[C@@H](Sc3ncccc3C(=O)[O-])C2=O)c1	ZINC000005016022	210591654	/nfs/dbraw/zinc/59/16/54/210591654.db2.gz	MLFBMSCZWHSUBW-CQSZACIVSA-N	-1	0	356.403	2.821	50	0		FFAARM
NC(=O)c1c(NC(=O)[C@@H]2CC=CC[C@@H]2C(=O)[O-])sc2c1CCCCC2	ZINC000004019126	210503865	/nfs/dbraw/zinc/50/38/65/210503865.db2.gz	MAVGXAKPWNROPG-MNOVXSKESA-N	-1	0	362.451	2.721	50	0		FFAARM
O=C(COC(=O)[C@@H]([N-]C(=O)C(F)(F)F)c1ccccc1)c1ccccc1	ZINC000002051784	210376403	/nfs/dbraw/zinc/37/64/03/210376403.db2.gz	BCHNFCADPMRYPL-HNNXBMFYSA-N	-1	0	365.307	2.832	50	0		FFAARM
Cc1coc2cc3oc(=O)c(CC(=O)NCCCC(=O)[O-])c(C)c3cc12	ZINC000002153097	210382048	/nfs/dbraw/zinc/38/20/48/210382048.db2.gz	BFMZOWKCANXADJ-UHFFFAOYSA-N	-1	0	357.362	2.680	50	0	biogenic	FFAARM
O=C([O-])c1nn(Cc2ncc(-c3ccc(F)cc3)o2)c(=O)c2ccccc21	ZINC000010485051	210371793	/nfs/dbraw/zinc/37/17/93/210371793.db2.gz	DYTWNQCATLCVFF-UHFFFAOYSA-N	-1	0	365.320	2.937	50	0		FFAARM
O=C([O-])[C@@H]1COCCN1C(=O)OCC1c2ccccc2-c2ccccc21	ZINC000001420802	210351659	/nfs/dbraw/zinc/35/16/59/210351659.db2.gz	CJVIYWXADATNKP-SFHVURJKSA-N	-1	0	353.374	2.721	50	0		FFAARM
Cc1cc(C)nc([N-]c2nc(CC(=O)NCc3ccccn3)cs2)n1	ZINC000049029475	221017167	/nfs/dbraw/zinc/01/71/67/221017167.db2.gz	XJQVDHBPEVXCNZ-UHFFFAOYSA-N	-1	0	354.439	2.547	50	0		FFAARM
O=c1ccc(=O)n(CCn2cnc(-c3ccccc3)c2-c2cccs2)[n-]1	ZINC000065393622	221210281	/nfs/dbraw/zinc/21/02/81/221210281.db2.gz	MFCUWRDVSHOGDK-UHFFFAOYSA-N	-1	0	364.430	2.829	50	0		FFAARM
Cc1ccc(F)cc1[N-]S(=O)(=O)c1cc2n(c1)CCN(C(C)C)C2=O	ZINC000065254780	221189195	/nfs/dbraw/zinc/18/91/95/221189195.db2.gz	FHAQTCPNORGGPQ-UHFFFAOYSA-N	-1	0	365.430	2.601	50	0		FFAARM
Cc1c(C(=O)[O-])nnn1-c1cccc2c1CCN(Cc1ccccc1F)C2	ZINC000068592023	221316679	/nfs/dbraw/zinc/31/66/79/221316679.db2.gz	FLXCKPSGWXTNIF-UHFFFAOYSA-N	-1	0	366.396	2.971	50	0		FFAARM
CC1(C)[C@H](C(=O)[O-])[C@@H]1C(=O)Nc1cccc(C(=O)Nc2ccccn2)c1	ZINC000071285789	221339226	/nfs/dbraw/zinc/33/92/26/221339226.db2.gz	ZGQUQGRADZIJNE-CABCVRRESA-N	-1	0	353.378	2.629	50	0		FFAARM
CC1(C)[C@H](C(=O)[O-])[C@@H]1C(=O)Nc1cccc(C(=O)Nc2nccs2)c1	ZINC000071288998	221340143	/nfs/dbraw/zinc/34/01/43/221340143.db2.gz	ARNXSRIUXBYBEV-NEPJUHHUSA-N	-1	0	359.407	2.691	50	0		FFAARM
CC1(C)[C@H](C(=O)[O-])[C@@H]1C(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1	ZINC000071288311	221340722	/nfs/dbraw/zinc/34/07/22/221340722.db2.gz	RTRMKBSREUZDMA-OLZOCXBDSA-N	-1	0	350.802	2.528	50	0		FFAARM
COc1cc(OC)c(NC(=O)C[C@]2(C(=O)[O-])CCSC2)cc1Cl	ZINC000071846833	221382525	/nfs/dbraw/zinc/38/25/25/221382525.db2.gz	DDVXZIIBPVPLNW-OAHLLOKOSA-N	-1	0	359.831	2.894	50	0		FFAARM
CC(=O)N1CC2(C[C@H]1C(=O)[O-])CCN(c1nccc3ccccc31)CC2	ZINC000082115787	132195796	/nfs/dbraw/zinc/19/57/96/132195796.db2.gz	AQOOSOYOAPGSFN-KRWDZBQOSA-N	-1	0	353.422	2.527	50	0		FFAARM
CC(C)Oc1ccccc1[C@H](C(=O)[O-])N1CCN(c2ccccn2)CC1	ZINC000095379988	132209486	/nfs/dbraw/zinc/20/94/86/132209486.db2.gz	DHQWWAJXVIJZTR-LJQANCHMSA-N	-1	0	355.438	2.817	50	0		FFAARM
O=C([O-])C[C@H](CC(=O)N1CCN(c2ccccc2)CC1)c1ccccc1	ZINC000226748879	132288077	/nfs/dbraw/zinc/28/80/77/132288077.db2.gz	SPUMLYWIFHNHPN-SFHVURJKSA-N	-1	0	352.434	2.984	50	0		FFAARM
O=C([O-])c1ccccc1CC(=O)N1CCN(c2cccc(Cl)c2)CC1	ZINC000072400883	132377707	/nfs/dbraw/zinc/37/77/07/132377707.db2.gz	IKDFFEVAHZQLPL-UHFFFAOYSA-N	-1	0	358.825	2.930	50	0		FFAARM
O=C([O-])[C@H]1C2CCC(CC2)[C@H]1C(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000017073976	132884077	/nfs/dbraw/zinc/88/40/77/132884077.db2.gz	GKGMJZXJBUDAIZ-PCHAPFSGSA-N	-1	0	358.438	2.599	50	0		FFAARM
Cc1ccc2c(c1)CCCN2S(=O)(=O)c1ccc(OCC(=O)[O-])cc1	ZINC000047593888	136122831	/nfs/dbraw/zinc/12/28/31/136122831.db2.gz	VJTYXDLBFMUDBF-UHFFFAOYSA-N	-1	0	361.419	2.600	50	0		FFAARM
CC1(C)[C@H](C(=O)[O-])[C@@H]1C(=O)Nc1ccc2c(c1)N(C(=O)C1CC1)CCC2	ZINC000071285605	136138840	/nfs/dbraw/zinc/13/88/40/136138840.db2.gz	NHAQLKDPSRCBOA-CVEARBPZSA-N	-1	0	356.422	2.671	50	0		FFAARM
CCc1ccccc1NC(=O)N1CCC2(CCC(=O)N(CC(=O)[O-])C2)CC1	ZINC000091519351	221766314	/nfs/dbraw/zinc/76/63/14/221766314.db2.gz	UJVYZBWODPDBCY-UHFFFAOYSA-N	-1	0	373.453	2.570	50	0		FFAARM
CCCN1CCn2cc(S(=O)(=O)[N-]c3cc(C)cc(C)c3)cc2C1=O	ZINC000096102050	222023616	/nfs/dbraw/zinc/02/36/16/222023616.db2.gz	WAPLHDWCGKITAS-UHFFFAOYSA-N	-1	0	361.467	2.772	50	0		FFAARM
COC(=O)C[C@H](c1ccsc1)c1c([O-])nc2ccc(Cl)cn2c1=O	ZINC000096117432	222032574	/nfs/dbraw/zinc/03/25/74/222032574.db2.gz	GVSLGVFACPJRML-LLVKDONJSA-N	-1	0	364.810	2.810	50	0		FFAARM
COC(=O)[C@@H]1Oc2c(c(=O)oc3ccccc23)[C@@H]1c1ccc(C(=O)[O-])cc1	ZINC000096335821	222116237	/nfs/dbraw/zinc/11/62/37/222116237.db2.gz	DLNHLZWTNXWJPT-WMLDXEAASA-N	-1	0	366.325	2.557	50	0		FFAARM
Cc1cc(NC(=O)c2c[nH]nc2S(=O)(=O)[N-]c2ccccc2)ccc1F	ZINC000096361065	222117791	/nfs/dbraw/zinc/11/77/91/222117791.db2.gz	JDTXYNJQWCGMOZ-UHFFFAOYSA-N	-1	0	374.397	2.910	50	0		FFAARM
O=C([O-])[C@@H]1CC[C@H](C(=O)N(Cc2ccncc2)Cc2ccc(O)cc2)C1	ZINC000097307192	222174138	/nfs/dbraw/zinc/17/41/38/222174138.db2.gz	VGEQYRBGCMOPAS-DLBZAZTESA-N	-1	0	354.406	2.817	50	0		FFAARM
CC[C@H](c1nc(-c2ccco2)nn1CC(=O)[O-])N1Cc2ccccc2C1=O	ZINC000097495278	222185769	/nfs/dbraw/zinc/18/57/69/222185769.db2.gz	UXSOHPRIPHONRD-CQSZACIVSA-N	-1	0	366.377	2.730	50	0		FFAARM
COc1cc(C(=O)[O-])cc(C(=O)NCc2csc(CSC)n2)c1	ZINC000097514292	222187384	/nfs/dbraw/zinc/18/73/84/222187384.db2.gz	MCDROKGQHGJRNS-UHFFFAOYSA-N	-1	0	352.437	2.643	50	0		FFAARM
O=C([C@@H]1CCCO1)N1CCCN(Cc2c(Cl)ccc([O-])c2Cl)CC1	ZINC000097776290	222213338	/nfs/dbraw/zinc/21/33/38/222213338.db2.gz	NSOOYFKCLWDJRV-HNNXBMFYSA-N	-1	0	373.280	2.912	50	0		FFAARM
CC(=O)c1nn(-c2ccccc2Cl)c2c(O)n(-c3ccccc3)c(O)c12	ZINC000100053610	222234216	/nfs/dbraw/zinc/23/42/16/222234216.db2.gz	VDIZIYFCLMTVGZ-DOTOQJQBSA-N	-1	0	367.792	2.663	50	0		FFAARM
CCCn1c2ccccc2c([O-])c(C(=O)Nc2nnc(CC)s2)c1=O	ZINC000100502105	222245163	/nfs/dbraw/zinc/24/51/63/222245163.db2.gz	QZNSMDSTACPWLC-UHFFFAOYSA-N	-1	0	358.423	2.783	50	0		FFAARM
O=c1c2[n-][nH]n(Cc3cccc(F)c3)c=2c(=O)n1-c1ccc(Cl)cc1	ZINC000101167781	222264734	/nfs/dbraw/zinc/26/47/34/222264734.db2.gz	BMFSPEGDPKKYKV-GJZGRUSLSA-N	-1	0	358.760	2.973	50	0		FFAARM
CCOc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccccc4)c=3c2=O)cc1	ZINC000101417726	222274155	/nfs/dbraw/zinc/27/41/55/222274155.db2.gz	VKVRKORTRNWXTE-SJORKVTESA-N	-1	0	350.378	2.579	50	0		FFAARM
CCOc1ccc(-n2c(=O)c3[n-][nH]n(Cc4cccc(F)c4)c=3c2=O)cc1	ZINC000101417803	222274405	/nfs/dbraw/zinc/27/44/05/222274405.db2.gz	HJYJMWWTZMIHLW-IRXDYDNUSA-N	-1	0	368.368	2.718	50	0		FFAARM
Cc1ccc(N2C(=O)[C@H]3C(C(=O)c4ccc(Cl)cc4)=NOC3=C2[O-])cc1	ZINC000103118665	222320938	/nfs/dbraw/zinc/32/09/38/222320938.db2.gz	LJWXLMOQRWMLFW-WMLDXEAASA-N	-1	0	368.776	2.776	50	0		FFAARM
C[C@H](OC1CCCCCC1)C(=O)[N-]S(=O)(=O)Cc1ccc(Cl)nc1	ZINC000163751877	222556228	/nfs/dbraw/zinc/55/62/28/222556228.db2.gz	ZKVPMQMTJQUUEC-LBPRGKRZSA-N	-1	0	374.890	2.809	50	0		FFAARM
Cc1c2cc(Cl)c([O-])cc2oc(=O)c1CC(=O)NCc1cccnc1	ZINC000005246743	263339722	/nfs/dbraw/zinc/33/97/22/263339722.db2.gz	DTCJTPNBIHFXME-UHFFFAOYSA-N	-1	0	358.781	2.714	50	0		FFAARM
Cc1cccc([C@@H](NC(=O)N(C)Cc2cc(C(C)(C)C)n[nH]2)C(=O)[O-])c1	ZINC000426595122	263642082	/nfs/dbraw/zinc/64/20/82/263642082.db2.gz	YJLMJEZDCRZCKG-MRXNPFEDSA-N	-1	0	358.442	2.983	50	0		FFAARM
O=C1N2CCSC2=N[C@]1([N-]c1nc2ccccc2s1)C(F)(F)F	ZINC000002504107	506281819	/nfs/dbraw/zinc/28/18/19/506281819.db2.gz	BLAKWGKBMRBZAO-LBPRGKRZSA-N	-1	0	358.370	2.912	50	0		FFAARM
COC(=O)c1c([N-]S(=O)(=O)c2ccc(F)cc2)sc2c1CCC2	ZINC000002734224	506289504	/nfs/dbraw/zinc/28/95/04/506289504.db2.gz	QCSVMBKFHOOHIY-UHFFFAOYSA-N	-1	0	355.412	2.963	50	0		FFAARM
COc1ccc([C@H]2N[C@@H](C(=O)[O-])CS2)cc1COCC(F)(F)F	ZINC000003013657	506306948	/nfs/dbraw/zinc/30/69/48/506306948.db2.gz	ROVUMDZPGHDPPQ-PWSUYJOCSA-N	-1	0	351.346	2.562	50	0		FFAARM
COc1ccc([C@H]2N[C@H](C(=O)[O-])CS2)cc1COCC(F)(F)F	ZINC000003013661	506307745	/nfs/dbraw/zinc/30/77/45/506307745.db2.gz	ROVUMDZPGHDPPQ-JQWIXIFHSA-N	-1	0	351.346	2.562	50	0		FFAARM
CC(C)C[C@@H](C(=O)[O-])N1C(=O)N2CCc3c4ccccc4[nH]c3[C@@]2(C)C1=O	ZINC000003882104	506351329	/nfs/dbraw/zinc/35/13/29/506351329.db2.gz	UXIZELYFPCMPQX-YWZLYKJASA-N	-1	0	369.421	2.703	50	0	biogenic	FFAARM
C[C@@H]1CN([C@@H](c2cccs2)c2sc3ncnn3c2[O-])C[C@H](C)O1	ZINC000004292189	506369473	/nfs/dbraw/zinc/36/94/73/506369473.db2.gz	QTDKDDVKZDKMQU-UMNHJUIQSA-N	-1	0	350.469	2.757	50	0		FFAARM
CS(=O)(=O)[N-]c1ccccc1C(=O)OCC(=O)c1c[nH]c2ccccc12	ZINC000004486691	506377306	/nfs/dbraw/zinc/37/73/06/506377306.db2.gz	FUFIBFZDTAGCNY-UHFFFAOYSA-N	-1	0	372.402	2.579	50	0		FFAARM
O=C([O-])COc1ccc(-c2nnn(Cc3c(F)cccc3Cl)n2)cc1	ZINC000004727727	506391611	/nfs/dbraw/zinc/39/16/11/506391611.db2.gz	GRIIMGYABCQNCN-UHFFFAOYSA-N	-1	0	362.748	2.644	50	0		FFAARM
O=C([O-])c1cc(S(=O)(=O)NCc2ccccn2)c(Cl)cc1Cl	ZINC000006275203	506474480	/nfs/dbraw/zinc/47/44/80/506474480.db2.gz	XHSGHQFUUHUXGG-UHFFFAOYSA-N	-1	0	361.206	2.565	50	0		FFAARM
CCC(NCc1ccco1)=C1C(=O)[N-]C(=O)N(c2ccccc2C)C1=O	ZINC000006419632	506482529	/nfs/dbraw/zinc/48/25/29/506482529.db2.gz	CLMAVEJNEMMXBW-PEZBUJJGSA-N	-1	0	353.378	2.625	50	0		FFAARM
O=c1[nH]c2ccc([N-]S(=O)(=O)c3cc(Cl)ccc3Cl)cc2[nH]1	ZINC000006471652	506485066	/nfs/dbraw/zinc/48/50/66/506485066.db2.gz	RYUDBWNYIDJLRC-UHFFFAOYSA-N	-1	0	358.206	2.964	50	0		FFAARM
O=C([O-])[C@@H]1C2CCC(CC2)[C@H]1C(=O)N1CCN(Cc2ccc(F)cc2)CC1	ZINC000006727045	506501259	/nfs/dbraw/zinc/50/12/59/506501259.db2.gz	BEYAEIJMMUGRIU-LRMJVLKBSA-N	-1	0	374.456	2.607	50	0		FFAARM
COC(=O)c1sccc1S(=O)(=O)[N-]c1ccc(OC)c(Cl)c1	ZINC000006916805	506517708	/nfs/dbraw/zinc/51/77/08/506517708.db2.gz	VFPHQYGBXLWEPP-UHFFFAOYSA-N	-1	0	361.828	2.998	50	0		FFAARM
O=S(=O)([N-]N=c1ccc(C(F)(F)F)c[nH]1)c1ccc(F)c(F)c1F	ZINC000007410024	506560286	/nfs/dbraw/zinc/56/02/86/506560286.db2.gz	VYULVZZTTVTUMX-UHFFFAOYSA-N	-1	0	371.262	2.823	50	0		FFAARM
CC(=O)Nc1ccc(S(=O)(=O)[N-]c2ccccc2N2CCCC2=O)cc1	ZINC000007726590	506585851	/nfs/dbraw/zinc/58/58/51/506585851.db2.gz	OLVQUTXYQXGIGZ-UHFFFAOYSA-N	-1	0	373.434	2.573	50	0		FFAARM
COc1cc(NS(=O)(=O)c2ccc(C)c(F)c2)c(C(=O)[O-])cc1OC	ZINC000042122861	506600157	/nfs/dbraw/zinc/60/01/57/506600157.db2.gz	ILDWYAXAOXJYKR-UHFFFAOYSA-N	-1	0	369.370	2.650	50	0		FFAARM
CCC1=NO[C@@H](Cn2c3cc(C(=O)[O-])cnc3n(C(CC)CC)c2=O)C1	ZINC000055182979	506693840	/nfs/dbraw/zinc/69/38/40/506693840.db2.gz	CJQGGBFLCPVCPA-CQSZACIVSA-N	-1	0	360.414	2.812	50	0		FFAARM
CCc1cc(=O)[nH]c(-c2cccc([N-]S(=O)(=O)c3ccccc3F)c2)n1	ZINC000055621159	506802483	/nfs/dbraw/zinc/80/24/83/506802483.db2.gz	NLAMUWRXMAVQBZ-UHFFFAOYSA-N	-1	0	373.409	2.939	50	0		FFAARM
O=C(CSC1=Nc2ccc(Cl)cc2S(=O)(=O)[N-]1)N1CCCCC1	ZINC000012361049	506853507	/nfs/dbraw/zinc/85/35/07/506853507.db2.gz	HVSBGYIDZPRNTP-UHFFFAOYSA-N	-1	0	373.887	2.556	50	0		FFAARM
Cn1ccc(NC(=O)c2ccccc2[N-]S(=O)(=O)c2ccc(F)cc2)n1	ZINC000012536160	506873562	/nfs/dbraw/zinc/87/35/62/506873562.db2.gz	LSMFVNILFSJBEN-UHFFFAOYSA-N	-1	0	374.397	2.612	50	0		FFAARM
Cn1cnnc1Sc1ccccc1[N-]S(=O)(=O)c1ccccc1F	ZINC000012541716	506874887	/nfs/dbraw/zinc/87/48/87/506874887.db2.gz	QLGMXZGHXNRYHW-UHFFFAOYSA-N	-1	0	364.427	2.906	50	0		FFAARM
COc1cccc(C[C@H](C(=O)Nc2cccc(C)c2C)c2nnn[n-]2)c1	ZINC000057524711	507285223	/nfs/dbraw/zinc/28/52/23/507285223.db2.gz	QCERGXFYEKWNLB-INIZCTEOSA-N	-1	0	351.410	2.790	50	0		FFAARM
COC(=O)c1cccc(S(=O)(=O)[N-]c2cc(Cl)ccc2OC)c1	ZINC000024256478	507400495	/nfs/dbraw/zinc/40/04/95/507400495.db2.gz	UFPIHIIKSAPFHD-UHFFFAOYSA-N	-1	0	355.799	2.936	50	0		FFAARM
O=C([O-])COc1ccc(S(=O)(=O)Nc2cccc(Cl)c2F)cc1	ZINC000047906725	507412028	/nfs/dbraw/zinc/41/20/28/507412028.db2.gz	SGCZUDVYPZJIGR-UHFFFAOYSA-N	-1	0	359.762	2.743	50	0		FFAARM
O=C([O-])C[C@H]1COCCN1Cc1ccccc1OCCc1ccccc1	ZINC000072172594	507769923	/nfs/dbraw/zinc/76/99/23/507769923.db2.gz	RLOTZQHXKSQQEX-IBGZPJMESA-N	-1	0	355.434	2.984	50	0		FFAARM
CCOC(=O)C[C@H](c1c(C)noc1C)c1c(=O)[nH]c2ccccc2c1[O-]	ZINC000072405308	507783947	/nfs/dbraw/zinc/78/39/47/507783947.db2.gz	RWIXTWKWNNFTKX-CYBMUJFWSA-N	-1	0	356.378	2.924	50	0		FFAARM
CCOC(=O)C[C@@H](c1c(C)noc1C)c1c(=O)[nH]c2ccccc2c1[O-]	ZINC000072405307	507784211	/nfs/dbraw/zinc/78/42/11/507784211.db2.gz	RWIXTWKWNNFTKX-ZDUSSCGKSA-N	-1	0	356.378	2.924	50	0		FFAARM
Cc1cc(C)cc(NC(=O)N2CCC3(CCC(=O)N(CC(=O)[O-])C3)CC2)c1	ZINC000091664697	508000176	/nfs/dbraw/zinc/00/01/76/508000176.db2.gz	XBHCGFFRJHTJDB-UHFFFAOYSA-N	-1	0	373.453	2.625	50	0		FFAARM
CCn1cc2ccc(NS(=O)(=O)c3cc(C(=O)[O-])ccc3C)cc2n1	ZINC000075572868	508118583	/nfs/dbraw/zinc/11/85/83/508118583.db2.gz	XSBWGNFWMSGVCA-UHFFFAOYSA-N	-1	0	359.407	2.864	50	0		FFAARM
CCCc1cc(C(=O)N[C@H](C(=O)[O-])c2ccc(F)c(Cl)c2)n(C)n1	ZINC000095366043	508177539	/nfs/dbraw/zinc/17/75/39/508177539.db2.gz	YDGFATHECUQFPA-AWEZNQCLSA-N	-1	0	353.781	2.721	50	0		FFAARM
CN(CC(=O)N1CCC[C@@H](c2ccc(C(=O)[O-])cc2)C1)Cc1ccccn1	ZINC000095386754	508182757	/nfs/dbraw/zinc/18/27/57/508182757.db2.gz	UJIGNSVBTUZORO-GOSISDBHSA-N	-1	0	367.449	2.618	50	0		FFAARM
COc1cccc(CC(=O)N[C@@H](CC(=O)[O-])c2ccc(OC)cc2OC)c1	ZINC000095464087	508187268	/nfs/dbraw/zinc/18/72/68/508187268.db2.gz	NOJJWKWOMWEFRL-KRWDZBQOSA-N	-1	0	373.405	2.587	50	0		FFAARM
CCOc1ccc(S(=O)(=O)[N-]c2cccc(-c3nncn3CC)c2)cn1	ZINC000095469150	508187613	/nfs/dbraw/zinc/18/76/13/508187613.db2.gz	NIUXDTBYZOBYEN-UHFFFAOYSA-N	-1	0	373.438	2.560	50	0		FFAARM
COC(=O)c1[n-]c(=NC(=O)c2nn(C)c3ccccc32)sc1CC(C)C	ZINC000095479148	508189014	/nfs/dbraw/zinc/18/90/14/508189014.db2.gz	KTUBGDROXGUNHE-UHFFFAOYSA-N	-1	0	372.450	3.267	50	0		FFAARM
CC(C)(C)OC(=O)NCCNc1nc(-c2ccccc2)ncc1C(=O)[O-]	ZINC000105640884	508379350	/nfs/dbraw/zinc/37/93/50/508379350.db2.gz	IWXVLFIHZIRJRL-UHFFFAOYSA-N	-1	0	358.398	2.778	50	0		FFAARM
Cc1nn(Cc2cccc(Cl)c2)cc1C(=O)N1CCC[C@H](C(=O)[O-])C1	ZINC000128510631	508603777	/nfs/dbraw/zinc/60/37/77/508603777.db2.gz	KAPFZQFGXWMJLW-AWEZNQCLSA-N	-1	0	361.829	2.830	50	0		FFAARM
CC(C)(C)CC(=O)Nc1ccc(CC(=O)N2CCC[C@@H](C(=O)[O-])C2)cc1	ZINC000136128038	508672402	/nfs/dbraw/zinc/67/24/02/508672402.db2.gz	PSOWVKASGYJQHW-OAHLLOKOSA-N	-1	0	360.454	2.927	50	0		FFAARM
Cn1ncnc1[N-]S(=O)(=O)c1ccc(OCC2CCCCC2)cc1	ZINC000126963445	509153383	/nfs/dbraw/zinc/15/33/83/509153383.db2.gz	PQRZNHGUUGNHKL-UHFFFAOYSA-N	-1	0	350.444	2.575	50	0		FFAARM
Cc1cc(C(=O)N[C@@H]2COCC[C@H]2Oc2ccc(C(=O)[O-])cc2)c(C)o1	ZINC000223825649	509350027	/nfs/dbraw/zinc/35/00/27/509350027.db2.gz	MHBVKTDFOBOSIG-IAGOWNOFSA-N	-1	0	359.378	2.561	50	0		FFAARM
CC(C)C[C@@H](NC(=O)c1ccc(CN2C[C@@H](C)O[C@@H](C)C2)cc1)C(=O)[O-]	ZINC000236602880	509462321	/nfs/dbraw/zinc/46/23/21/509462321.db2.gz	NKEILEYWIPSLQD-RVKKMQEKSA-N	-1	0	362.470	2.525	50	0		FFAARM
CC(C)c1cc(C(=O)N(CCC(=O)[O-])C[C@@H]2CCCO2)nn1C(C)(C)C	ZINC000236881441	509523732	/nfs/dbraw/zinc/52/37/32/509523732.db2.gz	ORYCTYLHCINCMT-AWEZNQCLSA-N	-1	0	365.474	2.857	50	0		FFAARM
CCOc1ccc(C(=O)N2CCC(C(=O)[O-])(c3ccccc3)CC2)cn1	ZINC000236950966	509539937	/nfs/dbraw/zinc/53/99/37/509539937.db2.gz	KQOMNKHAMOLVIQ-UHFFFAOYSA-N	-1	0	354.406	2.739	50	0		FFAARM
CC[C@@H](C(=O)N1CCO[C@@H](CC(=O)[O-])C1)c1cccc(C(F)(F)F)c1	ZINC000236954833	509540017	/nfs/dbraw/zinc/54/00/17/509540017.db2.gz	ARHMVXVMXOGXJD-UONOGXRCSA-N	-1	0	359.344	2.901	50	0		FFAARM
CN(Cc1ccc(C(=O)[O-])cc1)C(=O)[C@@H]1CC(=O)Nc2cc(F)ccc21	ZINC000237040064	509556487	/nfs/dbraw/zinc/55/64/87/509556487.db2.gz	TYSZMHARKHTQGO-OAHLLOKOSA-N	-1	0	356.353	2.608	50	0		FFAARM
CC[C@@H](Cc1ccccc1Br)C(=O)N1CC[C@H](C(=O)[O-])C1	ZINC000237037066	509556494	/nfs/dbraw/zinc/55/64/94/509556494.db2.gz	JFTXSXGVGIJUMI-AAEUAGOBSA-N	-1	0	354.244	2.951	50	0		FFAARM
Cc1cc(F)cc(S(=O)(=O)[N-]C(=O)c2csc([C@H]3CCCO3)n2)c1	ZINC000167012873	509622723	/nfs/dbraw/zinc/62/27/23/509622723.db2.gz	QYLAKXMMTGRQBO-CYBMUJFWSA-N	-1	0	370.427	2.561	50	0		FFAARM
COCCC1(C(=O)Nc2ccc([N-]S(=O)(=O)C(F)(F)F)cc2)CC1	ZINC000170606054	509678335	/nfs/dbraw/zinc/67/83/35/509678335.db2.gz	FMMXCJCTONWMHF-UHFFFAOYSA-N	-1	0	366.361	2.703	50	0		FFAARM
Cc1cc(C)nc([N-]S(=O)(=O)Cc2ccc(OC(F)(F)F)cc2)n1	ZINC000170609285	509679572	/nfs/dbraw/zinc/67/95/72/509679572.db2.gz	CMYBZZNYZDQLSG-UHFFFAOYSA-N	-1	0	361.345	2.934	50	0		FFAARM
O=C([N-]S(=O)(=O)c1cccnc1)[C@H](OC1CCCC1)c1ccccc1	ZINC000170620478	509683693	/nfs/dbraw/zinc/68/36/93/509683693.db2.gz	CYODYCPAJYFMLZ-QGZVFWFLSA-N	-1	0	360.435	2.587	50	0		FFAARM
Cc1cccc(C[C@H](CNC(=O)[C@H]2CCOc3ccccc32)C(=O)[O-])c1	ZINC000237694663	509712668	/nfs/dbraw/zinc/71/26/68/509712668.db2.gz	IHHLYDFQIAYDJX-AEFFLSMTSA-N	-1	0	353.418	2.921	50	0		FFAARM
Cc1nc(-c2ccc(C(=O)N3[C@H](C(=O)[O-])C[C@H]4CCCC[C@@H]43)cc2)n[nH]1	ZINC000237738984	509723426	/nfs/dbraw/zinc/72/34/26/509723426.db2.gz	SWSNDZJHLOZNPE-PMPSAXMXSA-N	-1	0	354.410	2.638	50	0		FFAARM
O=C([O-])C1CCN(C(=O)[C@H]2C[C@H]2c2ccc(Br)cc2)CC1	ZINC000238029835	509803750	/nfs/dbraw/zinc/80/37/50/509803750.db2.gz	UZDHDNHZFSSDIO-KBPBESRZSA-N	-1	0	352.228	2.876	50	0		FFAARM
O=C([O-])C1CCN(C(=O)c2cc3ccc(Br)cc3[nH]2)CC1	ZINC000238034533	509805130	/nfs/dbraw/zinc/80/51/30/509805130.db2.gz	CWGPGHSZSMGVDI-UHFFFAOYSA-N	-1	0	351.200	2.867	50	0		FFAARM
O=C([O-])CCN(C(=O)Cc1ccccc1C(F)(F)F)C1CCOCC1	ZINC000238065999	509813192	/nfs/dbraw/zinc/81/31/92/509813192.db2.gz	OVVYKQCFLPZHEB-UHFFFAOYSA-N	-1	0	359.344	2.730	50	0		FFAARM
O=C([O-])CCN(C(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1)C1CCOCC1	ZINC000238069710	509814108	/nfs/dbraw/zinc/81/41/08/509814108.db2.gz	BCNJWUBNIBODFL-CVEARBPZSA-N	-1	0	351.830	2.926	50	0		FFAARM
O=C([O-])[C@H]1CCCN1CC(=O)NCc1ccc(-c2ccc(Cl)cc2)o1	ZINC000238093703	509819854	/nfs/dbraw/zinc/81/98/54/509819854.db2.gz	YERGFAPAZOSQRQ-OAHLLOKOSA-N	-1	0	362.813	2.765	50	0		FFAARM
CC[C@@H](C)[C@@H](NC(=O)CCc1nc(-c2ccc3cc[nH]c3c2)no1)C(=O)[O-]	ZINC000252552024	509852921	/nfs/dbraw/zinc/85/29/21/509852921.db2.gz	ULUVSAUIWNKOPX-PIGZYNQJSA-N	-1	0	370.409	2.766	50	0		FFAARM
Cc1nn(C)c(C)c1[C@H](NC(=O)c1cccc(C(=O)[O-])c1)C(F)(F)F	ZINC000262838534	510433824	/nfs/dbraw/zinc/43/38/24/510433824.db2.gz	QZGKFURSWNCWSK-ZDUSSCGKSA-N	-1	0	355.316	2.769	50	0		FFAARM
Cc1ccc(-n2[n-]c(C(=O)N3CC=C(C(F)(F)F)CC3)cc2=O)cc1	ZINC000270526942	510895979	/nfs/dbraw/zinc/89/59/79/510895979.db2.gz	UVNOKJOCRMSQEL-UHFFFAOYSA-N	-1	0	351.328	2.809	50	0		FFAARM
Cc1c(C(=O)[O-])cnn1-c1ccc(C(=O)N[C@@H]2CCC[C@@H]3OCC[C@@H]32)cc1	ZINC000299746474	511668320	/nfs/dbraw/zinc/66/83/20/511668320.db2.gz	XPVIPDGFDPGVPT-NXHRZFHOSA-N	-1	0	369.421	2.566	50	0		FFAARM
Cc1nc(-c2cnn(C)c2)sc1C(=O)N1[C@@H]2CCCC[C@H]2C[C@H]1C(=O)[O-]	ZINC000299752730	511668626	/nfs/dbraw/zinc/66/86/26/511668626.db2.gz	VEMNUFPAMQLTQM-YUTCNCBUSA-N	-1	0	374.466	2.710	50	0		FFAARM
COc1cc2c(cc1OC)[C@H](CC(=O)[O-])N(C(=O)c1ccoc1C)CC2	ZINC000299742651	511668948	/nfs/dbraw/zinc/66/89/48/511668948.db2.gz	ICAGESDFAONBKQ-HNNXBMFYSA-N	-1	0	359.378	2.820	50	0		FFAARM
O=C([O-])Cc1ccc(S(=O)(=O)N2C[C@H]3CCC(=O)c4cccc2c43)cc1	ZINC000274291145	511782243	/nfs/dbraw/zinc/78/22/43/511782243.db2.gz	KHNIJHRYRMZQEZ-CYBMUJFWSA-N	-1	0	371.414	2.583	50	0		FFAARM
O=C([O-])Cn1ccc([C@@H]2CCCN(C(=O)c3cc4ccccc4cn3)C2)n1	ZINC000426538489	513973897	/nfs/dbraw/zinc/97/38/97/513973897.db2.gz	YTCHTKUDONAUOD-MRXNPFEDSA-N	-1	0	364.405	2.536	50	0		FFAARM
C[C@H]1Cc2cc(C(=O)N(C)Cc3ccc(OCC(=O)[O-])cc3)ccc2O1	ZINC000580096908	519005656	/nfs/dbraw/zinc/00/56/56/519005656.db2.gz	SODUVURAGSNXLV-ZDUSSCGKSA-N	-1	0	355.390	2.746	50	0		FFAARM
CCOc1ccc([C@H](C(=O)[O-])N2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000087489409	521249825	/nfs/dbraw/zinc/24/98/25/521249825.db2.gz	YFNIXSDTFXXPLJ-MRXNPFEDSA-N	-1	0	364.442	2.764	50	0		FFAARM
CCOC(=O)c1c(C)[nH]c(C)c1S(=O)(=O)[N-]c1ccc(C(C)=O)cc1	ZINC000020574815	521384299	/nfs/dbraw/zinc/38/42/99/521384299.db2.gz	KPUKGDSFWMQSJD-UHFFFAOYSA-N	-1	0	364.423	2.812	50	0		FFAARM
CC[C@H](Cc1cccc(Br)c1)C(=O)N1CC[C@@H](C(=O)[O-])C1	ZINC000269179965	522307632	/nfs/dbraw/zinc/30/76/32/522307632.db2.gz	KXXCGFYKZOAGDK-CHWSQXEVSA-N	-1	0	354.244	2.951	50	0		FFAARM
COc1cccc([C@@H]2CN(C(=O)CCc3c(C)noc3C)C[C@H]2C(=O)[O-])c1	ZINC000091664165	524121110	/nfs/dbraw/zinc/12/11/10/524121110.db2.gz	FFIFDHWQUJXWAN-ZWKOTPCHSA-N	-1	0	372.421	2.559	50	0		FFAARM
O=C([O-])[C@@H]1CCCN(C(=O)c2c[nH]c3cccc(Br)c23)C1	ZINC000272030888	526272986	/nfs/dbraw/zinc/27/29/86/526272986.db2.gz	PFBVTORVJDDNAD-SECBINFHSA-N	-1	0	351.200	2.867	50	0		FFAARM
Cc1oc(CN(C)C(=O)[C@H]2C[C@H]2c2ccc3c(c2)OCCO3)cc1C(=O)[O-]	ZINC000268944394	526768555	/nfs/dbraw/zinc/76/85/55/526768555.db2.gz	VHWZGMNFQCZURJ-HOTGVXAUSA-N	-1	0	371.389	2.820	50	0		FFAARM
CC[C@@H](C)NC(=O)c1c([O-])c2cccnc2n(-c2ccc(OC)cc2)c1=O	ZINC000101723329	570822565	/nfs/dbraw/zinc/82/25/65/570822565.db2.gz	BIAIECRVPGXRMM-GFCCVEGCSA-N	-1	0	367.405	2.628	50	0		FFAARM
Cc1cccc(N(Cc2nn3c([n-]2)nc(C)cc3=O)C(=O)C(C)(C)C)c1	ZINC000101802312	570823815	/nfs/dbraw/zinc/82/38/15/570823815.db2.gz	LCSAXZAKZWHXPM-UHFFFAOYSA-N	-1	0	353.426	2.614	50	0		FFAARM
O=S(=O)([N-]c1ccc2c(c1)OCCO2)c1ccc(-c2cc[nH]n2)s1	ZINC000085664851	571123954	/nfs/dbraw/zinc/12/39/54/571123954.db2.gz	FQUJFSPNAWBVEW-UHFFFAOYSA-N	-1	0	363.420	2.710	50	0		FFAARM
Cc1nc(-c2csc(S(=O)(=O)[N-]c3ccc(Cl)cn3)c2)no1	ZINC000021701588	571134197	/nfs/dbraw/zinc/13/41/97/571134197.db2.gz	ARZMOPMHTBMQGZ-UHFFFAOYSA-N	-1	0	356.816	2.956	50	0		FFAARM
CC(C)(CCS(C)(=O)=O)CNC(=O)c1ccc2[n-]c(=S)oc2c1	ZINC000073886423	571139038	/nfs/dbraw/zinc/13/90/38/571139038.db2.gz	KLOUVCINEHUFTQ-UHFFFAOYSA-N	-1	0	356.469	2.681	50	0		FFAARM
COc1ccc(NC(=O)N2CCO[C@H](C(=O)[O-])C2)cc1Cc1ccccc1	ZINC000669495121	600006395	/nfs/dbraw/zinc/00/63/95/600006395.db2.gz	KMXCGIYXYYXSKK-SFHVURJKSA-N	-1	0	370.405	2.603	50	0		FFAARM
Cc1ccc(OCc2cccc(C(=O)N[C@@](C)(C(=O)[O-])C3CC3)c2)cn1	ZINC000191068280	600616469	/nfs/dbraw/zinc/61/64/69/600616469.db2.gz	LJTQPHIRXJAVPL-HXUWFJFHSA-N	-1	0	354.406	2.952	50	0		FFAARM
CC[C@H](C)Oc1ccccc1/C=C\C(=O)N(CC(=O)[O-])C1CCOCC1	ZINC000584907991	600957554	/nfs/dbraw/zinc/95/75/54/600957554.db2.gz	BLVUDWQARLAJAO-CDNLZTBQSA-N	-1	0	361.438	2.969	50	0		FFAARM
COC(=O)c1ccccc1NC(=O)C(=O)C=C([O-])c1ccc(Cl)cc1	ZINC000100503404	728485042	/nfs/dbraw/zinc/48/50/42/728485042.db2.gz	AUGSMBDRWYLWFA-UHFFFAOYSA-N	-1	0	359.765	2.907	50	0		FFAARM
CO[C@](C)(C(=O)[O-])C(=O)N[C@H]1CCC[C@H]1c1ccccc1C(F)(F)F	ZINC000663046321	732376243	/nfs/dbraw/zinc/37/62/43/732376243.db2.gz	SMJQMFIVYOBALE-RBOXIYTFSA-N	-1	0	359.344	2.947	50	0		FFAARM
CCc1nc(S(=O)(=O)[N-]c2n[nH]c3cccc(F)c32)cn1CC1CC1	ZINC000663298949	732413497	/nfs/dbraw/zinc/41/34/97/732413497.db2.gz	CBQDUZOSLGIILD-UHFFFAOYSA-N	-1	0	363.418	2.672	50	0		FFAARM
O=C([O-])/C=C\c1ccc(S(=O)(=O)NCc2nccc3ccccc32)cc1	ZINC000098002481	1013258059	/nfs/dbraw/zinc/25/80/59/1013258059.db2.gz	YGEQXZGHWLNWPA-YFHOEESVSA-N	-1	0	368.414	2.811	50	0		FFAARM
O=C([O-])COc1ccccc1CN1CCN(Cc2cccc(F)c2)CC1	ZINC000063834043	991716144	/nfs/dbraw/zinc/71/61/44/991716144.db2.gz	PMSHLKTYWNCPJE-UHFFFAOYSA-N	-1	0	358.413	2.607	50	0		FFAARM
CCc1nc(S(=O)(=O)[N-]c2cc(-c3cccnc3)on2)cn1CC1CC1	ZINC000663298382	1026618853	/nfs/dbraw/zinc/61/88/53/1026618853.db2.gz	MLEGHMFAUFYZIE-UHFFFAOYSA-N	-1	0	373.438	2.706	50	0		FFAARM
NC(=O)c1c2c(sc1NC(=O)[C@@H]1CCCC[C@@H]1C(=O)[O-])CCCC2	ZINC000000355785	219304579	/nfs/dbraw/zinc/30/45/79/219304579.db2.gz	OFSGNJCEUBTMGV-ZJUUUORDSA-N	-1	0	350.440	2.555	50	0		FFAARM
O=C1N[C@H](c2ccccc2)C(=C([O-])c2cccs2)[C@@](O)(C(F)(F)F)N1	ZINC000000715646	219316462	/nfs/dbraw/zinc/31/64/62/219316462.db2.gz	OXRRYKXYECAQSB-YWPYICTPSA-N	-1	0	370.352	2.852	50	0		FFAARM
O=C([O-])[C@H](Cc1ccccc1)NS(=O)(=O)c1ccc2ccccc2c1	ZINC000000850356	219330959	/nfs/dbraw/zinc/33/09/59/219330959.db2.gz	RRSYAACXBJFWRS-SFHVURJKSA-N	-1	0	355.415	2.814	50	0		FFAARM
O=C([O-])CNC(=O)COc1ccc(-c2ccccc2)cc1Br	ZINC000000955781	219346630	/nfs/dbraw/zinc/34/66/30/219346630.db2.gz	ODYSYDWQQSUQKK-UHFFFAOYSA-N	-1	0	364.195	2.696	50	0		FFAARM
CCc1ccc2oc(-c3ccccc3)c/c(=N\CC(=O)NCC(=O)[O-])c2c1	ZINC000001792091	219418890	/nfs/dbraw/zinc/41/88/90/219418890.db2.gz	JHSSFZOSCURDSR-OQKWZONESA-N	-1	0	364.401	2.764	50	0	biogenic,in-vitro	FFAARM
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C(=O)[O-])C(C)C	ZINC000002516172	219449126	/nfs/dbraw/zinc/44/91/26/219449126.db2.gz	XISNUVNLGJKNIK-BPUTZDHNSA-N	-1	0	364.442	2.553	50	0		FFAARM
CCc1cccc2c(CC(=O)N(CCC(=O)[O-])C3CCOCC3)c[nH]c21	ZINC000236999422	222903945	/nfs/dbraw/zinc/90/39/45/222903945.db2.gz	IVBKFSUQMCOEEJ-UHFFFAOYSA-N	-1	0	358.438	2.755	50	0		FFAARM
COc1ccc2c(c1)CCN2C(=O)c1cc(C(=O)[O-])nn1-c1ccccc1	ZINC000237455723	222908385	/nfs/dbraw/zinc/90/83/85/222908385.db2.gz	GZKIQWSOSIZGOG-UHFFFAOYSA-N	-1	0	363.373	2.782	50	0		FFAARM
COc1ccc(-n2ccc(C(=O)N3CCCC[C@@H]3CCC(=O)[O-])n2)cc1	ZINC000237510890	222908860	/nfs/dbraw/zinc/90/88/60/222908860.db2.gz	JLYBRLYIGVKDOY-CQSZACIVSA-N	-1	0	357.410	2.740	50	0		FFAARM
C[C@]1(C(=O)[O-])CCN(C(=O)[C@H]2C[C@@H]2c2cccc(Br)c2)C1	ZINC000237650374	222910183	/nfs/dbraw/zinc/91/01/83/222910183.db2.gz	QZYCNZYTEKGAQQ-WWGRRREGSA-N	-1	0	352.228	2.876	50	0		FFAARM
CCOc1ccc([C@H](CC(=O)[O-])NC(=O)COc2ccccc2)cc1OC	ZINC000003623033	219523158	/nfs/dbraw/zinc/52/31/58/219523158.db2.gz	WYZXESRVSVKNAW-INIZCTEOSA-N	-1	0	373.405	2.805	50	0		FFAARM
CCN1C(=O)N/C(=C/c2ccccc2OCc2ccc(C(=O)[O-])cc2)C1=O	ZINC000004521027	219583000	/nfs/dbraw/zinc/58/30/00/219583000.db2.gz	LYPCCWFIGWLHHJ-LFIBNONCSA-N	-1	0	366.373	2.876	50	0		FFAARM
COc1ccc(-c2nnc(SCc3ccc(C(=O)[O-])cc3)n2N)cc1	ZINC000005069892	219646930	/nfs/dbraw/zinc/64/69/30/219646930.db2.gz	RSPRDSDJPNZTIM-UHFFFAOYSA-N	-1	0	356.407	2.658	50	0		FFAARM
CCOc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccccc4)c=3c2=O)cc1	ZINC000006770408	219767920	/nfs/dbraw/zinc/76/79/20/219767920.db2.gz	VKVRKORTRNWXTE-IAGOWNOFSA-N	-1	0	350.378	2.579	50	0		FFAARM
O=C([O-])c1cccc(NS(=O)(=O)c2cccc(Br)c2)c1	ZINC000007053745	219790391	/nfs/dbraw/zinc/79/03/91/219790391.db2.gz	HJEDQXUBOWCMCH-UHFFFAOYSA-N	-1	0	356.197	2.948	50	0		FFAARM
COc1cc(/C=C2\N=C(c3ccc(F)cc3)OC2=O)ccc1OCC(=O)[O-]	ZINC000007925313	219834037	/nfs/dbraw/zinc/83/40/37/219834037.db2.gz	MEYBUCHCWLMCJN-ZSOIEALJSA-N	-1	0	371.320	2.642	50	0		FFAARM
O=C([O-])CCN(C[C@@H]1CCCO1)C(=O)[C@H]1C[C@H]1c1ccc(F)cc1F	ZINC000299753363	223080381	/nfs/dbraw/zinc/08/03/81/223080381.db2.gz	XZGWVBRMUXGQIH-QEJZJMRPSA-N	-1	0	353.365	2.551	50	0		FFAARM
O=C([O-])[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1cccc(CN2CCCC2=O)c1	ZINC000299751147	223080531	/nfs/dbraw/zinc/08/05/31/223080531.db2.gz	PRRZSSBNXHOCGO-NXHRZFHOSA-N	-1	0	370.449	2.667	50	0		FFAARM
O=C([O-])[C@@H]1Cc2nc(NC(=O)c3cccc(F)c3F)sc2C(=O)C1	ZINC000299768144	223088103	/nfs/dbraw/zinc/08/81/03/223088103.db2.gz	GMGZKZJJZTUWGH-ZCFIWIBFSA-N	-1	0	352.318	2.503	50	0		FFAARM
Cc1ccc(C)c([C@H](C)NC(=O)Cc2csc([N-]S(C)(=O)=O)n2)c1	ZINC000012541798	220004566	/nfs/dbraw/zinc/00/45/66/220004566.db2.gz	JFFLNHMECLABPS-LBPRGKRZSA-N	-1	0	367.496	2.551	50	0		FFAARM
O=C([O-])c1cc2c(cc1NS(=O)(=O)c1cccc(Cl)c1)OCCO2	ZINC000012769646	220026519	/nfs/dbraw/zinc/02/65/19/220026519.db2.gz	ASJDCAOVHLHFTI-UHFFFAOYSA-N	-1	0	369.782	2.610	50	0		FFAARM
Cc1c(C(=O)[O-])sc2[nH]c(Cc3cnn(-c4ccccc4)c3)nc(=O)c12	ZINC000012788338	220030542	/nfs/dbraw/zinc/03/05/42/220030542.db2.gz	TXPNJBIQHHLEIB-UHFFFAOYSA-N	-1	0	366.402	2.768	50	0		FFAARM
CCOC(=O)c1ccc2ncc(S(=O)(=O)c3ccc(C)cc3)c([O-])c2c1	ZINC000013362907	220066250	/nfs/dbraw/zinc/06/62/50/220066250.db2.gz	YXXGOUMKTPNESI-UHFFFAOYSA-N	-1	0	371.414	2.846	50	0		FFAARM
O=C([O-])[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1cccc(CN2CCCC2=O)c1	ZINC000013428377	220066941	/nfs/dbraw/zinc/06/69/41/220066941.db2.gz	PRRZSSBNXHOCGO-SZMVWBNQSA-N	-1	0	370.449	2.667	50	0		FFAARM
O=C([O-])CCCC(=O)Nc1ccc(Cn2cc(Br)cn2)cc1	ZINC000013961030	220100321	/nfs/dbraw/zinc/10/03/21/220100321.db2.gz	LGGNOXQVXNCJOL-UHFFFAOYSA-N	-1	0	366.215	2.887	50	0		FFAARM
COc1ccc(OC)c(S(=O)(=O)[N-]c2cnn(Cc3ccccc3)c2)c1	ZINC000014227440	220118724	/nfs/dbraw/zinc/11/87/24/220118724.db2.gz	QFQIVHMHUNGMCI-UHFFFAOYSA-N	-1	0	373.434	2.749	50	0		FFAARM
CCc1c(C)sc2[n-]c(=S)n(CCCN3CCOCC3)c(=O)c12	ZINC000017073236	220202478	/nfs/dbraw/zinc/20/24/78/220202478.db2.gz	KTYFZLGNJMBDAY-UHFFFAOYSA-N	-1	0	353.513	2.714	50	0		FFAARM
O=c1c2c([n-]c(=S)n1CCN1CCOCC1)sc1c2CCCCC1	ZINC000017075153	220204127	/nfs/dbraw/zinc/20/41/27/220204127.db2.gz	OFLVRVZZRGMPPF-UHFFFAOYSA-N	-1	0	365.524	2.722	50	0		FFAARM
CCOc1ccc(-c2ccc(OCC[N-]C(=O)C(F)(F)F)nn2)cc1	ZINC000017314897	220213377	/nfs/dbraw/zinc/21/33/77/220213377.db2.gz	HOHHDHLIZCBONK-UHFFFAOYSA-N	-1	0	355.316	2.600	50	0		FFAARM
CCCOc1ccc(N2C(=O)C[C@@H](Nc3ccc(C(=O)[O-])cc3)C2=O)cc1	ZINC000019848544	220301013	/nfs/dbraw/zinc/30/10/13/220301013.db2.gz	AMMXNCBGDAKKEU-QGZVFWFLSA-N	-1	0	368.389	2.918	50	0		FFAARM
COc1cc2c(cc1OC)[C@H](c1c([O-])c3ccccc3oc1=O)NCC2	ZINC000020759067	220339982	/nfs/dbraw/zinc/33/99/82/220339982.db2.gz	HWRSRINZSFJLAW-GOSISDBHSA-N	-1	0	353.374	2.751	50	0	biogenic	FFAARM
Cc1cccc([N-]S(=O)(=O)c2ccc(-c3ccc(=O)[nH]n3)s2)c1C	ZINC000021531479	220360037	/nfs/dbraw/zinc/36/00/37/220360037.db2.gz	WKCGEGBNCJTAMQ-UHFFFAOYSA-N	-1	0	361.448	2.916	50	0		FFAARM
O=C([O-])c1cccc(S(=O)(=O)Nc2ccccc2Br)c1	ZINC000035277714	220774226	/nfs/dbraw/zinc/77/42/26/220774226.db2.gz	PPIWRJINAJFVPH-UHFFFAOYSA-N	-1	0	356.197	2.948	50	0		FFAARM
COc1ccc(CC(=O)[O-])cc1S(=O)(=O)Nc1ccc(Cl)cc1F	ZINC000048367954	221011064	/nfs/dbraw/zinc/01/10/64/221011064.db2.gz	ZGFQNBSACDOQIG-UHFFFAOYSA-N	-1	0	373.789	2.916	50	0		FFAARM
CCS(=O)(=O)c1ccc([N-]S(=O)(=O)c2cc(C)ccc2F)cc1	ZINC000055579673	221072123	/nfs/dbraw/zinc/07/21/23/221072123.db2.gz	YUDBYWBXRMCHDF-UHFFFAOYSA-N	-1	0	357.428	2.729	50	0		FFAARM
O=C([O-])c1cc(S(=O)(=O)Nc2ccc(Cl)cc2)cc2c1OCCO2	ZINC000057115645	221083824	/nfs/dbraw/zinc/08/38/24/221083824.db2.gz	PFWKPIZAJNIAOE-UHFFFAOYSA-N	-1	0	369.782	2.610	50	0		FFAARM
Cc1ccc(NS(=O)(=O)c2cc3c(c(C(=O)[O-])c2)OCCO3)cc1C	ZINC000057115556	221083998	/nfs/dbraw/zinc/08/39/98/221083998.db2.gz	VDWJYZIHNQAJFI-UHFFFAOYSA-N	-1	0	363.391	2.574	50	0		FFAARM
O=C(NCc1ccco1)C1CCN(C(=O)c2ccc([O-])c(Cl)c2)CC1	ZINC000058223136	221109304	/nfs/dbraw/zinc/10/93/04/221109304.db2.gz	LKZPOEKQLJRGHO-UHFFFAOYSA-N	-1	0	362.813	2.807	50	0		FFAARM
COc1cccc(NC(=O)C[C@@H]2Sc3cc(C(=O)[O-])ccc3NC2=O)c1	ZINC000061718376	221134441	/nfs/dbraw/zinc/13/44/41/221134441.db2.gz	WFCFENIRKJBXPO-HNNXBMFYSA-N	-1	0	372.402	2.835	50	0		FFAARM
COc1ccc([N-]S(=O)(=O)c2ccc(-c3nnc(C)o3)s2)cc1	ZINC000064919915	221156411	/nfs/dbraw/zinc/15/64/11/221156411.db2.gz	CCADRJHTUASDFX-UHFFFAOYSA-N	-1	0	351.409	2.916	50	0		FFAARM
C[C@H](c1nnc(SCC(=O)[O-])n1-c1ccccc1Cl)n1ccnc1	ZINC000067713469	221275566	/nfs/dbraw/zinc/27/55/66/221275566.db2.gz	PBTUGBMYAPSUCQ-SNVBAGLBSA-N	-1	0	363.830	2.903	50	0		FFAARM
COc1ccc(NC(=O)[C@@H]2[C@@H](C(=O)[O-])C2(C)C)cc1NC(=O)C1CCC1	ZINC000071285514	221338922	/nfs/dbraw/zinc/33/89/22/221338922.db2.gz	RBYPOAPBDUQLQN-GJZGRUSLSA-N	-1	0	360.410	2.729	50	0		FFAARM
O=C([O-])c1ccccc1CC(=O)Nc1cnn(Cc2ccccc2F)c1	ZINC000071283831	221339279	/nfs/dbraw/zinc/33/92/79/221339279.db2.gz	KXHMIQMWYXCFRR-UHFFFAOYSA-N	-1	0	353.353	2.950	50	0		FFAARM
COc1ccc(NC(=O)C2CCC2)c(NC(=O)[C@H]2[C@@H](C(=O)[O-])C2(C)C)c1	ZINC000071284128	221339601	/nfs/dbraw/zinc/33/96/01/221339601.db2.gz	MOJLNDNFKCVSHA-CABCVRRESA-N	-1	0	360.410	2.729	50	0		FFAARM
COc1ccc(CNC(=O)[C@H]2Cc3cc(C)c(C)cc3O2)cc1C(=O)[O-]	ZINC000299750940	533645316	/nfs/dbraw/zinc/64/53/16/533645316.db2.gz	OVGFQBCYVTXTJO-GOSISDBHSA-N	-1	0	355.390	2.630	50	0		FFAARM
O=C([O-])c1ccc(N2CCC[C@@]3(CCC(=O)N(C4CCCC4)C3)C2)nc1	ZINC000077428920	132184601	/nfs/dbraw/zinc/18/46/01/132184601.db2.gz	YTZMASMNHQLVNC-HXUWFJFHSA-N	-1	0	357.454	2.931	50	0		FFAARM
O=C([O-])C1(Oc2ccccc2F)CCN(c2ncnc3c2CCC3)CC1	ZINC000082137487	132197102	/nfs/dbraw/zinc/19/71/02/132197102.db2.gz	WGXMDMPCVOADEU-UHFFFAOYSA-N	-1	0	357.385	2.607	50	0		FFAARM
Cc1ccccc1CNc1ncc(C(C)(C)C(=O)[O-])c(N2CCOCC2)n1	ZINC000096140233	132220391	/nfs/dbraw/zinc/22/03/91/132220391.db2.gz	XLLBKZRSQGMLBP-UHFFFAOYSA-N	-1	0	370.453	2.596	50	0		FFAARM
C[C@H]1Oc2ccccc2N(CCC(=O)Nc2ccccc2C(=O)[O-])C1=O	ZINC000012990843	132865179	/nfs/dbraw/zinc/86/51/79/132865179.db2.gz	CVZUMJBFUCZPCJ-GFCCVEGCSA-N	-1	0	354.362	2.528	50	0		FFAARM
Cc1nn(C)c2ncc(C(=O)[O-])c(N3CCO[C@H](c4ccc(F)cc4)C3)c12	ZINC000071752789	136140289	/nfs/dbraw/zinc/14/02/89/136140289.db2.gz	UBOFAFGOJRLEAY-HNNXBMFYSA-N	-1	0	370.384	2.692	50	0		FFAARM
O=C([O-])CCc1cc2n(n1)CCCN(c1ccc(-c3ccccc3)nn1)C2	ZINC000072447388	221532977	/nfs/dbraw/zinc/53/29/77/221532977.db2.gz	KYFONRBKEZSSEL-UHFFFAOYSA-N	-1	0	363.421	2.768	50	0		FFAARM
COc1ccccc1OC1(C(=O)[O-])CCN(C(=O)[C@H]2CC23CCC3)CC1	ZINC000072462918	221539797	/nfs/dbraw/zinc/53/97/97/221539797.db2.gz	QWMNZSQETLWPDK-CQSZACIVSA-N	-1	0	359.422	2.710	50	0		FFAARM
COc1ccc(CNC(=O)[C@H](C)Oc2ccc(F)c(F)c2)cc1C(=O)[O-]	ZINC000095969563	221982964	/nfs/dbraw/zinc/98/29/64/221982964.db2.gz	BLEPQCRJRYLUJA-JTQLQIEISA-N	-1	0	365.332	2.755	50	0		FFAARM
O=C([O-])c1ccc(C(=O)N2CC[C@H](NC(=O)OCc3ccccc3)C2)cc1	ZINC000097137303	222163146	/nfs/dbraw/zinc/16/31/46/222163146.db2.gz	OLGSISOWPKLMNS-KRWDZBQOSA-N	-1	0	368.389	2.526	50	0		FFAARM
O=C([C@H]1CCCO1)N1CCCN(Cc2c(Cl)ccc([O-])c2Cl)CC1	ZINC000097776292	222213243	/nfs/dbraw/zinc/21/32/43/222213243.db2.gz	NSOOYFKCLWDJRV-OAHLLOKOSA-N	-1	0	373.280	2.912	50	0		FFAARM
COc1cccc(Cn2[nH][n-]c3c(=O)n(-c4ccc(Cl)cc4)c(=O)c2=3)c1	ZINC000101167176	222265158	/nfs/dbraw/zinc/26/51/58/222265158.db2.gz	STYUSGHAVRJFAX-HZPDHXFCSA-N	-1	0	370.796	2.842	50	0		FFAARM
Cc1ccccc1CN(C)C(=O)c1ccc2c(c1)[n-]c(=S)n(C)c2=O	ZINC000102176539	222290776	/nfs/dbraw/zinc/29/07/76/222290776.db2.gz	FWCDVFRIGQWJDL-UHFFFAOYSA-N	-1	0	353.447	2.803	50	0		FFAARM
Cc1c2c(cc(=O)n1Cc1cccnc1)[n-]n(-c1ccc(F)cc1)c2=O	ZINC000102492484	222298160	/nfs/dbraw/zinc/29/81/60/222298160.db2.gz	OYFFCJDBEXTECC-UHFFFAOYSA-N	-1	0	350.353	2.735	50	0		FFAARM
COc1ccc(CCC(=O)NCc2cc(=O)n(-c3ccccc3)[n-]2)cc1	ZINC000102710631	222305670	/nfs/dbraw/zinc/30/56/70/222305670.db2.gz	RJFOHQUYLOONBJ-UHFFFAOYSA-N	-1	0	351.406	2.836	50	0		FFAARM
COc1ccc([C@@H]2c3c(=O)[nH][nH]c3C[C@@](C)(O)[C@@H]2C(=O)OC(C)(C)C)cc1	ZINC000105989272	222380705	/nfs/dbraw/zinc/38/07/05/222380705.db2.gz	IWQOXAPTXUNOBD-PTSWNOGYSA-N	-1	0	374.437	2.521	50	0		FFAARM
CC(C)CC(=O)Nc1ccc(C(=O)N2CCCC[C@@H]2C(=O)[O-])cc1F	ZINC000159886066	222555115	/nfs/dbraw/zinc/55/51/15/222555115.db2.gz	HCOYKVNEUQUEME-OAHLLOKOSA-N	-1	0	350.390	2.890	50	0		FFAARM
O=C([O-])[C@H]1CCCCN1C(=O)C1CCN(c2nc3ccccc3s2)CC1	ZINC000159908083	222556074	/nfs/dbraw/zinc/55/60/74/222556074.db2.gz	PQQJAWOSLUWQBO-OAHLLOKOSA-N	-1	0	373.478	2.978	50	0		FFAARM
CCN1C(=O)c2ccc(C(=O)Nc3cc(C(=O)[O-])ccc3C)cc2C1=O	ZINC000001120434	263142751	/nfs/dbraw/zinc/14/27/51/263142751.db2.gz	AOISTMVNOWYWOQ-UHFFFAOYSA-N	-1	0	352.346	2.561	50	0		FFAARM
Cc1ccc(C(=O)COC(=O)c2ccc(NC(=O)CCC(=O)[O-])cc2)cc1	ZINC000004610651	263335249	/nfs/dbraw/zinc/33/52/49/263335249.db2.gz	HYOFXYDODSPGMF-UHFFFAOYSA-N	-1	0	369.373	2.838	50	0		FFAARM
COc1ccc([N-]S(=O)(=O)c2ccc(C)s2)cc1N1CCCC1=O	ZINC000005329688	263340410	/nfs/dbraw/zinc/34/04/10/263340410.db2.gz	FFDDAZBFNNQHKX-UHFFFAOYSA-N	-1	0	366.464	2.993	50	0		FFAARM
O=C([O-])Cn1nccc1[C@@H]1CCCN(C(=O)c2ccc3ccccc3n2)C1	ZINC000426580989	263637923	/nfs/dbraw/zinc/63/79/23/263637923.db2.gz	QESBDMWHSGXCDX-OAHLLOKOSA-N	-1	0	364.405	2.536	50	0		FFAARM
CN1C(=O)C(=Cc2ccc(OCc3ccc(C(=O)[O-])cc3)cc2)NC1=S	ZINC000001182138	506254205	/nfs/dbraw/zinc/25/42/05/506254205.db2.gz	KYQMNBJXRIVTHI-YBEGLDIGSA-N	-1	0	368.414	2.651	50	0		FFAARM
O=C([O-])[C@@H]1CCCC[C@H]1C(=O)N1CCN(C/C=C/c2ccccc2)CC1	ZINC000001469235	506263840	/nfs/dbraw/zinc/26/38/40/506263840.db2.gz	JQBIIYXKEFVGST-DCQHUWKXSA-N	-1	0	356.466	2.735	50	0		FFAARM
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](C(=O)[O-])C(C)C	ZINC000001572943	506266147	/nfs/dbraw/zinc/26/61/47/506266147.db2.gz	XISNUVNLGJKNIK-IMJJTQAJSA-N	-1	0	364.442	2.553	50	0		FFAARM
Cc1oc2c(cc3c(C)c(CC(=O)NCCC(=O)[O-])c(=O)oc3c2C)c1C	ZINC000002152499	506273208	/nfs/dbraw/zinc/27/32/08/506273208.db2.gz	BQFGRZXOYSPLJW-UHFFFAOYSA-N	-1	0	371.389	2.906	50	0	biogenic	FFAARM
CCN1CCCn2cc(S(=O)(=O)[N-]c3ccc(Cl)cc3)cc2C1=O	ZINC000065258771	506277683	/nfs/dbraw/zinc/27/76/83/506277683.db2.gz	BEKOARUKESSQNT-UHFFFAOYSA-N	-1	0	367.858	2.808	50	0		FFAARM
CCc1ccc(NC(=O)c2sc3[nH]c(=O)c(C(=O)[O-])cc3c2N)cc1	ZINC000002496957	506282276	/nfs/dbraw/zinc/28/22/76/506282276.db2.gz	PSFBYINNGCJNCT-UHFFFAOYSA-N	-1	0	357.391	2.685	50	0		FFAARM
CCn1cc(S(=O)(=O)[N-]c2ccn(Cc3ccc(Cl)cc3)n2)cn1	ZINC000002804569	506294723	/nfs/dbraw/zinc/29/47/23/506294723.db2.gz	URHCWFNMSAQABP-UHFFFAOYSA-N	-1	0	365.846	2.602	50	0		FFAARM
COc1ccc(S(=O)(=O)[N-]c2cnn(Cc3cccc(OC)c3)c2)cc1	ZINC000002804867	506295384	/nfs/dbraw/zinc/29/53/84/506295384.db2.gz	OIKJHMAXRZKXSM-UHFFFAOYSA-N	-1	0	373.434	2.749	50	0		FFAARM
O=C([O-])c1ccccc1NC(=O)c1ccc(NC(=O)[C@H]2CCCO2)cc1	ZINC000002879891	506300114	/nfs/dbraw/zinc/30/01/14/506300114.db2.gz	YRIJNBMCZCJELM-MRXNPFEDSA-N	-1	0	354.362	2.755	50	0		FFAARM
CC[C@H](C)NC(=O)c1ccc2c(c1)[n-]c(=S)n(Cc1ccco1)c2=O	ZINC000002970887	506305739	/nfs/dbraw/zinc/30/57/39/506305739.db2.gz	VQPWHVPOEKUIEI-NSHDSACASA-N	-1	0	357.435	2.855	50	0		FFAARM
COc1ccccc1CNC(=O)CCn1c(=O)c2ccccc2[n-]c1=S	ZINC000003043526	506307933	/nfs/dbraw/zinc/30/79/33/506307933.db2.gz	FUDULRHVNDHZMF-UHFFFAOYSA-N	-1	0	369.446	2.774	50	0		FFAARM
O=C([O-])c1cc(Br)cc(S(=O)(=O)N2CCCCCC2)c1	ZINC000033586192	506358682	/nfs/dbraw/zinc/35/86/82/506358682.db2.gz	FLSUSNUMQIUBRH-UHFFFAOYSA-N	-1	0	362.245	2.712	50	0		FFAARM
COc1ccc(C)cc1S(=O)(=O)[N-]c1cc2c3c(c1)CCCN3C(=O)C2	ZINC000004270428	506368082	/nfs/dbraw/zinc/36/80/82/506368082.db2.gz	RELUOWNQBLIXDB-UHFFFAOYSA-N	-1	0	372.446	2.640	50	0		FFAARM
COc1cc2c(cc1OC)[C@@H](C(=O)[O-])[C@@H](c1ccc(F)cc1)N(C)C2=O	ZINC000004563676	506382867	/nfs/dbraw/zinc/38/28/67/506382867.db2.gz	MIKLYYNEIZMHGU-IAGOWNOFSA-N	-1	0	359.353	2.838	50	0		FFAARM
CC[C@@H](C)[C@@H](NC(=O)N1CCC(c2nc3ccccc3[nH]2)CC1)C(=O)[O-]	ZINC000036579911	506406261	/nfs/dbraw/zinc/40/62/61/506406261.db2.gz	XSBUSYJZIAGEDP-MLGOLLRUSA-N	-1	0	358.442	2.951	50	0		FFAARM
Cc1nn(C)cc1-c1cc(C(=O)[O-])n2nc(-c3ccc(F)cc3)cc2n1	ZINC000036615661	506408588	/nfs/dbraw/zinc/40/85/88/506408588.db2.gz	HZJCFLROOUZBIC-UHFFFAOYSA-N	-1	0	351.341	2.943	50	0		FFAARM
Cc1ccc(NC(=O)CSc2nc3[nH]c(=O)cc([O-])c3s2)cc1F	ZINC000004945699	506409732	/nfs/dbraw/zinc/40/97/32/506409732.db2.gz	MOZUORHEPIXIEI-UHFFFAOYSA-N	-1	0	365.411	2.869	50	0		FFAARM
O=C([O-])COc1ccc(-c2nc(=O)c3c4c(sc3[nH]2)CCCC4)cc1	ZINC000005045080	506416802	/nfs/dbraw/zinc/41/68/02/506416802.db2.gz	DYSYCBHUHMPAMY-UHFFFAOYSA-N	-1	0	356.403	2.994	50	0		FFAARM
COc1ccc(C(=O)NCc2n[n-]c(=S)n2-c2ccccc2)c(OC)c1	ZINC000005128707	506424300	/nfs/dbraw/zinc/42/43/00/506424300.db2.gz	VFAWSBZPHIIRTJ-UHFFFAOYSA-N	-1	0	370.434	2.877	50	0		FFAARM
O=C([O-])c1cc(S(=O)(=O)Nc2ccc(Br)cc2)ccc1O	ZINC000005516161	506446293	/nfs/dbraw/zinc/44/62/93/506446293.db2.gz	RQJVYSSZBCFGDE-UHFFFAOYSA-N	-1	0	372.196	2.654	50	0		FFAARM
COc1cccc(C[C@H](C(=O)Nc2ccc(C)c(C)c2)c2nnn[n-]2)c1	ZINC000005518412	506447506	/nfs/dbraw/zinc/44/75/06/506447506.db2.gz	YWMAUZOEIPAJCR-KRWDZBQOSA-N	-1	0	351.410	2.790	50	0		FFAARM
CC[C@@H](NC(=O)Cc1c(C)c2c3occ(C)c3c(C)cc2oc1=O)C(=O)[O-]	ZINC000006624256	506491660	/nfs/dbraw/zinc/49/16/60/506491660.db2.gz	PWYUJWJDHJNQJB-CYBMUJFWSA-N	-1	0	371.389	2.986	50	0	biogenic	FFAARM
COC(=O)c1ccc(Nc2nnc(Cc3ccc(Cl)cc3)c(=O)[n-]2)cc1	ZINC000006721963	506500890	/nfs/dbraw/zinc/50/08/90/506500890.db2.gz	PRFSKPMKCVEQEW-UHFFFAOYSA-N	-1	0	370.796	2.939	50	0		FFAARM
O=S(=O)([N-]c1ccc(-n2cnnn2)cc1)c1cc(Cl)ccc1Cl	ZINC000007051817	506529099	/nfs/dbraw/zinc/52/90/99/506529099.db2.gz	ALVVRSPSGKGHGF-UHFFFAOYSA-N	-1	0	370.221	2.770	50	0		FFAARM
COc1ccc(OC)c(S(=O)(=O)[N-]c2ccc3c(c2)OC(F)(F)O3)c1	ZINC000007726563	506584173	/nfs/dbraw/zinc/58/41/73/506584173.db2.gz	FPSFGOGEFGUYRA-UHFFFAOYSA-N	-1	0	373.333	2.826	50	0		FFAARM
COc1cc(C(=O)[N-]S(C)(=O)=O)ccc1OCc1ccccc1Cl	ZINC000042278748	506614495	/nfs/dbraw/zinc/61/44/95/506614495.db2.gz	YTEWOKHFYCXGAR-UHFFFAOYSA-N	-1	0	369.826	2.617	50	0		FFAARM
CSc1nnc(SCC(=O)c2ccc([O-])c(NC(C)=O)c2)s1	ZINC000008881435	506672821	/nfs/dbraw/zinc/67/28/21/506672821.db2.gz	LDXBVGRBNSYXDO-UHFFFAOYSA-N	-1	0	355.466	2.899	50	0		FFAARM
O=C(CSc1nc2ccccc2o1)N[C@@H](Cc1ccccc1)C(=O)[O-]	ZINC000009026959	506677797	/nfs/dbraw/zinc/67/77/97/506677797.db2.gz	UQDMWDZYPGVNMA-AWEZNQCLSA-N	-1	0	356.403	2.732	50	0		FFAARM
Cc1ccc2c(c1)C[C@]1(CN2C)C(=O)[N-]C(=O)N(c2ccccc2C)C1=O	ZINC000009087711	506682159	/nfs/dbraw/zinc/68/21/59/506682159.db2.gz	PWOCMFZIMZKXHI-NRFANRHFSA-N	-1	0	363.417	2.770	50	0		FFAARM
COc1cccc(C=CC(=O)N(C)Cc2nc(=O)c3sccc3[n-]2)c1	ZINC000010720944	506752003	/nfs/dbraw/zinc/75/20/03/506752003.db2.gz	ZDXVXGJXWOKUBG-VOTSOKGWSA-N	-1	0	355.419	2.665	50	0		FFAARM
O=C1CCCN1c1ccccc1[N-]S(=O)(=O)c1cc(F)cc(F)c1	ZINC000012552607	506878273	/nfs/dbraw/zinc/87/82/73/506878273.db2.gz	VRWWUYUOUTZXCC-UHFFFAOYSA-N	-1	0	352.362	2.892	50	0		FFAARM
Cc1cc(-c2cccc(S(=O)(=O)NCCC(=O)[O-])c2)nc2ccccc12	ZINC000013317116	506937815	/nfs/dbraw/zinc/93/78/15/506937815.db2.gz	NLHZQEXWSWILGU-UHFFFAOYSA-N	-1	0	370.430	2.963	50	0		FFAARM
COc1cccc(-n2c(=O)c3[n-][nH]n(-c4ccc(C)c(F)c4)c=3c2=O)c1	ZINC000023125916	507332235	/nfs/dbraw/zinc/33/22/35/507332235.db2.gz	IYJZKTTYPQKFPS-HZPDHXFCSA-N	-1	0	354.341	2.641	50	0		FFAARM
O=C([O-])C1(n2ccnc2)CCN(C(=O)c2scc3c2CCCC3)CC1	ZINC000072433794	507790494	/nfs/dbraw/zinc/79/04/94/507790494.db2.gz	CHVYPKDDARAIIH-UHFFFAOYSA-N	-1	0	359.451	2.540	50	0		FFAARM
CC1(C)C[C@@]1(C(=O)N1CCn2nc(CCC(=O)[O-])cc2C1)c1cccs1	ZINC000072469294	507794805	/nfs/dbraw/zinc/79/48/05/507794805.db2.gz	WBRZHQNKSJFJQG-IBGZPJMESA-N	-1	0	373.478	2.672	50	0		FFAARM
O=C(Nc1cccc(Cn2cccnc2=O)c1)c1cc(Cl)ccc1[O-]	ZINC000079832823	508004940	/nfs/dbraw/zinc/00/49/40/508004940.db2.gz	XUCJWMNXSDKPPF-UHFFFAOYSA-N	-1	0	355.781	2.903	50	0		FFAARM
Cc1ccccc1[C@@H]1CN(C(=O)c2cnc(C3CC3)nc2)C[C@H]1C(=O)[O-]	ZINC000091831172	508017226	/nfs/dbraw/zinc/01/72/26/508017226.db2.gz	GCOPAYGGZOFDPL-DLBZAZTESA-N	-1	0	351.406	2.603	50	0		FFAARM
COc1ccc(CC(=O)[O-])c(Sc2ccc(S(C)(=O)=O)cc2)c1	ZINC000075284483	508093919	/nfs/dbraw/zinc/09/39/19/508093919.db2.gz	RUHDOQQWHYPWGA-UHFFFAOYSA-N	-1	0	352.433	2.877	50	0		FFAARM
CN(CC(=O)N1CCC[C@@H](c2cccc(C(=O)[O-])c2)C1)Cc1ccccn1	ZINC000095371130	508178382	/nfs/dbraw/zinc/17/83/82/508178382.db2.gz	NLXKHPCAGRNXBX-GOSISDBHSA-N	-1	0	367.449	2.618	50	0		FFAARM
Cc1c[nH]c(CN(C)[C@H](C(=O)[O-])c2ccc(NC(=O)N3CCCC3)cc2)n1	ZINC000095376916	508180074	/nfs/dbraw/zinc/18/00/74/508180074.db2.gz	VHTMSWGPHBRGQM-KRWDZBQOSA-N	-1	0	371.441	2.604	50	0		FFAARM
Cc1nc2ncccn2c1C(=O)N1CCC[C@@H](c2ccc(C(=O)[O-])cc2)C1	ZINC000095383105	508181241	/nfs/dbraw/zinc/18/12/41/508181241.db2.gz	UTDSCUBPHFFRMV-MRXNPFEDSA-N	-1	0	364.405	2.756	50	0		FFAARM
O=C([O-])c1ccc([C@@H]2CCCN(C(=O)CCCN3CCCCC3=O)C2)cc1	ZINC000095391141	508183899	/nfs/dbraw/zinc/18/38/99/508183899.db2.gz	LNFAFNYJMJSDMB-GOSISDBHSA-N	-1	0	372.465	2.884	50	0		FFAARM
COc1ccccc1C[C@@H](CNC(=O)Cc1ccc(C)c(OC)c1)C(=O)[O-]	ZINC000095464098	508187031	/nfs/dbraw/zinc/18/70/31/508187031.db2.gz	AYDGNSLIEQXUOO-KRWDZBQOSA-N	-1	0	371.433	2.614	50	0		FFAARM
O=c1c2[n-][nH]n(Cc3ccc(F)cc3)c=2c(=O)n1-c1ccc(F)c(F)c1	ZINC000095481463	508189139	/nfs/dbraw/zinc/18/91/39/508189139.db2.gz	XVHSDCKQGRBAFF-LSDHHAIUSA-N	-1	0	360.295	2.597	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)c2csc(-c3cccs3)n2)C[C@H]1c1ncc[nH]1	ZINC000095503103	508190984	/nfs/dbraw/zinc/19/09/84/508190984.db2.gz	PQBFHEIYWYSTPI-NXEZZACHSA-N	-1	0	374.447	2.535	50	0		FFAARM
O=C([O-])C[C@H]1c2ccccc2CCN1C(=O)COc1ccc(F)cc1F	ZINC000095526711	508196406	/nfs/dbraw/zinc/19/64/06/508196406.db2.gz	GWDZLIXYNQKJEZ-INIZCTEOSA-N	-1	0	361.344	2.944	50	0		FFAARM
CCOc1ccc(-c2ccnc(NCc3cc(C)nn3C)n2)cc1C(=O)[O-]	ZINC000077470196	508319881	/nfs/dbraw/zinc/31/98/81/508319881.db2.gz	NYVNOYCMNTVNCW-UHFFFAOYSA-N	-1	0	367.409	2.895	50	0		FFAARM
O=C([O-])[C@H]1CCCN(C(=O)c2ccc(CNC(=O)c3cccs3)cc2)C1	ZINC000136144922	508674188	/nfs/dbraw/zinc/67/41/88/508674188.db2.gz	ANECDUYFYRRPJP-HNNXBMFYSA-N	-1	0	372.446	2.615	50	0		FFAARM
COCc1nc(C)c(C(=O)[N-]S(=O)(=O)Cc2ccccc2Cl)s1	ZINC000132799345	509076441	/nfs/dbraw/zinc/07/64/41/509076441.db2.gz	JMSBUJJZOSJFFK-UHFFFAOYSA-N	-1	0	374.871	2.511	50	0		FFAARM
O=S(=O)([N-][C@@H](c1cccnc1)C1CCOCC1)c1c(F)cccc1F	ZINC000225624104	509380874	/nfs/dbraw/zinc/38/08/74/509380874.db2.gz	MTGNSORHOHVPNV-MRXNPFEDSA-N	-1	0	368.405	2.806	50	0		FFAARM
COc1cc(C(=O)N2CCC[C@@H]2C(=O)[O-])ccc1OCc1ccccc1	ZINC000225967400	509394903	/nfs/dbraw/zinc/39/49/03/509394903.db2.gz	FNEKGOGRVKREEK-MRXNPFEDSA-N	-1	0	355.390	2.963	50	0		FFAARM
CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)NCc1ccc(C(=O)[O-])o1	ZINC000236825203	509511929	/nfs/dbraw/zinc/51/19/29/509511929.db2.gz	VRDSQEYBNQQJHJ-INIZCTEOSA-N	-1	0	354.362	2.558	50	0		FFAARM
COc1ccccc1-c1nc(C(=O)[N-]S(=O)(=O)CC2CCC2)cs1	ZINC000164835744	509537994	/nfs/dbraw/zinc/53/79/94/509537994.db2.gz	ILAAXOCDTOZQEM-UHFFFAOYSA-N	-1	0	366.464	2.678	50	0		FFAARM
COc1ccc([C@@H]2CCCCCN2C(=O)CN2CCC[C@H]2C(=O)[O-])cc1	ZINC000237286169	509612891	/nfs/dbraw/zinc/61/28/91/509612891.db2.gz	SBAGCOZGVRZKAK-ROUUACIJSA-N	-1	0	360.454	2.688	50	0		FFAARM
Cc1cc(C)n(-c2ccc(C(=O)N(CCC(=O)[O-])C3CCOCC3)cc2)n1	ZINC000237679741	509708027	/nfs/dbraw/zinc/70/80/27/509708027.db2.gz	SHGNEUAAPFJFFC-UHFFFAOYSA-N	-1	0	371.437	2.585	50	0		FFAARM
Cc1cccc(C[C@H](CNC(=O)c2ncoc2[C@H]2CCCO2)C(=O)[O-])c1	ZINC000237698465	509713331	/nfs/dbraw/zinc/71/33/31/509713331.db2.gz	FYUJPMMLFWZRQH-HUUCEWRRSA-N	-1	0	358.394	2.508	50	0		FFAARM
O=C([O-])[C@H]1Cc2ccccc2CN1C(=O)Cc1coc(-c2ccccc2)n1	ZINC000238031987	509804886	/nfs/dbraw/zinc/80/48/86/509804886.db2.gz	BUOHDJLWJZATGM-GOSISDBHSA-N	-1	0	362.385	2.922	50	0		FFAARM
O=C([O-])CCN(C(=O)[C@H]1C[C@H]1c1ccccc1Cl)C1CCOCC1	ZINC000238070685	509814286	/nfs/dbraw/zinc/81/42/86/509814286.db2.gz	NOZDHAGARZLPEM-GJZGRUSLSA-N	-1	0	351.830	2.926	50	0		FFAARM
O=C([O-])[C@H]1CCCN(C(=O)CCc2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000238069023	509815053	/nfs/dbraw/zinc/81/50/53/509815053.db2.gz	BHYNLIPFYAIDHE-LBPRGKRZSA-N	-1	0	363.801	2.646	50	0		FFAARM
O=C([O-])CN(C(=O)[C@@H]1C[C@@H]1c1cccc(C(F)(F)F)c1)C1CCOCC1	ZINC000238103237	509821704	/nfs/dbraw/zinc/82/17/04/509821704.db2.gz	LWCHWTCZLNNJBI-HUUCEWRRSA-N	-1	0	371.355	2.901	50	0		FFAARM
O=C([O-])[C@H]1CCN(C(=O)CCc2nc3ccccc3n2-c2ccccc2)C1	ZINC000238136106	509825275	/nfs/dbraw/zinc/82/52/75/509825275.db2.gz	BKVYZGQQLNKNHC-HNNXBMFYSA-N	-1	0	363.417	2.891	50	0		FFAARM
O=C([O-])[C@H]1CN(C(=O)c2cc3ccccc3n2Cc2ccccc2)CCO1	ZINC000238143349	509826727	/nfs/dbraw/zinc/82/67/27/509826727.db2.gz	QSELGQZXFKWNIA-LJQANCHMSA-N	-1	0	364.401	2.615	50	0		FFAARM
Cc1nc(NC(=O)CN(Cc2ncccc2C)C(C)C)sc1C(=O)[O-]	ZINC000244882856	509876095	/nfs/dbraw/zinc/87/60/95/509876095.db2.gz	YALDTBHGELBDQN-UHFFFAOYSA-N	-1	0	362.455	2.702	50	0		FFAARM
CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@H]1CC[C@H](C(=O)[O-])CC1	ZINC000245325956	509886335	/nfs/dbraw/zinc/88/63/35/509886335.db2.gz	IEOLDSBHYKJJDA-IHRRRGAJSA-N	-1	0	356.463	2.543	50	0		FFAARM
CCOc1c(Cl)cc(CNC(=O)c2cc(C(=O)[O-])co2)cc1OC	ZINC000262416010	510272883	/nfs/dbraw/zinc/27/28/83/510272883.db2.gz	ZAQJHDDUHQXRRV-UHFFFAOYSA-N	-1	0	353.758	2.969	50	0		FFAARM
CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)NC[C@@H](CC(C)C)C(=O)[O-]	ZINC000262424436	510275215	/nfs/dbraw/zinc/27/52/15/510275215.db2.gz	DBVDQDGGHLUWHK-AEFFLSMTSA-N	-1	0	358.438	2.814	50	0		FFAARM
Cc1ccc(-c2noc(CCC(=O)N3CCC[C@@H]3CC(=O)[O-])n2)cc1F	ZINC000262917381	510475740	/nfs/dbraw/zinc/47/57/40/510475740.db2.gz	KBPJAEVTKZAHHI-CYBMUJFWSA-N	-1	0	361.373	2.582	50	0		FFAARM
CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)NCc1cc(C(=O)[O-])c(C)o1	ZINC000262992861	510512129	/nfs/dbraw/zinc/51/21/29/510512129.db2.gz	OOFIBGBGXFIXHI-SFHVURJKSA-N	-1	0	368.389	2.867	50	0		FFAARM
C/C(=C\C(=O)N1CCO[C@H](CC(=O)[O-])C1)c1ccccc1C(F)(F)F	ZINC000271918432	511370338	/nfs/dbraw/zinc/37/03/38/511370338.db2.gz	SXSNEJGJITZUHH-JATZPVMKSA-N	-1	0	357.328	2.811	50	0		FFAARM
C[C@@H](NC(=O)N1CCC[C@@H]1C(=O)[O-])c1ccc(OCC(F)(F)F)cc1	ZINC000555848205	517153171	/nfs/dbraw/zinc/15/31/71/517153171.db2.gz	FJHXADZNHNELGQ-ZWNOBZJWSA-N	-1	0	360.332	2.947	50	0		FFAARM
O=C([O-])CCc1ccc(-c2ccc([C@H](O)CN3CCOCC3)cc2)cc1	ZINC000534662616	517989887	/nfs/dbraw/zinc/98/98/87/517989887.db2.gz	YWAUFBSRLKZKQR-HXUWFJFHSA-N	-1	0	355.434	2.736	50	0		FFAARM
O=C(NCc1n[nH]c(=O)[n-]1)N[C@H]1CC2(CCCCC2)Oc2ccccc21	ZINC000584902871	518532046	/nfs/dbraw/zinc/53/20/46/518532046.db2.gz	YTCVOZMODACNER-ZDUSSCGKSA-N	-1	0	357.414	2.536	50	0		FFAARM
O=C([O-])c1cccc(C(=O)Nc2ccc(CCN3CCOCC3)cc2)c1	ZINC000578441796	519595402	/nfs/dbraw/zinc/59/54/02/519595402.db2.gz	AZMLJVLJDUDOAF-UHFFFAOYSA-N	-1	0	354.406	2.512	50	0		FFAARM
CCC[C@@H](NC(=O)CSc1ccc(Br)cc1)c1nnn[n-]1	ZINC000089949578	520733811	/nfs/dbraw/zinc/73/38/11/520733811.db2.gz	JTGJJBQMJNNGET-LLVKDONJSA-N	-1	0	370.276	2.712	50	0		FFAARM
Cc1nc(COc2cccc(/C=C\C(=O)N3CC[C@H](C(=O)[O-])C3)c2)cs1	ZINC000606441990	521069394	/nfs/dbraw/zinc/06/93/94/521069394.db2.gz	VAPRWQWJYSLSOV-YVACAVLKSA-N	-1	0	372.446	2.977	50	0		FFAARM
Cn1cc(/C=C\C(=O)N(CCC(=O)[O-])C2CCOCC2)c2ccccc21	ZINC000606441379	521069431	/nfs/dbraw/zinc/06/94/31/521069431.db2.gz	QSGPTIIGIJPUOK-SREVYHEPSA-N	-1	0	356.422	2.674	50	0		FFAARM
Cn1nccc1C1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H](C(=O)[O-])c1ccccc1	ZINC000634921658	521814390	/nfs/dbraw/zinc/81/43/90/521814390.db2.gz	LFZMJAMLSHMJLD-HQSKLWIPSA-N	-1	0	367.449	2.916	50	0		FFAARM
C[C@@H]1C[C@H](C(=O)N[C@H](c2ccccc2)c2ccc(F)cc2)O[C@H]1C(=O)[O-]	ZINC000630110621	522625787	/nfs/dbraw/zinc/62/57/87/522625787.db2.gz	XBFKOUVRRCAGHD-BDQAWRDZSA-N	-1	0	357.381	2.910	50	0		FFAARM
CC1=NN(c2ccc(C(=O)N[C@H](C)c3ncc(C(=O)[O-])s3)cc2)CC1	ZINC000621608703	522967722	/nfs/dbraw/zinc/96/77/22/522967722.db2.gz	XDIIVBQJXKUDLR-LLVKDONJSA-N	-1	0	358.423	2.918	50	0		FFAARM
CN1C(=O)C[C@@H](C(=O)N[C@H](CC(=O)[O-])c2ccc(F)cc2)c2ccccc21	ZINC000299750015	523699533	/nfs/dbraw/zinc/69/95/33/523699533.db2.gz	MKHBBMVXKZFPLJ-HZPDHXFCSA-N	-1	0	370.380	2.608	50	0		FFAARM
Cc1noc(-c2ccc(C(=O)N3[C@@H]4CCCC[C@@H]4C[C@H]3C(=O)[O-])cc2)n1	ZINC000299742667	534874823	/nfs/dbraw/zinc/87/48/23/534874823.db2.gz	IERWBAYNEFRYMF-OAGGEKHMSA-N	-1	0	355.394	2.903	50	0		FFAARM
O=C([O-])[C@H]1CCN(C(=O)/C=C/c2ccc(OCc3ccccn3)cc2)C1	ZINC000178260525	526326311	/nfs/dbraw/zinc/32/63/11/526326311.db2.gz	TZHHWZDVUYKEAQ-FSNWXROXSA-N	-1	0	352.390	2.607	50	0		FFAARM
O=S(=O)([N-]CCn1ccc(-c2ccsc2)n1)c1c(F)cccc1F	ZINC000217892893	527222451	/nfs/dbraw/zinc/22/24/51/527222451.db2.gz	LYSXVLXJPXLSFS-UHFFFAOYSA-N	-1	0	369.418	2.868	50	0		FFAARM
O=C([O-])[C@H]1CCCN(C(=O)C2(c3ccc(Cl)cc3)CCOCC2)C1	ZINC000109621831	570928825	/nfs/dbraw/zinc/92/88/25/570928825.db2.gz	JUBPLWMIPAMFQV-ZDUSSCGKSA-N	-1	0	351.830	2.711	50	0		FFAARM
O=C(c1ccc2[n-]c(=S)oc2c1)N1CCN(c2ccccc2O)CC1	ZINC000118758011	571176854	/nfs/dbraw/zinc/17/68/54/571176854.db2.gz	MFHBQONCWHDOGQ-UHFFFAOYSA-N	-1	0	355.419	2.785	50	0		FFAARM
O=C([O-])[C@H]1c2ccccc2CCN1C(=O)c1ccc2c(c1)CCCC(=O)N2	ZINC000663145270	601492377	/nfs/dbraw/zinc/49/23/77/601492377.db2.gz	WRGHATDUVQZLEM-LJQANCHMSA-N	-1	0	364.401	2.786	50	0		FFAARM
C[C@@H](C(=O)[O-])C(=O)NCc1ccc(Br)cc1C(F)(F)F	ZINC000263550873	729692013	/nfs/dbraw/zinc/69/20/13/729692013.db2.gz	KSPQLUVZNNFEFC-ZCFIWIBFSA-N	-1	0	354.122	2.805	50	0		FFAARM
CCCn1nccc1C(=O)N1C[C@@H](c2ccc(Cl)cc2)[C@H](C(=O)[O-])C1	ZINC000659151986	731944785	/nfs/dbraw/zinc/94/47/85/731944785.db2.gz	VKTLLNZPMHHFJT-LSDHHAIUSA-N	-1	0	361.829	2.887	50	0		FFAARM
O=C([O-])CN(C(=O)/C=C(\c1ccccc1)C(F)(F)F)C1CCOCC1	ZINC000584907997	845947487	/nfs/dbraw/zinc/94/74/87/845947487.db2.gz	KSOXZAAMDQELEP-GXDHUFHOSA-N	-1	0	357.328	2.725	50	0		FFAARM
C[C@@H]1Oc2c(cccc2C(=O)N2CC[C@H](C(=O)[O-])c3ccccc32)NC1=O	ZINC000669435601	984589524	/nfs/dbraw/zinc/58/95/24/984589524.db2.gz	LHXICFSQTQVXBD-AAEUAGOBSA-N	-1	0	366.373	2.625	50	0		FFAARM
Cc1c(C(=O)[O-])sc2[nH]cnc(=N[C@H]3C[C@H](CO)c4ccccc43)c12	ZINC000952876055	1011006040	/nfs/dbraw/zinc/00/60/40/1011006040.db2.gz	ZTNFTAHQYOQDIS-MFKMUULPSA-N	-1	0	355.419	2.753	50	0		FFAARM
CN(Cc1noc(C2CCCC2)n1)C(=O)c1[n-]c(=O)nc2ccccc21	ZINC000020149155	1022557979	/nfs/dbraw/zinc/55/79/79/1022557979.db2.gz	BJNJHZPCOLFEDL-UHFFFAOYSA-N	-1	0	353.382	2.648	50	0		FFAARM
C[C@H](NC(=O)Nc1cccnc1-c1cnn(C)c1)[C@@H]1C[C@H](C(=O)[O-])C1(C)C	ZINC000653544472	1024938996	/nfs/dbraw/zinc/93/89/96/1024938996.db2.gz	YXTKNRNNJASKRD-FPMFFAJLSA-N	-1	0	371.441	2.739	50	0		FFAARM
CN1C(=O)CCc2cc(C(=O)N3CC[C@@H](C(=O)[O-])c4ccccc43)ccc21	ZINC000669434759	1027936641	/nfs/dbraw/zinc/93/66/41/1027936641.db2.gz	XOMQNPSNJCRTND-MRXNPFEDSA-N	-1	0	364.401	2.814	50	0		FFAARM
CN(Cc1ccc(C(=O)[O-])cc1)C(=O)[C@H]1C[C@H]1c1ccc2c(c1)OCCO2	ZINC000299747615	529983970	/nfs/dbraw/zinc/98/39/70/529983970.db2.gz	DKFLKNCHKFSRKF-IRXDYDNUSA-N	-1	0	367.401	2.918	50	0		FFAARM
Cc1cccc(C)c1NC(=O)c1cc(S(N)(=O)=O)c(Cl)cc1[O-]	ZINC000000538538	219305360	/nfs/dbraw/zinc/30/53/60/219305360.db2.gz	MTZBBNMLMNBNJL-UHFFFAOYSA-N	-1	0	354.815	2.562	50	0	world	FFAARM
CCC(=O)[N-]S(=O)(=O)c1ccc(NC(=O)c2ccccc2Cl)cc1	ZINC000000663272	219310386	/nfs/dbraw/zinc/31/03/86/219310386.db2.gz	WZKVBHHMHYIXMH-UHFFFAOYSA-N	-1	0	366.826	2.807	50	0		FFAARM
CCOC(=O)c1sc(NC(=O)C(F)(F)F)c(C(=O)OCC)c1C	ZINC000000721759	219317274	/nfs/dbraw/zinc/31/72/74/219317274.db2.gz	UOPNPLXVIHOYFT-UHFFFAOYSA-N	-1	0	353.318	2.911	50	0		FFAARM
O=C([O-])[C@H]1CC=CC[C@H]1C(=O)Nc1ccc(C(=O)Nc2ccccn2)cc1	ZINC000000794591	219321305	/nfs/dbraw/zinc/32/13/05/219321305.db2.gz	YWBYNQIDGROGDX-CVEARBPZSA-N	-1	0	365.389	2.939	50	0		FFAARM
O=C([O-])c1cccc(NC2=C(Cl)C(=O)N(CCc3ccccc3)C2=O)c1	ZINC000000938534	219343158	/nfs/dbraw/zinc/34/31/58/219343158.db2.gz	XBKFBHQZGILPBD-UHFFFAOYSA-N	-1	0	370.792	2.859	50	0		FFAARM
CC(=O)[N-]S(=O)(=O)c1ccc(NC(=O)c2cccc3ccccc32)cc1	ZINC000000996627	219351242	/nfs/dbraw/zinc/35/12/42/219351242.db2.gz	DVVUVEQXLOVRGH-UHFFFAOYSA-N	-1	0	368.414	2.917	50	0		FFAARM
CCOC(=O)Cc1csc([N-]S(=O)(=O)c2ccc(SC)cc2)n1	ZINC000001059743	219360990	/nfs/dbraw/zinc/36/09/90/219360990.db2.gz	ATSHFHKMSVYVPH-UHFFFAOYSA-N	-1	0	372.493	2.771	50	0		FFAARM
O=C([N-]N1C(=O)/C(=C/c2cccnc2)SC1=S)c1ccccc1F	ZINC000001093893	219368866	/nfs/dbraw/zinc/36/88/66/219368866.db2.gz	MZSCESBJSMQING-JYRVWZFOSA-N	-1	0	359.407	2.767	50	0		FFAARM
CCOC(=O)c1ccccc1[N-]S(=O)(=O)c1ccc(NC(C)=O)cc1	ZINC000001215327	219389948	/nfs/dbraw/zinc/38/99/48/219389948.db2.gz	RAGDRHAUNCLMIK-UHFFFAOYSA-N	-1	0	362.407	2.623	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)c1nc(N2CCCC2)ncc1Cl)c1ccccc1	ZINC000238185874	222914378	/nfs/dbraw/zinc/91/43/78/222914378.db2.gz	ILDSFWFXYUKNNK-CQSZACIVSA-N	-1	0	374.828	2.676	50	0		FFAARM
O=C([O-])C1CCN(S(=O)(=O)c2ccc(Cl)c(C(F)(F)F)c2)CC1	ZINC000003369820	219504769	/nfs/dbraw/zinc/50/47/69/219504769.db2.gz	LUVBPRSIHUQMSZ-UHFFFAOYSA-N	-1	0	371.764	2.844	50	0		FFAARM
CCOc1ccc(-n2nnc(C(=O)Nc3ccc(C(=O)[O-])cc3)c2C)cc1	ZINC000004511627	219581895	/nfs/dbraw/zinc/58/18/95/219581895.db2.gz	HFDYXYNHRWZXJM-UHFFFAOYSA-N	-1	0	366.377	2.925	50	0		FFAARM
COc1ccc(C2(C(=O)N3CC[C@H](C(=O)[O-])C3)CCCCC2)cc1OC	ZINC000299741399	223079318	/nfs/dbraw/zinc/07/93/18/223079318.db2.gz	FQXJZCPDMZXGFE-AWEZNQCLSA-N	-1	0	361.438	2.839	50	0		FFAARM
Cc1c(C(=O)[O-])cnn1-c1ccc(C(=O)N[C@@H]2CCC[C@H]3OCC[C@@H]32)cc1	ZINC000299746473	223079356	/nfs/dbraw/zinc/07/93/56/223079356.db2.gz	XPVIPDGFDPGVPT-KBAYOESNSA-N	-1	0	369.421	2.566	50	0		FFAARM
Cc1c(Br)cccc1C(=O)N(CCC(=O)[O-])C1CCOCC1	ZINC000299753383	223080468	/nfs/dbraw/zinc/08/04/68/223080468.db2.gz	YAPNIJPLENHQNI-UHFFFAOYSA-N	-1	0	370.243	2.853	50	0		FFAARM
COc1ccc(C(=O)CSc2nc([O-])cc(=O)n2-c2ccccc2)cc1	ZINC000009193510	219876210	/nfs/dbraw/zinc/87/62/10/219876210.db2.gz	ZHKBWVOIEGAFHZ-UHFFFAOYSA-N	-1	0	368.414	2.922	50	0		FFAARM
Cc1ccc(C(=O)NCCn2c(=O)c3ccccc3[n-]c2=S)cc1F	ZINC000012539276	220004900	/nfs/dbraw/zinc/00/49/00/220004900.db2.gz	LVQNSZCZVLEZIW-UHFFFAOYSA-N	-1	0	357.410	2.937	50	0		FFAARM
COc1ccc(C(=O)[O-])cc1S(=O)(=O)N(C)Cc1sccc1C	ZINC000013088988	220057424	/nfs/dbraw/zinc/05/74/24/220057424.db2.gz	QCPCAKBBIDFWBK-UHFFFAOYSA-N	-1	0	355.437	2.584	50	0		FFAARM
O=C([O-])C[C@H]1Sc2nnc(-c3ccco3)n2N=C1c1ccc(F)cc1	ZINC000013182387	220061514	/nfs/dbraw/zinc/06/15/14/220061514.db2.gz	NBSKPXVTIAGNDC-GFCCVEGCSA-N	-1	0	358.354	2.879	50	0		FFAARM
CSc1ccccc1[N-]C(=S)Nc1ccc(S(N)(=O)=O)cc1	ZINC000013544963	220071706	/nfs/dbraw/zinc/07/17/06/220071706.db2.gz	YINCUMWULRUESF-UHFFFAOYSA-N	-1	0	353.494	2.865	50	0		FFAARM
COc1ccc(OC)c([C@H](C)NC(=O)COc2cccc(C(=O)[O-])c2)c1	ZINC000013419279	220066859	/nfs/dbraw/zinc/06/68/59/220066859.db2.gz	NMXBHASRROCAGP-LBPRGKRZSA-N	-1	0	359.378	2.658	50	0		FFAARM
CC[C@H](C)[C@H](NC(=O)N1CCC(c2nc3ccccc3[nH]2)CC1)C(=O)[O-]	ZINC000013654341	220081440	/nfs/dbraw/zinc/08/14/40/220081440.db2.gz	XSBUSYJZIAGEDP-LRDDRELGSA-N	-1	0	358.442	2.951	50	0		FFAARM
CC[C@@H]1CCc2c(sc(NC(=O)C[C@H](C)CC(=O)[O-])c2C(N)=O)C1	ZINC000017073063	220202452	/nfs/dbraw/zinc/20/24/52/220202452.db2.gz	MGXNAIHDNDGLSA-VHSXEESVSA-N	-1	0	352.456	2.801	50	0		FFAARM
Cc1ccccc1-n1[n-]c(CSc2nnnn2-c2ccccc2)cc1=O	ZINC000017832027	220217305	/nfs/dbraw/zinc/21/73/05/220217305.db2.gz	IHCZIRQDMTZIHW-UHFFFAOYSA-N	-1	0	364.434	2.742	50	0		FFAARM
Cc1cccc([N-]S(=O)(=O)c2cc(Br)cnc2N)c1C	ZINC000020467571	220327263	/nfs/dbraw/zinc/32/72/63/220327263.db2.gz	QUWYHENNHHEPMG-UHFFFAOYSA-N	-1	0	356.245	2.844	50	0		FFAARM
COc1cc2c(cc1OC)[C@@H](CC(=O)[O-])N(C(=O)[C@@H]1CC=CCC1)CC2	ZINC000299742045	533172913	/nfs/dbraw/zinc/17/29/13/533172913.db2.gz	GMYDEYVOPCBYEE-CZUORRHYSA-N	-1	0	359.422	2.961	50	0		FFAARM
COc1ccc(C(N)=O)cc1[N-]S(=O)(=O)c1ccc(C)cc1Cl	ZINC000048356138	221009909	/nfs/dbraw/zinc/00/99/09/221009909.db2.gz	DKXBZXCBIIWNMK-UHFFFAOYSA-N	-1	0	354.815	2.557	50	0		FFAARM
CCOC(=O)c1ccc(NC(=O)c2c([O-])c3sccc3n(C)c2=O)cc1	ZINC000049409445	221021888	/nfs/dbraw/zinc/02/18/88/221021888.db2.gz	GIPFWLNRRHRFNX-UHFFFAOYSA-N	-1	0	372.402	2.735	50	0		FFAARM
O=C(CSc1nc(=O)c2sccc2[n-]1)Nc1ccc(F)cc1F	ZINC000051317218	221034469	/nfs/dbraw/zinc/03/44/69/221034469.db2.gz	IBJAYKFEMABTSO-UHFFFAOYSA-N	-1	0	353.375	2.994	50	0		FFAARM
CSc1ccc(CNC(=O)c2ccc3c(c2)[n-]c(=S)[nH]c3=O)cc1	ZINC000055747622	221073943	/nfs/dbraw/zinc/07/39/43/221073943.db2.gz	CWTISIBWUHVATP-UHFFFAOYSA-N	-1	0	357.460	2.864	50	0		FFAARM
Cc1cc(F)ccc1[N-]S(=O)(=O)c1cc2[nH]c(=O)[nH]c2cc1Cl	ZINC000064976607	221159911	/nfs/dbraw/zinc/15/99/11/221159911.db2.gz	UTWFOOIPABPHJD-UHFFFAOYSA-N	-1	0	355.778	2.758	50	0		FFAARM
COc1ccc(Cl)cc1[N-]S(=O)(=O)c1c(C)nc2sc(C)nn21	ZINC000065183634	221175469	/nfs/dbraw/zinc/17/54/69/221175469.db2.gz	RYUHFGFJYMSCTO-UHFFFAOYSA-N	-1	0	372.859	2.870	50	0		FFAARM
COc1ccc([C@H]2CC(=O)Nc3nn4c(nc(C)cc4C)c32)cc1C(=O)[O-]	ZINC000065370818	221204133	/nfs/dbraw/zinc/20/41/33/221204133.db2.gz	NZHXYMOZIKDAND-GFCCVEGCSA-N	-1	0	366.377	2.527	50	0		FFAARM
Cc1cccc([N-]S(=O)(=O)c2cc3n(c2)CCN(CC(C)C)C3=O)c1	ZINC000065254805	221188837	/nfs/dbraw/zinc/18/88/37/221188837.db2.gz	QYKFVJMJGXVOOZ-UHFFFAOYSA-N	-1	0	361.467	2.709	50	0		FFAARM
Cc1ccccc1-n1c(SCC(=O)[O-])nnc1[C@H](O)c1ccccc1	ZINC000065461876	221221627	/nfs/dbraw/zinc/22/16/27/221221627.db2.gz	GQEYRFXCBBIONR-MRXNPFEDSA-N	-1	0	355.419	2.834	50	0		FFAARM
COc1ccc(F)cc1[C@H](C)NC(=O)c1ccc2c(c1)[n-]c(=S)[nH]c2=O	ZINC000065564958	221234201	/nfs/dbraw/zinc/23/42/01/221234201.db2.gz	PRBBRQIUXURLMP-VIFPVBQESA-N	-1	0	373.409	2.851	50	0		FFAARM
O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)[N-]O[C@@H]1CCCCO1	ZINC000065496376	221227182	/nfs/dbraw/zinc/22/71/82/221227182.db2.gz	PPABBQWELRDXJW-LJQANCHMSA-N	-1	0	354.406	2.658	50	0		FFAARM
Cc1c(-c2nnc(SCC(=O)[O-])n2[C@H](C)c2ccccc2)cnn1C	ZINC000067675631	221269413	/nfs/dbraw/zinc/26/94/13/221269413.db2.gz	HHHICFQLVOUQAY-LLVKDONJSA-N	-1	0	357.439	2.773	50	0		FFAARM
COc1ccc(CCN(CCC(=O)[O-])C(=O)c2ccccc2)cc1OC	ZINC000071769517	221373798	/nfs/dbraw/zinc/37/37/98/221373798.db2.gz	FPILSQAUUHGENX-UHFFFAOYSA-N	-1	0	357.406	2.863	50	0		FFAARM
CC(=O)N1CC2(C[C@@H]1C(=O)[O-])CCN(c1ccc3ccccc3n1)CC2	ZINC000082096520	132194252	/nfs/dbraw/zinc/19/42/52/132194252.db2.gz	FKUMDCIJOZLPHD-QGZVFWFLSA-N	-1	0	353.422	2.527	50	0		FFAARM
O=C([O-])C1(CCc2ccccc2)CCN(c2ncnc3nc[nH]c32)CC1	ZINC000071758954	136140449	/nfs/dbraw/zinc/14/04/49/136140449.db2.gz	LYAIUGDWJRARTE-UHFFFAOYSA-N	-1	0	351.410	2.657	50	0		FFAARM
Cc1cnc(C)c(N2CCC(C(=O)[O-])(n3cnc4ccccc43)CC2)n1	ZINC000072418740	136145690	/nfs/dbraw/zinc/14/56/90/136145690.db2.gz	PDNNSSMGVOGOCD-UHFFFAOYSA-N	-1	0	351.410	2.523	50	0		FFAARM
COc1ccc(Br)cc1/C=C\C(=O)N1CCC(C(=O)[O-])CC1	ZINC000096298690	222112854	/nfs/dbraw/zinc/11/28/54/222112854.db2.gz	DUGPPQIBJHWIND-DJWKRKHSSA-N	-1	0	368.227	2.794	50	0		FFAARM
CN(Cc1ncc[nH]1)Cc1cc(-c2ccccn2)ccc1OCC(=O)[O-]	ZINC000097213021	222169040	/nfs/dbraw/zinc/16/90/40/222169040.db2.gz	AGDVQGFWLIGBPH-UHFFFAOYSA-N	-1	0	352.394	2.567	50	0		FFAARM
C[C@@H]1CCc2cc(F)cc3c([O-])c(C(=O)NCc4ccco4)c(=O)n1c23	ZINC000100663086	222249009	/nfs/dbraw/zinc/24/90/09/222249009.db2.gz	DQFXWNIWPSXMTC-SNVBAGLBSA-N	-1	0	356.353	2.876	50	0		FFAARM
CN(CCCc1ccccc1)C(=O)c1ccc2c(c1)[n-]c(=S)n(C)c2=O	ZINC000103236764	222327916	/nfs/dbraw/zinc/32/79/16/222327916.db2.gz	YVWLMUVBUFFZGG-UHFFFAOYSA-N	-1	0	367.474	2.927	50	0		FFAARM
CCn1c(=O)c2ccc(C(=O)NCc3ccc(F)cc3)cc2[n-]c1=S	ZINC000102171276	222290486	/nfs/dbraw/zinc/29/04/86/222290486.db2.gz	GJABLQOSXYEQPI-UHFFFAOYSA-N	-1	0	357.410	2.774	50	0		FFAARM
Cn1c(=O)c2ccc(C(=O)NCc3cccc(Cl)c3)cc2[n-]c1=S	ZINC000102177088	222291373	/nfs/dbraw/zinc/29/13/73/222291373.db2.gz	GQHUWKJTWXJCNI-UHFFFAOYSA-N	-1	0	359.838	2.806	50	0		FFAARM
CC(N[C@H](C)c1ccccc1)=C1C(=O)[N-]C(=O)N(Cc2ccccc2)C1=O	ZINC000005625732	263342218	/nfs/dbraw/zinc/34/22/18/263342218.db2.gz	CAUIGXDAFLGOLN-GBUWSYLDSA-N	-1	0	363.417	2.890	50	0		FFAARM
CC(=O)c1cc2c(cc1NC(=O)C[C@H](C(=O)[O-])c1ccc(F)cc1)OCO2	ZINC000025208603	263388484	/nfs/dbraw/zinc/38/84/84/263388484.db2.gz	NOGTUAFZZHBRJM-AWEZNQCLSA-N	-1	0	373.336	2.954	50	0		FFAARM
Cc1coc2cc3oc(=O)c(CC(=O)N4CCC[C@@H]4C(=O)[O-])c(C)c3cc12	ZINC000002107623	506272879	/nfs/dbraw/zinc/27/28/79/506272879.db2.gz	GYIJLLWCMRKVHP-OAHLLOKOSA-N	-1	0	369.373	2.774	50	0		FFAARM
CCN1CCCn2cc(S(=O)(=O)[N-]c3cc(C)cc(C)c3)cc2C1=O	ZINC000065258757	506277443	/nfs/dbraw/zinc/27/74/43/506277443.db2.gz	QDWASVUIIJYGDC-UHFFFAOYSA-N	-1	0	361.467	2.772	50	0		FFAARM
O=C(Nc1ccc(S(=O)(=O)[N-]c2ncccn2)cc1)c1ccc(F)cc1	ZINC000002773412	506290947	/nfs/dbraw/zinc/29/09/47/506290947.db2.gz	PXLYGXOHLUNXHT-UHFFFAOYSA-N	-1	0	372.381	2.669	50	0		FFAARM
O=S(=O)([N-]c1ncn(Cc2ccc(Cl)cc2)n1)c1cccs1	ZINC000002775060	506291588	/nfs/dbraw/zinc/29/15/88/506291588.db2.gz	HJONGZRGEWKLGM-UHFFFAOYSA-N	-1	0	354.844	2.842	50	0		FFAARM
CCNC(=O)CSc1nnc(-c2cc(Cl)sc2Cl)c(=O)[n-]1	ZINC000032778457	506293751	/nfs/dbraw/zinc/29/37/51/506293751.db2.gz	JSEVDDMSTMWQDI-UHFFFAOYSA-N	-1	0	365.267	2.841	50	0		FFAARM
COc1ccc(OC)c(-n2c(=O)c3ccc(C(=O)[O-])cc3[nH]c2=S)c1	ZINC000003632920	506347853	/nfs/dbraw/zinc/34/78/53/506347853.db2.gz	OTVZAJUDLQAVCO-UHFFFAOYSA-N	-1	0	358.375	2.764	50	0		FFAARM
O=C([O-])c1cccc(S(=O)(=O)Oc2c(F)c(F)c(F)c(F)c2F)c1	ZINC000004100512	506358661	/nfs/dbraw/zinc/35/86/61/506358661.db2.gz	IQNWRQIITAZQRE-UHFFFAOYSA-N	-1	0	368.235	2.848	50	0		FFAARM
CCC[C@@H]1CCc2c(sc(NC(=O)CCCC(=O)[O-])c2C(N)=O)C1	ZINC000004124221	506360622	/nfs/dbraw/zinc/36/06/22/506360622.db2.gz	LVBKZTKMCICHRK-SNVBAGLBSA-N	-1	0	352.456	2.945	50	0		FFAARM
CCN(CC)c1ncc(NS(=O)(=O)c2cccc(C)c2)cc1C(=O)[O-]	ZINC000035397674	506381301	/nfs/dbraw/zinc/38/13/01/506381301.db2.gz	FOERGSVMZBWTAD-UHFFFAOYSA-N	-1	0	363.439	2.735	50	0		FFAARM
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC(=O)CCC(=O)[O-]	ZINC000004550491	506381741	/nfs/dbraw/zinc/38/17/41/506381741.db2.gz	WKBPTTIVJRDLJA-UHFFFAOYSA-N	-1	0	372.377	2.759	50	0		FFAARM
COc1ccccc1C[C@H](C(=O)Nc1cc(C)cc(C)c1)c1nnn[n-]1	ZINC000004673216	506386642	/nfs/dbraw/zinc/38/66/42/506386642.db2.gz	NFQDZWHKNLKWIU-INIZCTEOSA-N	-1	0	351.410	2.790	50	0		FFAARM
COc1cccc(CNc2ccc(N3CCOCC3)c(C(=O)[O-])c2)c1OC	ZINC000004703563	506389680	/nfs/dbraw/zinc/38/96/80/506389680.db2.gz	AWWJFSBMVMRPHK-UHFFFAOYSA-N	-1	0	372.421	2.851	50	0		FFAARM
CC(C)N(CCC(=O)[O-])C(=O)c1ccc(I)cc1	ZINC000037585087	506429523	/nfs/dbraw/zinc/42/95/23/506429523.db2.gz	QAUMUSKFRJYILS-UHFFFAOYSA-N	-1	0	361.179	2.617	50	0		FFAARM
CCOc1ccccc1NC(=O)[C@H](Cc1cccc(OC)c1)c1nnn[n-]1	ZINC000005444747	506442544	/nfs/dbraw/zinc/44/25/44/506442544.db2.gz	BJQQTHMTKBKFQR-OAHLLOKOSA-N	-1	0	367.409	2.572	50	0		FFAARM
O=C(NC[C@H]1CN(Cc2ccccc2)CCO1)c1ccc([O-])c(Cl)c1	ZINC000039975643	506455735	/nfs/dbraw/zinc/45/57/35/506455735.db2.gz	USBNALPFBKMNGS-INIZCTEOSA-N	-1	0	360.841	2.676	50	0		FFAARM
CC[C@@H](Sc1nc2c(cnn2-c2ccc(F)cc2)c(=O)[nH]1)C(=O)OC	ZINC000005967731	506463200	/nfs/dbraw/zinc/46/32/00/506463200.db2.gz	CGNUJPSZAUYPRN-GFCCVEGCSA-N	-1	0	362.386	2.704	50	0		FFAARM
COc1cc(NC(=O)c2cc(Cl)ccc2[O-])ccc1NS(C)(=O)=O	ZINC000040087334	506464893	/nfs/dbraw/zinc/46/48/93/506464893.db2.gz	HYYXJQKNOAYXCE-UHFFFAOYSA-N	-1	0	370.814	2.678	50	0		FFAARM
O=C([O-])CCNC(=O)Cn1ccc2ccc(OCc3ccccc3)cc21	ZINC000040268336	506479987	/nfs/dbraw/zinc/47/99/87/506479987.db2.gz	XUAVNRJRUVIHRF-UHFFFAOYSA-N	-1	0	352.390	2.811	50	0		FFAARM
CCOc1ccccc1[N-]S(=O)(=O)c1ccc2c(c1)CCN2C(C)=O	ZINC000006728985	506501038	/nfs/dbraw/zinc/50/10/38/506501038.db2.gz	OJSAXDZBLBNBKN-UHFFFAOYSA-N	-1	0	360.435	2.795	50	0		FFAARM
O=C([O-])[C@H]1C2CCC(CC2)[C@H]1C(=O)N1CCN(Cc2ccc(F)cc2)CC1	ZINC000006727043	506501156	/nfs/dbraw/zinc/50/11/56/506501156.db2.gz	BEYAEIJMMUGRIU-HWMSQKFYSA-N	-1	0	374.456	2.607	50	0		FFAARM
O=c1c2[n-][nH]n(Cc3ccc(F)cc3)c=2c(=O)n1-c1ccc(F)c(F)c1	ZINC000006770625	506505677	/nfs/dbraw/zinc/50/56/77/506505677.db2.gz	XVHSDCKQGRBAFF-CABCVRRESA-N	-1	0	360.295	2.597	50	0		FFAARM
O=C1CCCN1c1ccccc1[N-]S(=O)(=O)c1ccc(F)cc1F	ZINC000007726604	506586438	/nfs/dbraw/zinc/58/64/38/506586438.db2.gz	JVKVLBAHELFINP-UHFFFAOYSA-N	-1	0	352.362	2.892	50	0		FFAARM
CN(Cc1cn(-c2ccccc2)nc1-c1cccnc1)C(=O)CCC(=O)[O-]	ZINC000008861910	506671146	/nfs/dbraw/zinc/67/11/46/506671146.db2.gz	INBQWBCSVYRRSI-UHFFFAOYSA-N	-1	0	364.405	2.758	50	0		FFAARM
O=C(Nc1cc(=O)nc2[n-]c(Cc3ccccc3)nn21)C1CCCCC1	ZINC000009013347	506678094	/nfs/dbraw/zinc/67/80/94/506678094.db2.gz	DGHPXIRYXNIJSN-UHFFFAOYSA-N	-1	0	351.410	2.940	50	0		FFAARM
CCOc1ccccc1NC(=O)[C@H](Cc1ccccc1OC)c1nnn[n-]1	ZINC000009434463	506697837	/nfs/dbraw/zinc/69/78/37/506697837.db2.gz	OQHBWCSZIAZJEK-CQSZACIVSA-N	-1	0	367.409	2.572	50	0		FFAARM
COC(=O)c1ccc(S(=O)(=O)[N-]c2ccccc2OC(F)F)cc1	ZINC000009737373	506710661	/nfs/dbraw/zinc/71/06/61/506710661.db2.gz	DRNLGCMKXJATCB-UHFFFAOYSA-N	-1	0	357.334	2.875	50	0		FFAARM
O=C([N-]n1cnc2c(cnn2-c2cccc(Cl)c2)c1=O)c1cccs1	ZINC000010251765	506734539	/nfs/dbraw/zinc/73/45/39/506734539.db2.gz	HXFPEZZOKCDULT-UHFFFAOYSA-N	-1	0	371.809	2.681	50	0		FFAARM
CCS(=O)(=O)c1ccc(NC(=O)CC2(C(=O)[O-])CCCCC2)cc1	ZINC000010829153	506754984	/nfs/dbraw/zinc/75/49/84/506754984.db2.gz	WBUXTMAQZNUMNQ-UHFFFAOYSA-N	-1	0	353.440	2.844	50	0		FFAARM
CCC(CC)(CC(=O)Nc1c(C)n(C)n(-c2ccccc2)c1=O)C(=O)[O-]	ZINC000011160727	506766576	/nfs/dbraw/zinc/76/65/76/506766576.db2.gz	KZAWUXQFIRSNGU-UHFFFAOYSA-N	-1	0	359.426	2.704	50	0		FFAARM
CC[C@H](C)[C@@H](C(=O)[O-])N1C(=O)N2CCc3c4ccccc4[nH]c3[C@]2(C)C1=O	ZINC000011692337	506789168	/nfs/dbraw/zinc/78/91/68/506789168.db2.gz	VMYWFCHFKKXGGP-UYHHGJEOSA-N	-1	0	369.421	2.703	50	0		FFAARM
O=C(Cc1csc([N-]c2ncccn2)n1)NCCOc1ccc(F)cc1	ZINC000044227642	506822199	/nfs/dbraw/zinc/82/21/99/506822199.db2.gz	ZHOWDYXESUOECV-UHFFFAOYSA-N	-1	0	373.413	2.554	50	0		FFAARM
Cc1nc(-c2ccc(OC(F)(F)F)cc2)sc1C(=O)NCC(=O)[O-]	ZINC000012409109	506859565	/nfs/dbraw/zinc/85/95/65/506859565.db2.gz	XFVSDYAUBMPOEH-UHFFFAOYSA-N	-1	0	360.313	2.832	50	0		FFAARM
Cc1n[nH]c(C)c1S(=O)(=O)[N-]c1cccc(NC(=O)c2ccco2)c1	ZINC000012552022	506878812	/nfs/dbraw/zinc/87/88/12/506878812.db2.gz	VZALWMIEUZICEX-UHFFFAOYSA-N	-1	0	360.395	2.673	50	0		FFAARM
Cc1[n-]n([C@@H]2CCS(=O)(=O)C2)c(=O)c1Cc1cccc2ccccc21	ZINC000061717722	507632796	/nfs/dbraw/zinc/63/27/96/507632796.db2.gz	SHAVRCJPONJBFX-MRXNPFEDSA-N	-1	0	356.447	2.588	50	0		FFAARM
CNc1nc(C(=O)N2CCC(Cc3cccc(C(=O)[O-])c3)CC2)cs1	ZINC000072162483	507765303	/nfs/dbraw/zinc/76/53/03/507765303.db2.gz	BGSBPCRYRCVAKW-UHFFFAOYSA-N	-1	0	359.451	2.978	50	0		FFAARM
Cc1ccc(OC2(C(=O)[O-])CCN(C(=O)c3ccc(F)cc3)CC2)cn1	ZINC000072447195	507792059	/nfs/dbraw/zinc/79/20/59/507792059.db2.gz	LCEIDMHIUFTXQX-UHFFFAOYSA-N	-1	0	358.369	2.668	50	0		FFAARM
CC(C)(C)c1ccn(C2(C(=O)[O-])CCN(C(=O)C[C@@H]3C=CCC3)CC2)n1	ZINC000072453508	507793431	/nfs/dbraw/zinc/79/34/31/507793431.db2.gz	QCLUQIFNXVUMAD-OAHLLOKOSA-N	-1	0	359.470	2.939	50	0		FFAARM
O=C([O-])C1(n2cccn2)CCN(C(=O)c2ccc3sccc3c2)CC1	ZINC000072472832	507795709	/nfs/dbraw/zinc/79/57/09/507795709.db2.gz	CGYOHNUJMFWJKL-UHFFFAOYSA-N	-1	0	355.419	2.814	50	0		FFAARM
O=C([O-])C1(n2cccn2)CCN(C(=O)c2csc3c2CCCC3)CC1	ZINC000072479302	507797277	/nfs/dbraw/zinc/79/72/77/507797277.db2.gz	MTRDDVSKEQXFBS-UHFFFAOYSA-N	-1	0	359.451	2.540	50	0		FFAARM
CC(C)(CC(=O)Nc1ccc(Cc2nnc3ccccn32)cc1)C(=O)[O-]	ZINC000078813895	507910108	/nfs/dbraw/zinc/91/01/08/507910108.db2.gz	GVWOOXXKNVAXDS-UHFFFAOYSA-N	-1	0	352.394	2.760	50	0		FFAARM
COC(=O)c1[n-]c(=NC(=O)c2n[nH]c3ccccc32)sc1CC(C)C	ZINC000079492636	507967374	/nfs/dbraw/zinc/96/73/74/507967374.db2.gz	NSFQPRGCMVAUQB-UHFFFAOYSA-N	-1	0	358.423	3.257	50	0		FFAARM
COCCC[C@]1(C(=O)[O-])CCCN(C(=O)NCc2cccc(F)c2)C1	ZINC000091468486	507988085	/nfs/dbraw/zinc/98/80/85/507988085.db2.gz	XTZVASPSBSKRQK-GOSISDBHSA-N	-1	0	352.406	2.629	50	0		FFAARM
Cc1ccc(C)c(C(=O)N2CCC3(CCC(=O)N([C@@H](C)C(=O)[O-])C3)CC2)c1	ZINC000091872308	508021022	/nfs/dbraw/zinc/02/10/22/508021022.db2.gz	JCCNBDBYSBXFMD-INIZCTEOSA-N	-1	0	372.465	2.621	50	0		FFAARM
COc1ccc([N-]S(=O)(=O)c2c(C)[nH]c(C)c2-c2nnc(C)o2)cc1	ZINC000075504860	508112212	/nfs/dbraw/zinc/11/22/12/508112212.db2.gz	UAZANCQQLZECLK-UHFFFAOYSA-N	-1	0	362.411	2.799	50	0		FFAARM
O=C([O-])[C@]1(NC(=O)c2cccc(-n3cccn3)c2)CCCc2ccccc21	ZINC000095392075	508184367	/nfs/dbraw/zinc/18/43/67/508184367.db2.gz	IVIGTYJNDHULKI-NRFANRHFSA-N	-1	0	361.401	2.919	50	0		FFAARM
O=C([O-])[C@@H](Cc1ccccc1)NC(=O)c1cc(-c2ccccc2F)n[nH]1	ZINC000095528227	508196224	/nfs/dbraw/zinc/19/62/24/508196224.db2.gz	SYVOGABKZLGKFB-QGZVFWFLSA-N	-1	0	353.353	2.642	50	0		FFAARM
O=C([N-]S(=O)(=O)N1CCc2ccccc21)c1cc(F)c(Cl)cc1F	ZINC000095979096	508199834	/nfs/dbraw/zinc/19/98/34/508199834.db2.gz	FNEVRVOZMQDVPV-UHFFFAOYSA-N	-1	0	372.780	2.656	50	0		FFAARM
Cc1cccc2cc(C(=O)Nc3ccc(CC(=O)NCC(=O)[O-])cc3)oc21	ZINC000095970436	508199974	/nfs/dbraw/zinc/19/99/74/508199974.db2.gz	WOWQKFUSYKTRSC-UHFFFAOYSA-N	-1	0	366.373	2.737	50	0		FFAARM
NC(=O)c1ccc(S(=O)(=O)[N-]c2cc(Cl)cc(Cl)c2O)cc1	ZINC000095982807	508200642	/nfs/dbraw/zinc/20/06/42/508200642.db2.gz	SVLYCMAPPSGNES-UHFFFAOYSA-N	-1	0	361.206	2.599	50	0		FFAARM
CCN1C[C@]2(CCCN(C(=O)c3ccc([O-])c(Cl)c3)C2)CCC1=O	ZINC000082160778	508227381	/nfs/dbraw/zinc/22/73/81/508227381.db2.gz	JAWBSHQLGNCJKC-SFHVURJKSA-N	-1	0	350.846	2.910	50	0		FFAARM
O=C([O-])Cn1ccc(NC(=O)[C@H]2C[C@@H]2c2ccccc2OC(F)(F)F)n1	ZINC000122720454	508577430	/nfs/dbraw/zinc/57/74/30/508577430.db2.gz	KWMVQTQGRNTUOG-MNOVXSKESA-N	-1	0	369.299	2.609	50	0		FFAARM
O=C([N-]S(=O)(=O)c1cccnc1)c1ccc(OC2CCC2)cc1Cl	ZINC000136052589	508667234	/nfs/dbraw/zinc/66/72/34/508667234.db2.gz	FDHSWXNEGPLIIO-UHFFFAOYSA-N	-1	0	366.826	2.785	50	0		FFAARM
O=C(c1ccc2[n-]c(=S)oc2c1)N1CCOC[C@H]1C[C@H](O)c1ccco1	ZINC000159014882	508780808	/nfs/dbraw/zinc/78/08/08/508780808.db2.gz	BQPDQORTTGIUFX-OCCSQVGLSA-N	-1	0	374.418	2.674	50	0		FFAARM
COc1ccc2[nH]c(CNC(=O)c3cc(=O)n(-c4ccccc4)[n-]3)cc2c1	ZINC000215533412	509248855	/nfs/dbraw/zinc/24/88/55/509248855.db2.gz	OVOURHWGBZXOIZ-UHFFFAOYSA-N	-1	0	362.389	2.586	50	0		FFAARM
CC[C@]1(c2ccc(NC(=O)[C@@H]3[C@@H](C(=O)[O-])C3(C)C)cc2)CCC(=O)NC1=O	ZINC000227300303	509405446	/nfs/dbraw/zinc/40/54/46/509405446.db2.gz	WVPFXTRAQOLAMI-AUSJPIAWSA-N	-1	0	372.421	2.907	50	0		FFAARM
CC(=O)N[C@H](CC(=O)N1CCC[C@H](CCC(=O)[O-])C1)c1ccc(C)cc1	ZINC000236718454	509488841	/nfs/dbraw/zinc/48/88/41/509488841.db2.gz	KYGPMXZNLGZWOR-SJLPKXTDSA-N	-1	0	360.454	2.666	50	0		FFAARM
O=C([N-]S(=O)(=O)c1cccc(Cl)c1)c1csc([C@@H]2CCCO2)n1	ZINC000165216892	509563835	/nfs/dbraw/zinc/56/38/35/509563835.db2.gz	IEAIYKCBQVQQJG-LBPRGKRZSA-N	-1	0	372.855	2.767	50	0		FFAARM
C[C@@H]1CN(Cc2ccc(C(=O)NC(C)(C)CCC(=O)[O-])cc2)C[C@@H](C)O1	ZINC000237509799	509665515	/nfs/dbraw/zinc/66/55/15/509665515.db2.gz	WYIGWZOGMRCHRH-HUUCEWRRSA-N	-1	0	362.470	2.669	50	0		FFAARM
Cc1cc(S(=O)(=O)[N-]c2cn(Cc3ccccc3)nn2)c(F)cc1F	ZINC000170609121	509679807	/nfs/dbraw/zinc/67/98/07/509679807.db2.gz	FJPPMWRNTVUPOJ-UHFFFAOYSA-N	-1	0	364.377	2.714	50	0		FFAARM
C[C@]1(C(=O)[O-])CCN(C(=O)c2ccccc2C(=O)c2ccc(F)cc2)C1	ZINC000237653326	509703369	/nfs/dbraw/zinc/70/33/69/509703369.db2.gz	AXZWIEGMSNYULC-FQEVSTJZSA-N	-1	0	355.365	2.994	50	0		FFAARM
Cc1oc(-c2ccco2)nc1CC(=O)N[C@@H](Cc1ccccc1)C(=O)[O-]	ZINC000237659683	509703567	/nfs/dbraw/zinc/70/35/67/509703567.db2.gz	WDCMWZKWNFHMRR-HNNXBMFYSA-N	-1	0	354.362	2.598	50	0		FFAARM
Cc1ccccc1[C@H](CC(=O)[O-])NC(=O)[C@@H]1CC(=O)Nc2cc(F)ccc21	ZINC000237655576	509703581	/nfs/dbraw/zinc/70/35/81/509703581.db2.gz	FGHCEKCYERRBTO-WBVHZDCISA-N	-1	0	370.380	2.892	50	0		FFAARM
C[C@H]1CN(Cc2ccc(C(=O)NC(C)(C)CCC(=O)[O-])cc2)C[C@H](C)O1	ZINC000237675917	509708663	/nfs/dbraw/zinc/70/86/63/509708663.db2.gz	WYIGWZOGMRCHRH-GJZGRUSLSA-N	-1	0	362.470	2.669	50	0		FFAARM
Cc1nc(-c2cnn(C)c2)sc1C(=O)N1CCC[C@@H](CCC(=O)[O-])C1	ZINC000237733498	509721994	/nfs/dbraw/zinc/72/19/94/509721994.db2.gz	QLKRBVCDXAIIRN-LBPRGKRZSA-N	-1	0	362.455	2.569	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)[C@H]1CCCOC1)c1cccc(Br)c1	ZINC000237963783	509786845	/nfs/dbraw/zinc/78/68/45/509786845.db2.gz	LITPEXUALWNLBW-AAEUAGOBSA-N	-1	0	356.216	2.508	50	0		FFAARM
CC(N=Nc1ccccc1C(=O)[O-])c1cccc(OCC(=O)N(C)C)c1	ZINC000252505860	509845962	/nfs/dbraw/zinc/84/59/62/509845962.db2.gz	ODAXHCFHCMAGQI-UHFFFAOYSA-N	-1	0	355.394	2.688	50	0		FFAARM
O=C([O-])[C@@H]1CCN(C(=O)/C=C\c2ccc(Oc3cccnc3)c(F)c2)C1	ZINC000255573229	509929919	/nfs/dbraw/zinc/92/99/19/509929919.db2.gz	ICEWSQYTOONLKD-KXQLTZBTSA-N	-1	0	356.353	2.959	50	0		FFAARM
O=C([O-])c1ccc(C(=O)N2CCC3(C[C@H]3C(=O)N3CCCCC3)CC2)cc1	ZINC000262345611	510252071	/nfs/dbraw/zinc/25/20/71/510252071.db2.gz	XWMCCTLSLXPYHM-KRWDZBQOSA-N	-1	0	370.449	2.640	50	0		FFAARM
O=C([O-])[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1scnc1C1CC1	ZINC000190771965	510335514	/nfs/dbraw/zinc/33/55/14/510335514.db2.gz	TUKLDJSMSVYWTI-CQSZACIVSA-N	-1	0	355.419	2.928	50	0		FFAARM
C[C@H](c1ccccc1)N1C[C@@H](C(=O)Nc2cccc(CC(=O)[O-])c2)CC1=O	ZINC000263144416	510582882	/nfs/dbraw/zinc/58/28/82/510582882.db2.gz	KETJNWHZLTUWRN-PBHICJAKSA-N	-1	0	366.417	2.862	50	0		FFAARM
C[C@H]1CC[C@@H](C(=O)[O-])CN1C(=O)Cc1csc(Cc2ccccc2)n1	ZINC000263160049	510591756	/nfs/dbraw/zinc/59/17/56/510591756.db2.gz	IGYMDATVIWUFKE-DZGCQCFKSA-N	-1	0	358.463	2.988	50	0		FFAARM
Cc1ccc(F)c(-n2nc(C(=O)N[C@@H](C(=O)[O-])C(C)C)c3c2CCC3)c1	ZINC000263225184	510619542	/nfs/dbraw/zinc/61/95/42/510619542.db2.gz	PWESJUWPLINCEO-MRXNPFEDSA-N	-1	0	359.401	2.648	50	0		FFAARM
O=C([O-])c1ccc(C(=O)NCc2cc(Cl)ccc2N2CCOCC2)cc1	ZINC000263392375	510689531	/nfs/dbraw/zinc/68/95/31/510689531.db2.gz	DVOVDCKFKAOKOO-UHFFFAOYSA-N	-1	0	374.824	2.805	50	0		FFAARM
O=C([O-])Cc1ccc(S(=O)(=O)NCC2CCc3ccccc3CC2)cc1	ZINC000530153924	517596179	/nfs/dbraw/zinc/59/61/79/517596179.db2.gz	XLUMBZZJXZMAGP-UHFFFAOYSA-N	-1	0	373.474	2.787	50	0		FFAARM
C[C@@]1(C(=O)[O-])C[C@@H](O)CN1C(=O)OCC1c2ccccc2-c2ccccc21	ZINC000521398881	517713989	/nfs/dbraw/zinc/71/39/89/517713989.db2.gz	WSKXCJGRXYRWBH-ASSNKEHSSA-N	-1	0	367.401	2.845	50	0		FFAARM
CC(C)(C(=O)[O-])C(=O)Nc1cccc(CS(=O)(=O)C2CCCCC2)c1	ZINC000579125423	518535037	/nfs/dbraw/zinc/53/50/37/518535037.db2.gz	LVZLEOSVYGGGLL-UHFFFAOYSA-N	-1	0	367.467	2.983	50	0		FFAARM
O=C([O-])CN(Cc1ccccc1)C(=O)C[C@@H]1Sc2ccccc2NC1=O	ZINC000299741799	534501168	/nfs/dbraw/zinc/50/11/68/534501168.db2.gz	GEKLDZHCQYWCME-INIZCTEOSA-N	-1	0	370.430	2.603	50	0		FFAARM
CCOc1cc(C(=O)N2CC[C@H](C(=O)[O-])C2)ccc1OCc1cccnc1	ZINC000269181943	520661946	/nfs/dbraw/zinc/66/19/46/520661946.db2.gz	LNRWJMMDKNYWSN-INIZCTEOSA-N	-1	0	370.405	2.606	50	0		FFAARM
O=C(/C=C\c1cccc(OC2CCCC2)c1)[N-]S(=O)(=O)c1cccnc1	ZINC000606443304	521069727	/nfs/dbraw/zinc/06/97/27/521069727.db2.gz	LZHKKTDIANNUGO-KHPPLWFESA-N	-1	0	372.446	2.921	50	0		FFAARM
Cc1oc(CN(C)C(=O)c2cccc(CN3CCCC3=O)c2)cc1C(=O)[O-]	ZINC000299750950	534545465	/nfs/dbraw/zinc/54/54/65/534545465.db2.gz	OWGFIFHNQOYJAF-UHFFFAOYSA-N	-1	0	370.405	2.681	50	0		FFAARM
O=C([O-])COc1ccc(C(=O)N[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)cc1	ZINC000621540198	522915976	/nfs/dbraw/zinc/91/59/76/522915976.db2.gz	NTFRYHXWEHFBON-SJLPKXTDSA-N	-1	0	373.380	2.939	50	0		FFAARM
COc1ccc(-n2ccc(C(=O)N3[C@@H]4CCCC[C@@H]4C[C@H]3C(=O)[O-])n2)cc1	ZINC000268950817	523332751	/nfs/dbraw/zinc/33/27/51/523332751.db2.gz	SUWQTTWPQCYDOG-XWIAVFTESA-N	-1	0	369.421	2.739	50	0		FFAARM
Cc1cccc(C[C@@H](CNC(=O)[C@H]2CCOc3ccccc32)C(=O)[O-])c1	ZINC000237671448	524464726	/nfs/dbraw/zinc/46/47/26/524464726.db2.gz	IHHLYDFQIAYDJX-WMZOPIPTSA-N	-1	0	353.418	2.921	50	0		FFAARM
COc1ccc2c(ccn2CCC(=O)N[C@@H](Cc2ccccc2)C(=O)[O-])c1	ZINC000020760641	525616082	/nfs/dbraw/zinc/61/60/82/525616082.db2.gz	VYJZFCMHYYXRAU-SFHVURJKSA-N	-1	0	366.417	2.852	50	0	biogenic	FFAARM
C[C@H](Sc1ccccc1Cl)C(=O)N1CCC[C@@H](c2nnn[n-]2)C1	ZINC000089420093	525994531	/nfs/dbraw/zinc/99/45/31/525994531.db2.gz	NCJJLCDGQZTTHR-WDEREUQCSA-N	-1	0	351.863	2.740	50	0		FFAARM
O=C([O-])[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)CC[C@H]1Cc2ccccc2NC1=O	ZINC000268935948	526290272	/nfs/dbraw/zinc/29/02/72/526290272.db2.gz	HKNIJECRIHRKRW-ONIAQPFYSA-N	-1	0	370.449	2.822	50	0		FFAARM
O=C([O-])[C@H]1C[C@H]1C(=O)NCC1(c2cccc(C(F)(F)F)c2)CCOCC1	ZINC000268921638	526335245	/nfs/dbraw/zinc/33/52/45/526335245.db2.gz	SUXJCUQIGAYGPQ-KGLIPLIRSA-N	-1	0	371.355	2.591	50	0		FFAARM
O=C([O-])c1ccc(C(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)cn1	ZINC000262334048	526361859	/nfs/dbraw/zinc/36/18/59/526361859.db2.gz	WHSDYKYSZGUYOH-OAHLLOKOSA-N	-1	0	354.362	2.528	50	0		FFAARM
CCC(CC)CNc1ncc(C(C)(C)C(=O)[O-])c(N2CCOCC2)n1	ZINC000096150011	535025606	/nfs/dbraw/zinc/02/56/06/535025606.db2.gz	WXUXEIQSSIYWIC-UHFFFAOYSA-N	-1	0	350.463	2.524	50	0		FFAARM
O=C(CCn1c(=O)c2ccccc2[n-]c1=S)NCC1(C2CC2)CCC1	ZINC000120678780	571093579	/nfs/dbraw/zinc/09/35/79/571093579.db2.gz	UMEJIOUAQKLUJV-UHFFFAOYSA-N	-1	0	357.479	2.772	50	0		FFAARM
CCc1ccc([C@H](COC)NC(=O)CC2(C(=O)[O-])Cc3ccccc3C2)o1	ZINC000236977308	571098990	/nfs/dbraw/zinc/09/89/90/571098990.db2.gz	WALIODYBHZKKMP-KRWDZBQOSA-N	-1	0	371.433	2.906	50	0		FFAARM
CC[C@@H](C)[C@@H](NC(=O)Cc1csc(-c2ccccc2OC)n1)C(=O)[O-]	ZINC000085432475	571115539	/nfs/dbraw/zinc/11/55/39/571115539.db2.gz	JUHBOQXNALNPGD-BDJLRTHQSA-N	-1	0	362.451	2.977	50	0		FFAARM
Cc1ccc(OCc2cccc(C(=O)N[C@](C)(C(=O)[O-])C3CC3)c2)cn1	ZINC000191068267	600616496	/nfs/dbraw/zinc/61/64/96/600616496.db2.gz	LJTQPHIRXJAVPL-FQEVSTJZSA-N	-1	0	354.406	2.952	50	0		FFAARM
CC(C)(C)n1nnc(CC(=O)Nc2ccc3sc(C(=O)[O-])cc3c2)n1	ZINC000659131448	731943188	/nfs/dbraw/zinc/94/31/88/731943188.db2.gz	WNCWOVOCEIIJLF-UHFFFAOYSA-N	-1	0	359.411	2.522	50	0		FFAARM
O=C([O-])[C@@H]1CCN(C(=O)/C=C/c2ccc(Oc3cccnc3)c(F)c2)C1	ZINC000178266881	970131743	/nfs/dbraw/zinc/13/17/43/970131743.db2.gz	ICEWSQYTOONLKD-YVARQFDVSA-N	-1	0	356.353	2.959	50	0		FFAARM
COc1cc(C(=O)[O-])cc(C(=O)Nc2cccc(C(=O)N(C)C)c2C)c1	ZINC000952868953	1011000841	/nfs/dbraw/zinc/00/08/41/1011000841.db2.gz	JFWVEZONRDEGQE-UHFFFAOYSA-N	-1	0	356.378	2.656	50	0		FFAARM
Cc1c(C(=O)[O-])sc2[nH]cnc(=N[C@@H]3C[C@H](CO)c4ccccc43)c12	ZINC000952876056	1011006236	/nfs/dbraw/zinc/00/62/36/1011006236.db2.gz	ZTNFTAHQYOQDIS-ZWNOBZJWSA-N	-1	0	355.419	2.753	50	0		FFAARM
CN(C)Cc1nc(C(=O)N2CC[C@@H](Cc3cccc(C(=O)[O-])c3)C2)cs1	ZINC000072122393	1019817063	/nfs/dbraw/zinc/81/70/63/1019817063.db2.gz	DARMZHVXBATYOS-AWEZNQCLSA-N	-1	0	373.478	2.608	50	0		FFAARM
Cc1cc(C(=O)N2CCC[C@@H]2C(=O)[O-])nn1-c1cccc(C(F)(F)F)c1	ZINC000652068579	1024816121	/nfs/dbraw/zinc/81/61/21/1024816121.db2.gz	HSLDOTJYKSVOKC-CQSZACIVSA-N	-1	0	367.327	2.889	50	0		FFAARM
C[C@@H](NC(=O)Nc1cc([C@@H]2CCCO2)nn1C)[C@@H]1C[C@H](C(=O)[O-])C1(C)C	ZINC000653544344	1024939586	/nfs/dbraw/zinc/93/95/86/1024939586.db2.gz	URRLZDQHKFVBDN-CZXHOFHRSA-N	-1	0	364.446	2.529	50	0		FFAARM
COc1ccc2c(c1)[C@H](C(=O)N[C@H](c1nnn[n-]1)c1ccccc1)CCC2	ZINC000655391589	1025207564	/nfs/dbraw/zinc/20/75/64/1025207564.db2.gz	XJQSOWDIHHFYCQ-AEFFLSMTSA-N	-1	0	363.421	2.534	50	0		FFAARM
CC[C@@H](C)[C@@H](NC(=O)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1)C(=O)[O-]	ZINC000236863367	1031678772	/nfs/dbraw/zinc/67/87/72/1031678772.db2.gz	YCKHWAZAWYDYAM-BDJLRTHQSA-N	-1	0	359.426	2.674	50	0		FFAARM
Cc1ccc(C(=O)N2CCC(Nc3nc(C)cc(C(=O)[O-])n3)CC2)cc1	ZINC001506405353	1059496177	/nfs/dbraw/zinc/49/61/77/1059496177.db2.gz	ZLQFJPFHZOOTCB-UHFFFAOYSA-N	-1	0	354.410	2.508	50	0		FFAARM
CN(C[C@@H]1CCN(c2ccccc2)C1)S(=O)(=O)c1ccccc1C(=O)[O-]	ZINC001506422271	1059512017	/nfs/dbraw/zinc/51/20/17/1059512017.db2.gz	RALPHFVLHZKYEF-HNNXBMFYSA-N	-1	0	374.462	2.532	50	0		FFAARM
COC(=O)C[C@H](c1ccc2c(c1)OCO2)c1c([O-])c2ccccc2oc1=O	ZINC000217820995	222674458	/nfs/dbraw/zinc/67/44/58/222674458.db2.gz	VABSXQDQQNHUSJ-CYBMUJFWSA-N	-1	0	368.341	2.922	50	0	biogenic	FFAARM
Cc1cc2c(cc1C)N[C@H](CC(=O)Nc1cccc(C(=O)[O-])c1)C(=O)N2	ZINC000000639813	219307649	/nfs/dbraw/zinc/30/76/49/219307649.db2.gz	WEVACZPYYADBPH-MRXNPFEDSA-N	-1	0	353.378	2.763	50	0		FFAARM
COc1ccc([C@@H]2N[C@H](C(=O)[O-])Cc3c4ccccc4[nH]c32)c(OC)c1	ZINC000000754339	219318280	/nfs/dbraw/zinc/31/82/80/219318280.db2.gz	TWSTVZBEFBQGQE-WMZOPIPTSA-N	-1	0	352.390	2.873	50	0	biogenic	FFAARM
O=C([O-])C1CCN(S(=O)(=O)c2ccc(Oc3ccccc3)cc2)CC1	ZINC000000854191	219332090	/nfs/dbraw/zinc/33/20/90/219332090.db2.gz	UYXQOCSYVPCEHR-UHFFFAOYSA-N	-1	0	361.419	2.964	50	0		FFAARM
CC(=O)Nc1ccc(S(=O)(=O)[N-]c2cc(-c3ccccc3)nn2C)cc1	ZINC000001034676	219356252	/nfs/dbraw/zinc/35/62/52/219356252.db2.gz	UTZACFRSYOOJCW-UHFFFAOYSA-N	-1	0	370.434	2.846	50	0		FFAARM
O=C(/N=c1\[n-]nc2ccccn21)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000030691305	539889473	/nfs/dbraw/zinc/88/94/73/539889473.db2.gz	CBKPSCZXNPWTRI-UHFFFAOYSA-N	-1	0	358.361	2.629	50	0		FFAARM
Cc1cc([N-]S(=O)(=O)c2ccc(Cl)c(Cl)c2)n2ncnc2n1	ZINC000225396325	222837725	/nfs/dbraw/zinc/83/77/25/222837725.db2.gz	UTCYWUIPAFBRKJ-UHFFFAOYSA-N	-1	0	358.210	2.540	50	0		FFAARM
CC(C)(O)[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)[O-]	ZINC000002583267	219450141	/nfs/dbraw/zinc/45/01/41/219450141.db2.gz	KIOMNBRJPAICIT-KRWDZBQOSA-N	-1	0	355.390	2.749	50	0		FFAARM
O=C([O-])c1cccc(NC(=O)c2ccccc2NC(=O)[C@H]2CCCO2)c1	ZINC000008189556	219852238	/nfs/dbraw/zinc/85/22/38/219852238.db2.gz	FSYPIIBAPCWCHP-MRXNPFEDSA-N	-1	0	354.362	2.755	50	0		FFAARM
Cc1oc(CN(C)C(=O)C2(c3ccccc3)CCOCC2)cc1C(=O)[O-]	ZINC000299747768	223079383	/nfs/dbraw/zinc/07/93/83/223079383.db2.gz	DZKNLKKMUGZAHR-UHFFFAOYSA-N	-1	0	357.406	2.993	50	0		FFAARM
O=C([O-])[C@@H]1CCCN1CC(=O)N(CCc1ccccc1)Cc1ccccc1	ZINC000299745862	223079776	/nfs/dbraw/zinc/07/97/76/223079776.db2.gz	SYSZHUPCUHPKLY-FQEVSTJZSA-N	-1	0	366.461	2.807	50	0		FFAARM
O=C([O-])[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)Cc1cc2ccccc2[nH]c1=O	ZINC000299753759	223080648	/nfs/dbraw/zinc/08/06/48/223080648.db2.gz	ZFUMTDNEOZKCTF-XKQJLSEDSA-N	-1	0	354.406	2.727	50	0		FFAARM
O=c1c2ccccc2[n-]c(=S)n1C[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000012541000	220005256	/nfs/dbraw/zinc/00/52/56/220005256.db2.gz	LVFLVLIPAYVHNB-INIZCTEOSA-N	-1	0	367.474	2.960	50	0		FFAARM
COc1ccc(CNC(=O)CSc2ccccc2C(=O)[O-])cc1OC	ZINC000012937150	220045442	/nfs/dbraw/zinc/04/54/42/220045442.db2.gz	SKZJHCFHDAVSKZ-UHFFFAOYSA-N	-1	0	361.419	2.811	50	0		FFAARM
COc1ccc(CC(=O)N2CCC(C(=O)[O-])(c3ccccc3)CC2)cc1	ZINC000013185300	220061479	/nfs/dbraw/zinc/06/14/79/220061479.db2.gz	IDXRXALZTHPGKD-UHFFFAOYSA-N	-1	0	353.418	2.883	50	0		FFAARM
CCc1ccc(NC2=N[C@@H](CC(=O)Nc3ccccc3OC)C([O-])=N2)cc1	ZINC000013691188	220087079	/nfs/dbraw/zinc/08/70/79/220087079.db2.gz	PFPCQYABALEXLH-INIZCTEOSA-N	-1	0	366.421	2.553	50	0		FFAARM
Cc1[n-]n(-c2ccc(F)cc2)c(=O)c1CCC(=O)NCc1ccccc1	ZINC000014201054	220117562	/nfs/dbraw/zinc/11/75/62/220117562.db2.gz	ITXBNGZCYXBKIL-UHFFFAOYSA-N	-1	0	353.397	2.862	50	0		FFAARM
CCOC(=O)c1c[nH]nc1S(=O)(=O)[N-]c1cc(Cl)cc(Cl)c1	ZINC000015862604	220169902	/nfs/dbraw/zinc/16/99/02/220169902.db2.gz	BLIKLAPFZDOLLH-UHFFFAOYSA-N	-1	0	364.210	2.694	50	0		FFAARM
COc1ccc(-n2cccc2/C=C2\SC(=O)N(CC(=O)[O-])C2=O)cc1	ZINC000016226426	220181227	/nfs/dbraw/zinc/18/12/27/220181227.db2.gz	WQCNGYOQHQJIDO-ZROIWOOFSA-N	-1	0	358.375	2.607	50	0		FFAARM
COc1ccc([N-]S(=O)(=O)c2ccc(OC)cc2OC)c(OC)c1	ZINC000017073163	220202826	/nfs/dbraw/zinc/20/28/26/220202826.db2.gz	USFYGINLRGMGBH-UHFFFAOYSA-N	-1	0	353.396	2.522	50	0		FFAARM
O=C([O-])COCC(=O)Nc1sc2c(c1C(=O)Nc1ccccc1)CCC2	ZINC000017076586	220204576	/nfs/dbraw/zinc/20/45/76/220204576.db2.gz	USTWKKTUXCRUPB-UHFFFAOYSA-N	-1	0	374.418	2.529	50	0		FFAARM
CCN1C(=O)Cc2cc([N-]S(=O)(=O)c3ccc(F)cc3F)ccc21	ZINC000017289030	220211343	/nfs/dbraw/zinc/21/13/43/220211343.db2.gz	RRLJTGPEHDHCSE-UHFFFAOYSA-N	-1	0	352.362	2.675	50	0		FFAARM
CC[C@H](C)n1c2nc(-c3cccnc3)cc(C(=O)[O-])c2c(=O)[nH]c1=S	ZINC000020615428	220336711	/nfs/dbraw/zinc/33/67/11/220336711.db2.gz	GLAQJHYFJVBALO-VIFPVBQESA-N	-1	0	356.407	2.811	50	0		FFAARM
CCc1cccc([N-]S(=O)(=O)c2cc(Br)cnc2N)c1	ZINC000020467633	220327955	/nfs/dbraw/zinc/32/79/55/220327955.db2.gz	OCAFXYNELAUHKV-UHFFFAOYSA-N	-1	0	356.245	2.790	50	0		FFAARM
O=C([O-])c1ccc(OCCNS(=O)(=O)c2ccc3ccccc3c2)cc1	ZINC000020534245	220330610	/nfs/dbraw/zinc/33/06/10/220330610.db2.gz	RPRHLTVNVSZVCN-UHFFFAOYSA-N	-1	0	371.414	2.895	50	0		FFAARM
COc1ccc(-c2nc(CC(=O)N3CCC[C@@H](C(=O)[O-])C3)cs2)cc1	ZINC000020729759	220339198	/nfs/dbraw/zinc/33/91/98/220339198.db2.gz	MOEMNSUGKKKAIB-CYBMUJFWSA-N	-1	0	360.435	2.684	50	0		FFAARM
O=C([O-])C1=Nc2nc(-c3ccccc3)nn2[C@H](c2ccc3c(c2)OCO3)C1	ZINC000020745670	220340090	/nfs/dbraw/zinc/34/00/90/220340090.db2.gz	BXGJNCCVTQSBOA-AWEZNQCLSA-N	-1	0	362.345	2.657	50	0		FFAARM
Cc1cn2c(nc(C)c(S(=O)(=O)[N-]c3ccc(F)cc3C)c2=O)s1	ZINC000020922020	220346612	/nfs/dbraw/zinc/34/66/12/220346612.db2.gz	YNWCSTOGMTULSV-UHFFFAOYSA-N	-1	0	367.427	2.621	50	0		FFAARM
O=C(Nc1ccc(S(=O)(=O)[N-]c2ncccn2)cc1)[C@@H]1CC=CCC1	ZINC000021335115	220356229	/nfs/dbraw/zinc/35/62/29/220356229.db2.gz	DDVFLQANUFRGLX-CYBMUJFWSA-N	-1	0	358.423	2.572	50	0		FFAARM
Cc1nc2sc([C@@H](c3ccccc3Cl)N3CCOCC3)c([O-])n2n1	ZINC000022626660	220392242	/nfs/dbraw/zinc/39/22/42/220392242.db2.gz	ADMCWHAABMWCHC-CYBMUJFWSA-N	-1	0	364.858	2.880	50	0		FFAARM
O=C([O-])[C@H]1CC=CC[C@H]1C(=O)Nc1cccc(CN2CCCCC2=O)c1	ZINC000051186051	221034456	/nfs/dbraw/zinc/03/44/56/221034456.db2.gz	VNUPHNBKQPRWKO-SJORKVTESA-N	-1	0	356.422	2.805	50	0		FFAARM
Cc1ccc2nc(C)c(C(=O)N[C@@H](Cc3ccc(O)cc3)C(=O)[O-])cc2c1	ZINC000055393686	221068805	/nfs/dbraw/zinc/06/88/05/221068805.db2.gz	HDULZBGQNYDFCR-IBGZPJMESA-N	-1	0	364.401	2.983	50	0		FFAARM
Cc1cc(-n2cc(C(=O)[O-])c3c2[C@@H](c2ccc(O)cc2)CC(=O)N3)no1	ZINC000061717684	221134193	/nfs/dbraw/zinc/13/41/93/221134193.db2.gz	LNTWVWMEFOVSAQ-GFCCVEGCSA-N	-1	0	353.334	2.652	50	0		FFAARM
CC(C)NC(=O)C1CCN(C(=O)c2ccc(Br)cc2O)CC1	ZINC000058244073	221110655	/nfs/dbraw/zinc/11/06/55/221110655.db2.gz	PAGKYIGRBJTOSH-UHFFFAOYSA-N	-1	0	369.259	2.532	50	0		FFAARM
Cc1ccnn1-c1cccc(NS(=O)(=O)c2cccc(C(=O)[O-])c2)c1	ZINC000058368834	221115474	/nfs/dbraw/zinc/11/54/74/221115474.db2.gz	PJTLGSUDLQDPKX-UHFFFAOYSA-N	-1	0	357.391	2.680	50	0		FFAARM
COC(=O)c1cc(S(=O)(=O)[N-]c2cc(Cl)ccc2C)c(C)n1C	ZINC000064922943	221155851	/nfs/dbraw/zinc/15/58/51/221155851.db2.gz	VWBQMMYBSMUALD-UHFFFAOYSA-N	-1	0	356.831	2.883	50	0		FFAARM
CCc1ccc([N-]S(=O)(=O)c2cc3[nH]c(=O)[nH]c3cc2Cl)cc1	ZINC000064976600	221159175	/nfs/dbraw/zinc/15/91/75/221159175.db2.gz	GMLSUFAPOODIOW-UHFFFAOYSA-N	-1	0	351.815	2.873	50	0		FFAARM
CCOc1ccccc1[N-]S(=O)(=O)c1cc2[nH]c(=O)[nH]c2cc1Cl	ZINC000064976590	221159445	/nfs/dbraw/zinc/15/94/45/221159445.db2.gz	ZUTKWMHUZUQATG-UHFFFAOYSA-N	-1	0	367.814	2.709	50	0		FFAARM
CCOC(=O)c1ccc(NC(=O)Cc2c(C(=O)[O-])c(C)cn2CC)cc1	ZINC000064983759	221161974	/nfs/dbraw/zinc/16/19/74/221161974.db2.gz	OCGNWEBKLMUNSI-UHFFFAOYSA-N	-1	0	358.394	2.873	50	0		FFAARM
CCc1ccccc1[N-]S(=O)(=O)c1cc(-c2ccc(=O)[nH]n2)cs1	ZINC000065119297	221170598	/nfs/dbraw/zinc/17/05/98/221170598.db2.gz	PGOOGRHJQLFRGW-UHFFFAOYSA-N	-1	0	361.448	2.862	50	0		FFAARM
COc1ccc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2OC)c(Cl)c1	ZINC000065833727	221237226	/nfs/dbraw/zinc/23/72/26/221237226.db2.gz	MOPPAWUMHIBAJY-UHFFFAOYSA-N	-1	0	371.798	2.856	50	0		FFAARM
O=C([O-])c1nn(CC2CC2)c2c1CN(C(=O)c1cc3sccc3[nH]1)CC2	ZINC000067562816	221259655	/nfs/dbraw/zinc/25/96/55/221259655.db2.gz	PLCHOWMCPFMXQK-UHFFFAOYSA-N	-1	0	370.434	2.733	50	0		FFAARM
C[C@H](c1nnc(SCC(=O)[O-])n1-c1ccccc1Cl)n1cccn1	ZINC000067834140	221291837	/nfs/dbraw/zinc/29/18/37/221291837.db2.gz	QVKJYHYDDCRXEZ-SNVBAGLBSA-N	-1	0	363.830	2.903	50	0		FFAARM
CCc1ccc(-c2cn3c(C(=O)N[C@@H](C)c4nnn[n-]4)csc3n2)cc1	ZINC000067894262	221301170	/nfs/dbraw/zinc/30/11/70/221301170.db2.gz	UDBWTLDPHJVHKB-JTQLQIEISA-N	-1	0	367.438	2.629	50	0		FFAARM
CC(C)(C)OC(=O)N1C[C@@H](n2cc(-c3ccccc3)nn2)C[C@H]1C(=O)[O-]	ZINC000071257083	221337414	/nfs/dbraw/zinc/33/74/14/221337414.db2.gz	ADNVHPPFKNQHHE-ZFWWWQNUSA-N	-1	0	358.398	2.580	50	0		FFAARM
COc1cc(NC(=O)[C@@H]2[C@H](C(=O)[O-])C2(C)C)ccc1NC(=O)c1ccco1	ZINC000071280376	221338612	/nfs/dbraw/zinc/33/86/12/221338612.db2.gz	XZJQARGVAKCOTF-LSDHHAIUSA-N	-1	0	372.377	2.836	50	0		FFAARM
CCc1nnc(-c2ccc(O)c(NC(=O)Cc3ccccc3C(=O)[O-])c2)o1	ZINC000071284592	221339032	/nfs/dbraw/zinc/33/90/32/221339032.db2.gz	CTBLEBBFASPALL-UHFFFAOYSA-N	-1	0	367.361	2.884	50	0		FFAARM
CC1(C)[C@H](C(=O)[O-])[C@@H]1C(=O)Nc1ccc(C(=O)NCc2ccco2)cc1	ZINC000071288224	221340121	/nfs/dbraw/zinc/34/01/21/221340121.db2.gz	LPHKYQKNKXIOBP-CABCVRRESA-N	-1	0	356.378	2.505	50	0		FFAARM
COc1ccccc1S(=O)(=O)N1CC[C@@H](c2ccccc2C(=O)[O-])C1	ZINC000072145312	221422882	/nfs/dbraw/zinc/42/28/82/221422882.db2.gz	LREQPABZTUUMON-CYBMUJFWSA-N	-1	0	361.419	2.572	50	0		FFAARM
COc1ccc(S(=O)(=O)[N-]c2cc(-c3ccncc3)nn2C)c(C)c1	ZINC000072301884	221459753	/nfs/dbraw/zinc/45/97/53/221459753.db2.gz	ZNESWUWLVNDKQO-UHFFFAOYSA-N	-1	0	358.423	2.600	50	0		FFAARM
COc1ccc(CNC(=O)[C@H]2Cc3cc(Cl)ccc3O2)cc1C(=O)[O-]	ZINC000299745974	533644815	/nfs/dbraw/zinc/64/48/15/533644815.db2.gz	UJXHABYGZMRSND-MRXNPFEDSA-N	-1	0	361.781	2.667	50	0		FFAARM
O=C([O-])c1ccc(N2CCC[C@@H](c3nccn3Cc3ccccn3)C2)nc1	ZINC000095367468	132208321	/nfs/dbraw/zinc/20/83/21/132208321.db2.gz	MYCMZGAWOMIHOA-MRXNPFEDSA-N	-1	0	363.421	2.804	50	0		FFAARM
O=C([O-])c1ccc(-c2ccccc2)nc1N1CCC2(CC1)OCCC[C@H]2O	ZINC000095380549	132209454	/nfs/dbraw/zinc/20/94/54/132209454.db2.gz	URASIHOXABBDAR-GOSISDBHSA-N	-1	0	368.433	2.957	50	0		FFAARM
Cc1nc([C@@H]2CCCN(c3ncccc3C(=O)[O-])C2)cc(N2CCCC2)n1	ZINC000072475430	136149222	/nfs/dbraw/zinc/14/92/22/136149222.db2.gz	DLFLPYGZTDTQND-OAHLLOKOSA-N	-1	0	367.453	2.862	50	0		FFAARM
O=C([O-])[C@@]12CN(C(=O)c3ccc4ncccc4c3)C[C@@H]1c1ccccc1OC2	ZINC000095354015	221854813	/nfs/dbraw/zinc/85/48/13/221854813.db2.gz	VNLHHFQAQXSOBL-VGOFRKELSA-N	-1	0	374.396	2.938	50	0		FFAARM
O=C([O-])[C@@H](Cc1ccc(F)cc1)NC(=O)c1ncoc1-c1cccs1	ZINC000095989716	221985785	/nfs/dbraw/zinc/98/57/85/221985785.db2.gz	LSSNELHASUKKCX-GFCCVEGCSA-N	-1	0	360.366	2.968	50	0		FFAARM
O=C(NCc1ccc(Cl)cc1)c1c([O-])c2cccc3c2n(c1=O)CC3	ZINC000100621227	222248412	/nfs/dbraw/zinc/24/84/12/222248412.db2.gz	MYNNLRZPNHJOKP-UHFFFAOYSA-N	-1	0	354.793	2.847	50	0		FFAARM
Cc1ccc([C@H]2CC(c3c(=O)[nH]c(=O)n(C4CCCCC4)c3[O-])=NN2)s1	ZINC000101762205	222283464	/nfs/dbraw/zinc/28/34/64/222283464.db2.gz	JWSSMLKCBFDHRW-GFCCVEGCSA-N	-1	0	374.466	2.556	50	0		FFAARM
CCNC(=O)Nc1ccc(-c2nc([N-]c3nc(C)cc(C)n3)n[nH]2)cc1	ZINC000008560181	263356260	/nfs/dbraw/zinc/35/62/60/263356260.db2.gz	OGMAWASQQRBRRJ-UHFFFAOYSA-N	-1	0	352.402	2.764	50	0		FFAARM
COc1cc2c(cc1OC)[C@H](CC(=O)[O-])N(C(=O)c1ccccc1)CC2	ZINC000012505578	263370902	/nfs/dbraw/zinc/37/09/02/263370902.db2.gz	DZQPKVVYBUQCRW-INIZCTEOSA-N	-1	0	355.390	2.918	50	0		FFAARM
CCCn1ncc(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)[O-])c1C	ZINC000095527715	263429085	/nfs/dbraw/zinc/42/90/85/263429085.db2.gz	CGIHBVRNLWUXAC-KRWDZBQOSA-N	-1	0	354.410	2.509	50	0		FFAARM
Cc1ccc(C(=O)N2CCC[C@@H](c3ccnn3CC(=O)[O-])C2)cc1Cl	ZINC000426442892	263592642	/nfs/dbraw/zinc/59/26/42/263592642.db2.gz	JSCXWBHMDPZDOU-CQSZACIVSA-N	-1	0	361.829	2.949	50	0		FFAARM
CCc1ccccc1NC(=O)N1CCC[C@H](c2ccn(CC(=O)[O-])n2)C1	ZINC000426504445	263611969	/nfs/dbraw/zinc/61/19/69/263611969.db2.gz	GOHKYNKLCQENPS-HNNXBMFYSA-N	-1	0	356.426	2.942	50	0		FFAARM
O=C(CSc1nncc(=O)[n-]1)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000005626215	506451889	/nfs/dbraw/zinc/45/18/89/506451889.db2.gz	WYUXHZUVNRBMDL-UHFFFAOYSA-N	-1	0	364.736	2.568	50	0		FFAARM
C[C@H](NC(=O)CSc1nnc(-c2ccccc2)c(=O)[n-]1)c1ccccc1	ZINC000001282225	506258707	/nfs/dbraw/zinc/25/87/07/506258707.db2.gz	YVOLDOCGAIDGIH-ZDUSSCGKSA-N	-1	0	366.446	2.801	50	0		FFAARM
O=c1[nH]c2ccc(S(=O)(=O)[N-]c3cnc4ccccc4c3)cc2s1	ZINC000001424459	506262320	/nfs/dbraw/zinc/26/23/20/506262320.db2.gz	DSRXMMGQYIZWLS-UHFFFAOYSA-N	-1	0	357.416	2.939	50	0		FFAARM
COc1ccc(Br)cc1[C@@H]1SC[C@@H](C(=O)[O-])N1C(C)=O	ZINC000002763439	506290180	/nfs/dbraw/zinc/29/01/80/506290180.db2.gz	UZGPXPRWSYHLDM-JQWIXIFHSA-N	-1	0	360.229	2.505	50	0		FFAARM
Cc1ccc(C(=O)[O-])cc1NC(=O)[C@@H](C)Cn1cc(Br)cn1	ZINC000002794428	506293511	/nfs/dbraw/zinc/29/35/11/506293511.db2.gz	CMEJXKXZLYOCRN-JTQLQIEISA-N	-1	0	366.215	2.927	50	0		FFAARM
COc1cc(NC(=O)CC2(C(=O)[O-])CCCC2)ccc1N1CCCC1=O	ZINC000032772002	506293985	/nfs/dbraw/zinc/29/39/85/506293985.db2.gz	NJVIQWJYYGJNRX-UHFFFAOYSA-N	-1	0	360.410	2.796	50	0		FFAARM
C[C@@H](NS(=O)(=O)c1ccc(OCC(=O)[O-])c(Cl)c1)c1ccccc1	ZINC000002872280	506299523	/nfs/dbraw/zinc/29/95/23/506299523.db2.gz	ICSDHJDGCPDZIL-LLVKDONJSA-N	-1	0	369.826	2.843	50	0		FFAARM
O=C([O-])[C@H]1CCCN1C(=O)C(NC(=O)c1ccccc1)=C1CCCCC1	ZINC000003671319	506350216	/nfs/dbraw/zinc/35/02/16/506350216.db2.gz	DUSKWHYUEMJMSE-MRXNPFEDSA-N	-1	0	356.422	2.710	50	0		FFAARM
O=C([O-])[C@@H]1Sc2[nH]c(=O)sc2[C@H]2c3cc(Cl)ccc3OC(=O)[C@@H]12	ZINC000004597841	506384240	/nfs/dbraw/zinc/38/42/40/506384240.db2.gz	GLRLETCXFWLLIY-QXFUBDJGSA-N	-1	0	369.807	2.728	50	0		FFAARM
O=C([O-])CCCN1C(=O)[C@H]2[C@H](C1=O)C1c3ccccc3C2c2ccccc21	ZINC000004134932	506361374	/nfs/dbraw/zinc/36/13/74/506361374.db2.gz	NNUJYUGKZMAOCH-NTFDOXNWSA-N	-1	0	361.397	2.743	50	0		FFAARM
Cn1cc(Br)c(-c2cccc(NC(=O)CCC(=O)[O-])c2)n1	ZINC000004324711	506371844	/nfs/dbraw/zinc/37/18/44/506371844.db2.gz	CBSRRUVFYMTCIH-UHFFFAOYSA-N	-1	0	352.188	2.653	50	0		FFAARM
O=C(CSC1=Nc2ccccc2S(=O)(=O)[N-]1)OCc1ccccc1	ZINC000004329640	506372472	/nfs/dbraw/zinc/37/24/72/506372472.db2.gz	QILXOIMZSZAYQT-UHFFFAOYSA-N	-1	0	362.432	2.633	50	0		FFAARM
CC(C)c1ccc(S(=O)(=O)Nc2cnc(N(C)C)c(C(=O)[O-])c2)cc1	ZINC000035397724	506381789	/nfs/dbraw/zinc/38/17/89/506381789.db2.gz	ZOHQGGDOQREVBA-UHFFFAOYSA-N	-1	0	363.439	2.770	50	0		FFAARM
CC(C)Oc1ccc([C@@H](CC(=O)[O-])NS(=O)(=O)c2ccccc2)cc1	ZINC000004580861	506383286	/nfs/dbraw/zinc/38/32/86/506383286.db2.gz	WDLNFWDZMXZPLQ-QGZVFWFLSA-N	-1	0	363.435	2.968	50	0		FFAARM
Cc1ccc(NS(=O)(=O)c2ccc(NC(=O)/C=C/C(=O)[O-])cc2)c(C)c1	ZINC000004662697	506386517	/nfs/dbraw/zinc/38/65/17/506386517.db2.gz	HIALGPJMAPWDIS-MDZDMXLPSA-N	-1	0	374.418	2.684	50	0		FFAARM
Cn1c(SCC(=O)Nc2ccc(C(=O)[O-])cc2)nnc1-c1ccco1	ZINC000004739034	506392090	/nfs/dbraw/zinc/39/20/90/506392090.db2.gz	YQSLKMXPILJTSF-UHFFFAOYSA-N	-1	0	358.379	2.504	50	0		FFAARM
CC(=O)Oc1ccc(NC(=O)COc2cccc(C)c2C)c(C(=O)[O-])c1	ZINC000004825236	506397495	/nfs/dbraw/zinc/39/74/95/506397495.db2.gz	AGDJJDIJGWFORR-UHFFFAOYSA-N	-1	0	357.362	2.944	50	0		FFAARM
COc1ccc(C(=O)Nc2ccccc2C(=O)N[C@@H](C(=O)[O-])C(C)C)cc1	ZINC000004866134	506401249	/nfs/dbraw/zinc/40/12/49/506401249.db2.gz	ICNWLOCYNRZUJT-QGZVFWFLSA-N	-1	0	370.405	2.787	50	0		FFAARM
Cc1nnc(S[C@H](C)C(=O)Nc2nc(-c3ccccc3)cs2)[n-]c1=O	ZINC000004911686	506406181	/nfs/dbraw/zinc/40/61/81/506406181.db2.gz	FLELWOIMNWMAEJ-SNVBAGLBSA-N	-1	0	373.463	2.716	50	0		FFAARM
O=C([O-])c1cccc(S(=O)(=O)Nc2cccc(Br)c2)c1	ZINC000036403771	506406358	/nfs/dbraw/zinc/40/63/58/506406358.db2.gz	GFGFWFQIEKHTRB-UHFFFAOYSA-N	-1	0	356.197	2.948	50	0		FFAARM
CN1C(=O)C(=Cc2ccccc2OCc2ccc(C(=O)[O-])cc2)NC1=S	ZINC000005904352	506461901	/nfs/dbraw/zinc/46/19/01/506461901.db2.gz	NYYXJEMFEOJIPF-XNTDXEJSSA-N	-1	0	368.414	2.651	50	0		FFAARM
O=S(=O)([N-]c1ccc(S(=O)(=O)C(F)F)cc1)c1ccccc1F	ZINC000006315729	506476495	/nfs/dbraw/zinc/47/64/95/506476495.db2.gz	KHIOELFQHHBXCM-UHFFFAOYSA-N	-1	0	365.354	2.623	50	0		FFAARM
O=C([O-])[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(O)(C(F)(F)F)C(F)(F)F)cc1	ZINC000006863210	506512551	/nfs/dbraw/zinc/51/25/51/506512551.db2.gz	QCBAODFXUVDXOG-DTWKUNHWSA-N	-1	0	371.233	2.658	50	0		FFAARM
CC(=O)c1ccccc1[N-]S(=O)(=O)c1ccc(N2CCCC2=O)cc1	ZINC000007708900	506584454	/nfs/dbraw/zinc/58/44/54/506584454.db2.gz	LOJOWYZHXJFWGT-UHFFFAOYSA-N	-1	0	358.419	2.817	50	0		FFAARM
CCc1sc(C(=O)[N-]S(=O)(=O)c2ccc3c(c2)OCCO3)cc1C	ZINC000042268669	506614342	/nfs/dbraw/zinc/61/43/42/506614342.db2.gz	NRCYJTGVSIKPFR-UHFFFAOYSA-N	-1	0	367.448	2.509	50	0		FFAARM
CCC1C(=O)N=C(SCC(=O)Nc2cccc3ccccc32)N=C1[O-]	ZINC000008573204	506658780	/nfs/dbraw/zinc/65/87/80/506658780.db2.gz	IKKLIBLPRCYADF-UHFFFAOYSA-N	-1	0	355.419	2.922	50	0		FFAARM
COc1cc(S(=O)(=O)[N-]c2ccccn2)c(C)cc1Br	ZINC000011613765	506783340	/nfs/dbraw/zinc/78/33/40/506783340.db2.gz	XPOLBCORNDRMEN-UHFFFAOYSA-N	-1	0	357.229	2.962	50	0		FFAARM
CCCN(Cc1nc(=O)c2sccc2[n-]1)C(=O)c1n[nH]c2ccccc21	ZINC000012507360	506870662	/nfs/dbraw/zinc/87/06/62/506870662.db2.gz	CNXFEYFIIXRDAZ-UHFFFAOYSA-N	-1	0	367.434	2.913	50	0		FFAARM
O=C([N-]N1C(=O)NC2(CCCCC2)C1=O)c1cc(Cl)ccc1Cl	ZINC000014792469	507000069	/nfs/dbraw/zinc/00/00/69/507000069.db2.gz	FQZKDLOMNLVHDW-UHFFFAOYSA-N	-1	0	356.209	2.893	50	0		FFAARM
O=c1[nH]c(=S)[n-]c2c1sc1nc(N3CCOCC3)c3c(c12)CCC3	ZINC000018177614	507143278	/nfs/dbraw/zinc/14/32/78/507143278.db2.gz	YXRORORPMLIQIE-UHFFFAOYSA-N	-1	0	360.464	2.933	50	0		FFAARM
COCCN(CC(=O)[O-])C(=O)OCC1c2ccccc2-c2ccccc21	ZINC000070915543	507659407	/nfs/dbraw/zinc/65/94/07/507659407.db2.gz	JMZNWGXELFZOKV-UHFFFAOYSA-N	-1	0	355.390	2.969	50	0		FFAARM
O=C([O-])c1ccccc1[C@H]1CCN(C(=O)c2ccccc2-n2cncn2)C1	ZINC000072164855	507767386	/nfs/dbraw/zinc/76/73/86/507767386.db2.gz	OVNYHNRPUNHFNI-AWEZNQCLSA-N	-1	0	362.389	2.595	50	0		FFAARM
O=C([O-])CCc1cc2n(n1)CCCN(c1nccc(C3CCCC3)n1)C2	ZINC000072407949	507784934	/nfs/dbraw/zinc/78/49/34/507784934.db2.gz	DXNOQKYELDSQMM-UHFFFAOYSA-N	-1	0	355.442	2.758	50	0		FFAARM
O=C([O-])C[C@H]1COCCN1C(=O)c1ccc(CSc2ccccc2)o1	ZINC000072475645	507795941	/nfs/dbraw/zinc/79/59/41/507795941.db2.gz	DHAWBDRLWKJYPE-ZDUSSCGKSA-N	-1	0	361.419	2.888	50	0		FFAARM
Cc1ccc(S(=O)(=O)Nc2cccc(Cn3cccn3)c2)cc1C(=O)[O-]	ZINC000031722515	507821253	/nfs/dbraw/zinc/82/12/53/507821253.db2.gz	QDAFQDUCQSFICN-UHFFFAOYSA-N	-1	0	371.418	2.739	50	0		FFAARM
O=c1[nH]cc(C(F)(F)F)cc1[N-]S(=O)(=O)c1cc(F)ccc1Cl	ZINC000089769691	507864147	/nfs/dbraw/zinc/86/41/47/507864147.db2.gz	BRNYDNKFVGSVME-UHFFFAOYSA-N	-1	0	370.711	2.987	50	0		FFAARM
CCc1ccc(NC(=O)N2CCC3(CCC(=O)N(CC(=O)[O-])C3)CC2)cc1	ZINC000091620135	507996237	/nfs/dbraw/zinc/99/62/37/507996237.db2.gz	WAWORBPWALVCCQ-UHFFFAOYSA-N	-1	0	373.453	2.570	50	0		FFAARM
COc1cccc([C@@H]2CN(C(=O)c3ccc(C)cc3O)C[C@H]2C(=O)[O-])c1	ZINC000091620043	507996539	/nfs/dbraw/zinc/99/65/39/507996539.db2.gz	JFKYSHCHQJXVJO-DLBZAZTESA-N	-1	0	355.390	2.650	50	0		FFAARM
O=C([O-])c1ccccc1-c1cn(CCc2nc3cc(F)ccc3[nH]2)nn1	ZINC000095363135	508176676	/nfs/dbraw/zinc/17/66/76/508176676.db2.gz	FPSBYLXNYACHPA-UHFFFAOYSA-N	-1	0	351.341	2.901	50	0		FFAARM
CSc1ccccc1[C@@H](C(=O)[O-])N1CCN(Cc2cccnc2)CC1	ZINC000095363129	508176735	/nfs/dbraw/zinc/17/67/35/508176735.db2.gz	APHOMWXKLCJVIZ-SFHVURJKSA-N	-1	0	357.479	2.747	50	0		FFAARM
CC(C)c1ccc(NC(=O)N2CCC3(CC2)[C@@H](C(=O)[O-])CC(=O)N3C)cc1	ZINC000095376525	508179848	/nfs/dbraw/zinc/17/98/48/508179848.db2.gz	NVOOBPOUPFSIOU-MRXNPFEDSA-N	-1	0	373.453	2.739	50	0		FFAARM
O=C([O-])[C@@H](c1ccc(Cl)c(F)c1)N1CCN(Cc2ccccn2)CC1	ZINC000095383103	508181283	/nfs/dbraw/zinc/18/12/83/508181283.db2.gz	MLFWOEVTMLFYQT-QGZVFWFLSA-N	-1	0	363.820	2.818	50	0		FFAARM
Cc1nn(C)c(C)c1C[C@@H](C)C(=O)N[C@@H](C(=O)[O-])c1ccccc1Cl	ZINC000095464030	508187247	/nfs/dbraw/zinc/18/72/47/508187247.db2.gz	LMNPMQZBKUOUCZ-QLJPJBMISA-N	-1	0	363.845	2.811	50	0		FFAARM
O=C([O-])[C@@H](c1ccc(O)cc1)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000095498323	508189841	/nfs/dbraw/zinc/18/98/41/508189841.db2.gz	ZALZATDQIAXXOB-GOSISDBHSA-N	-1	0	360.841	2.989	50	0		FFAARM
Cc1nn(C)c(Oc2ccc(C(=O)[O-])cc2)c1I	ZINC000095704865	508197635	/nfs/dbraw/zinc/19/76/35/508197635.db2.gz	DUAGEPFZOMAIIM-UHFFFAOYSA-N	-1	0	358.135	2.824	50	0		FFAARM
Cc1nc(C(=O)N2CCCC[C@H]2C(=O)[O-])nn1-c1ccccc1C(C)C	ZINC000136488355	508697653	/nfs/dbraw/zinc/69/76/53/508697653.db2.gz	WAVHYECXLQTGPN-INIZCTEOSA-N	-1	0	356.426	2.778	50	0		FFAARM
Cc1ncc(CN2CCN(C(=O)c3cc(F)cc(Cl)c3[O-])CC2)s1	ZINC000151118674	508960492	/nfs/dbraw/zinc/96/04/92/508960492.db2.gz	GAZUIPZDXRZNHU-UHFFFAOYSA-N	-1	0	369.849	2.908	50	0		FFAARM
Cc1noc(C)c1S(=O)(=O)NCc1ccc(C(=O)c2ccco2)s1	ZINC000211082298	509239902	/nfs/dbraw/zinc/23/99/02/509239902.db2.gz	BAIWSPOUAXVILP-UHFFFAOYSA-N	-1	0	366.420	2.655	50	0		FFAARM
O=S(=O)(/C=C\c1ccccc1Cl)[N-]c1ncn(-c2ccccn2)n1	ZINC000222096543	509311889	/nfs/dbraw/zinc/31/18/89/509311889.db2.gz	WDNGQQCOMGTHJQ-NTMALXAHSA-N	-1	0	361.814	2.728	50	0		FFAARM
CN(Cc1ccc(C(=O)[O-])cc1)C(=O)c1ccc(N2CCCC2=O)cc1	ZINC000237067979	509563671	/nfs/dbraw/zinc/56/36/71/509563671.db2.gz	OZUKDXAWPUWEGT-UHFFFAOYSA-N	-1	0	352.390	2.784	50	0		FFAARM
C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)N1CCO[C@H](CC(=O)[O-])C1	ZINC000237340636	509626560	/nfs/dbraw/zinc/62/65/60/509626560.db2.gz	VVLWDJPRKOTYLH-SMDDNHRTSA-N	-1	0	359.344	2.586	50	0		FFAARM
COc1ccc([N-]S(=O)(=O)c2ccc(SC(F)(F)F)cc2)nn1	ZINC000170609087	509679009	/nfs/dbraw/zinc/67/90/09/509679009.db2.gz	LOOOUMVAKYMHCE-UHFFFAOYSA-N	-1	0	365.358	2.898	50	0		FFAARM
COc1ccc(-c2ncc(C(=O)[N-]S(=O)(=O)CC(C)(C)C)s2)cc1	ZINC000170645739	509695012	/nfs/dbraw/zinc/69/50/12/509695012.db2.gz	OWFNOJJYORPXIM-UHFFFAOYSA-N	-1	0	368.480	2.924	50	0		FFAARM
COc1ccc([C@H](C)CC(=O)[N-]S(=O)(=O)c2sc(C)nc2C)cc1	ZINC000170654747	509701192	/nfs/dbraw/zinc/70/11/92/509701192.db2.gz	FOQROCCHRGTNEY-SNVBAGLBSA-N	-1	0	368.480	2.767	50	0		FFAARM
Cc1ccc(CCC2CCN(C(=O)CN3CCC[C@H]3C(=O)[O-])CC2)cc1	ZINC000237703068	509715328	/nfs/dbraw/zinc/71/53/28/509715328.db2.gz	CEWXGAUKRHOLHH-IBGZPJMESA-N	-1	0	358.482	2.715	50	0		FFAARM
Cn1c(C(=O)N(CCC(=O)[O-])C[C@@H]2CCCO2)ccc1-c1ccccc1	ZINC000237709814	509716181	/nfs/dbraw/zinc/71/61/81/509716181.db2.gz	DPUJAINLURFTAQ-INIZCTEOSA-N	-1	0	356.422	2.788	50	0		FFAARM
Cc1cc(C)n(-c2ccc(C(=O)N3[C@H](C(=O)[O-])C[C@H]4CCCC[C@@H]43)cn2)n1	ZINC000237787231	509735629	/nfs/dbraw/zinc/73/56/29/509735629.db2.gz	BFRDHTVWBXNBED-PVAVHDDUSA-N	-1	0	368.437	2.742	50	0		FFAARM
Cc1nc(-c2cccc(C(=O)N(CC(=O)[O-])C3CCOCC3)c2)cs1	ZINC000237808446	509740529	/nfs/dbraw/zinc/74/05/29/509740529.db2.gz	FSCYVTNRTGZRGG-UHFFFAOYSA-N	-1	0	360.435	2.824	50	0		FFAARM
O=C([O-])CCN(C(=O)c1ccc(Br)c(F)c1)C1CCOCC1	ZINC000238074152	509814346	/nfs/dbraw/zinc/81/43/46/509814346.db2.gz	JCBAXIVUWJRTLR-UHFFFAOYSA-N	-1	0	374.206	2.684	50	0		FFAARM
O=C([O-])c1ccc(CNC(=O)C2(c3ccc(F)cc3)CCOCC2)cc1	ZINC000238105658	509822102	/nfs/dbraw/zinc/82/21/02/509822102.db2.gz	OAMSPBNVMUPQNR-UHFFFAOYSA-N	-1	0	357.381	2.889	50	0		FFAARM
O=C([O-])CN(C(=O)c1csc(-c2ccsc2)n1)C1CCOCC1	ZINC000238116090	509823368	/nfs/dbraw/zinc/82/33/68/509823368.db2.gz	UDYJZEUMIUFMLD-UHFFFAOYSA-N	-1	0	352.437	2.577	50	0		FFAARM
O=C([O-])CN(Cc1ccccc1)C(=O)c1cc(N2CCCC2=O)ccc1F	ZINC000238151118	509826953	/nfs/dbraw/zinc/82/69/53/509826953.db2.gz	WXKFNCCQGXSWCL-UHFFFAOYSA-N	-1	0	370.380	2.680	50	0		FFAARM
O=C([O-])CN1CCC[C@@H]1c1nc(Cc2ccc(Br)cc2)no1	ZINC000238155991	509828465	/nfs/dbraw/zinc/82/84/65/509828465.db2.gz	YSBSFTQUQLVNPH-GFCCVEGCSA-N	-1	0	366.215	2.644	50	0		FFAARM
O=C([O-])C[C@@H]1CN(C(=O)[C@H]2C[C@@H]2c2ccccc2C(F)(F)F)CCO1	ZINC000238197205	509831710	/nfs/dbraw/zinc/83/17/10/509831710.db2.gz	XVEZOBFPJUVZST-RTXFEEFZSA-N	-1	0	357.328	2.511	50	0		FFAARM
O=C([O-])C[C@@H]1CN(C(=O)CCCCc2nc3ccccc3s2)CCO1	ZINC000238195425	509831821	/nfs/dbraw/zinc/83/18/21/509831821.db2.gz	WLYXLJOEUNYPJU-CYBMUJFWSA-N	-1	0	362.451	2.711	50	0		FFAARM
COc1ccc(NC(=O)C(C#N)=NNc2cc(C(=O)[O-])ccc2C)cc1	ZINC000254628294	509909424	/nfs/dbraw/zinc/90/94/24/509909424.db2.gz	OJMHQNRUUOGZLZ-UHFFFAOYSA-N	-1	0	352.350	2.632	50	0		FFAARM
C[C@@H]1CC[C@@H](C(=O)[O-])CN1C(=O)Cc1csc(Cc2ccccc2)n1	ZINC000263160053	510591935	/nfs/dbraw/zinc/59/19/35/510591935.db2.gz	IGYMDATVIWUFKE-UKRRQHHQSA-N	-1	0	358.463	2.988	50	0		FFAARM
O=C([O-])c1csc(NC(=O)CCC(=O)N2CCc3sccc3C2)c1	ZINC000191356362	510620561	/nfs/dbraw/zinc/62/05/61/510620561.db2.gz	KRRNJGDURSBGSD-UHFFFAOYSA-N	-1	0	364.448	2.811	50	0		FFAARM
COc1ccc(CCC(=O)N2[C@@H]3CCCC[C@H]3C[C@H]2C(=O)[O-])cc1OC	ZINC000263680042	510785927	/nfs/dbraw/zinc/78/59/27/510785927.db2.gz	GZJOMPUUNLBZPA-XHSDSOJGSA-N	-1	0	361.438	2.881	50	0		FFAARM
Cc1ccc(-n2[n-]c(C(=O)Nc3nc4c(s3)CSCC4)cc2=O)cc1	ZINC000376105479	512662816	/nfs/dbraw/zinc/66/28/16/512662816.db2.gz	YWIHPDICHQCGLB-UHFFFAOYSA-N	-1	0	372.475	2.972	50	0		FFAARM
O=C([O-])Cn1ccc([C@H]2CCCN(C(=O)c3ccc(Cl)c(F)c3)C2)n1	ZINC000426387832	513924881	/nfs/dbraw/zinc/92/48/81/513924881.db2.gz	SSNRBYWJBOJKQI-LBPRGKRZSA-N	-1	0	365.792	2.780	50	0		FFAARM
Cc1ccc(C)c(CC(=O)N2CCC[C@H](c3ccnn3CC(=O)[O-])C2)c1	ZINC000426488372	513956963	/nfs/dbraw/zinc/95/69/63/513956963.db2.gz	UBALJHOQKBJGSI-INIZCTEOSA-N	-1	0	355.438	2.533	50	0		FFAARM
COc1ccccc1OCc1ccc(C(=O)N2CCC[C@H](C(=O)[O-])C2)o1	ZINC000507713488	516287292	/nfs/dbraw/zinc/28/72/92/516287292.db2.gz	KFJGPFLGTPWDMB-ZDUSSCGKSA-N	-1	0	359.378	2.804	50	0		FFAARM
CO[C@H](CS(=O)(=O)[N-]c1noc(C(C)(C)C)n1)c1ccc(F)cc1	ZINC000530155888	517598451	/nfs/dbraw/zinc/59/84/51/517598451.db2.gz	LIFOXQXATFUDMN-GFCCVEGCSA-N	-1	0	357.407	2.636	50	0		FFAARM
O=C([O-])[C@@H]1CCCN(C(=O)c2cc3cc(Br)ccc3[nH]2)C1	ZINC000299405202	534520296	/nfs/dbraw/zinc/52/02/96/534520296.db2.gz	OHCHTYQCYAEAES-SECBINFHSA-N	-1	0	351.200	2.867	50	0		FFAARM
O=C([O-])[C@H]1COCCN1C(=O)/C=C\c1ccc(Cl)c(C(F)(F)F)c1	ZINC000606441301	521068546	/nfs/dbraw/zinc/06/85/46/521068546.db2.gz	RYTLKJHCMGTIKU-DTRQGZQOSA-N	-1	0	363.719	2.684	50	0		FFAARM
Cc1oc(CN(C)C(=O)/C=C\c2ccc3c(c2)OCCO3)cc1C(=O)[O-]	ZINC000606441991	521069316	/nfs/dbraw/zinc/06/93/16/521069316.db2.gz	VSBPCCNOHNVNBQ-XQRVVYSFSA-N	-1	0	357.362	2.729	50	0		FFAARM
O=C([O-])[C@H]1COCCN1C(=O)c1ccc(Oc2ccc(F)c(F)c2)cc1	ZINC000299747488	534539742	/nfs/dbraw/zinc/53/97/42/534539742.db2.gz	DDWJTYIOFWIFJL-MRXNPFEDSA-N	-1	0	363.316	2.683	50	0		FFAARM
COc1cc(C(=O)N2CC[C@@H](C(=O)[O-])C2)cc(Cl)c1OCC(C)C	ZINC000269174684	522089291	/nfs/dbraw/zinc/08/92/91/522089291.db2.gz	JEBUUDZUWCXUOB-LLVKDONJSA-N	-1	0	355.818	2.930	50	0		FFAARM
Cc1cc(C)n(CCCC(=O)N2C[C@@H](c3cccc(F)c3)[C@H](C(=O)[O-])C2)n1	ZINC000091364820	524517758	/nfs/dbraw/zinc/51/77/58/524517758.db2.gz	VBGMICZSNAGUSO-ZWKOTPCHSA-N	-1	0	373.428	2.746	50	0		FFAARM
O=C([O-])[C@@H]1CCN(C(=O)C2(c3ccc(Br)cc3)CCC2)C1	ZINC000269167220	526278099	/nfs/dbraw/zinc/27/80/99/526278099.db2.gz	GBCVPWHARVOQKA-LLVKDONJSA-N	-1	0	352.228	2.804	50	0		FFAARM
O=C([O-])[C@H]1C[C@@H]1C(=O)NCC1(c2cccc(C(F)(F)F)c2)CCOCC1	ZINC000268921635	526333534	/nfs/dbraw/zinc/33/35/34/526333534.db2.gz	SUXJCUQIGAYGPQ-KBPBESRZSA-N	-1	0	371.355	2.591	50	0		FFAARM
O=C([O-])c1ccc(CNC(=O)C2(c3ccccc3Cl)CCOCC2)o1	ZINC000268905845	526366251	/nfs/dbraw/zinc/36/62/51/526366251.db2.gz	NQQQBMRXCDQYEQ-UHFFFAOYSA-N	-1	0	363.797	2.996	50	0		FFAARM
O=C([O-])C[C@@H]1CN(C(=O)/C=C/c2cccc(OC3CCCC3)c2)CCO1	ZINC000268942491	527629668	/nfs/dbraw/zinc/62/96/68/527629668.db2.gz	FNINPSQRHZXSBJ-GFOMBABLSA-N	-1	0	359.422	2.723	50	0		FFAARM
Cc1cc(C(=O)N2[C@H](C(=O)[O-])C[C@H]3CCCC[C@@H]32)ccc1N1CCOCC1	ZINC000647730867	568065827	/nfs/dbraw/zinc/06/58/27/568065827.db2.gz	ZMNZYPNDXHRJEM-MNEFBYGVSA-N	-1	0	372.465	2.690	50	0		FFAARM
Cc1nc(-c2ncccn2)sc1C(=O)N[C@H]1CCCCC[C@@H]1C(=O)[O-]	ZINC000120177508	570565027	/nfs/dbraw/zinc/56/50/27/570565027.db2.gz	WSDKWZWWRFFBHV-RYUDHWBXSA-N	-1	0	360.439	2.672	50	0		FFAARM
O=C(/N=c1\[n-]nc2ccccn21)[C@H]1C[C@H]1c1ccccc1Br	ZINC000084502243	571086964	/nfs/dbraw/zinc/08/69/64/571086964.db2.gz	ICTLYEVYGOEVPJ-RYUDHWBXSA-N	-1	0	357.211	2.656	50	0		FFAARM
O=C([O-])[C@]1(O)CCCN(C(=O)OCC2c3ccccc3-c3ccccc32)C1	ZINC000307618053	571117134	/nfs/dbraw/zinc/11/71/34/571117134.db2.gz	SITJORSMOALLHK-NRFANRHFSA-N	-1	0	367.401	2.847	50	0		FFAARM
C[S@@](=O)Cc1cccc(NC(=O)CC2(C(=O)[O-])Cc3ccccc3C2)c1	ZINC000169987660	571260351	/nfs/dbraw/zinc/26/03/51/571260351.db2.gz	LOWIZNONJKESGC-AREMUKBSSA-N	-1	0	371.458	2.764	50	0		FFAARM
CC(C)(C)c1ccc(OC[C@@H](O)CNC(=O)c2ccccc2C(=O)[O-])cc1	ZINC000004122027	971384056	/nfs/dbraw/zinc/38/40/56/971384056.db2.gz	SDKHNHXSAASUNH-HNNXBMFYSA-N	-1	0	371.433	2.852	50	0		FFAARM
C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)N1CC[C@H](C(=O)[O-])c2ccccc21	ZINC000669436709	984588751	/nfs/dbraw/zinc/58/87/51/984588751.db2.gz	COBKYMWYZQRLAE-YEWDVWPNSA-N	-1	0	353.374	2.820	50	0		FFAARM
Cc1cc2ncc(C(=O)N3CC[C@@H](C(=O)[O-])c4ccccc43)c(C)n2n1	ZINC000669436529	984588784	/nfs/dbraw/zinc/58/87/84/984588784.db2.gz	VDECMTVVAFHOLF-CQSZACIVSA-N	-1	0	350.378	2.565	50	0		FFAARM
COc1cc(/C=C(/C#N)C(=O)Nc2ccc(C(=O)[O-])cc2)cc(OC)c1O	ZINC000096663356	1012257257	/nfs/dbraw/zinc/25/72/57/1012257257.db2.gz	TYMUEBZUJAOSEA-QPEQYQDCSA-N	-1	0	368.345	2.653	50	0		FFAARM
C[C@H]1CCc2cc(F)cc3c([O-])c(C(=O)NCc4ccco4)c(=O)n1c23	ZINC000004326598	1012369805	/nfs/dbraw/zinc/36/98/05/1012369805.db2.gz	DJKOBSQAIJTFKF-JTQLQIEISA-N	-1	0	356.353	2.876	50	0		FFAARM
CC(C)c1cc(NC(=O)c2nn(C)cc2C(=O)[O-])n(-c2ccc(F)cc2)n1	ZINC000020616447	1022593528	/nfs/dbraw/zinc/59/35/28/1022593528.db2.gz	KZXGNLIMGNONDB-UHFFFAOYSA-N	-1	0	371.372	2.819	50	0		FFAARM
COc1ccc([C@H]2N[C@H](C(=O)[O-])Cc3c4ccccc4[nH]c32)c(OC)c1	ZINC000000754340	219317690	/nfs/dbraw/zinc/31/76/90/219317690.db2.gz	TWSTVZBEFBQGQE-FUHWJXTLSA-N	-1	0	352.390	2.873	50	0	biogenic	FFAARM
O=C([O-])[C@@H]1CC=CC[C@@H]1C(=O)Nc1ccc(C(=O)N2CCCCC2)cc1	ZINC000000794630	219321816	/nfs/dbraw/zinc/32/18/16/219321816.db2.gz	XLQUTUSBPFBIPN-DLBZAZTESA-N	-1	0	356.422	2.918	50	0		FFAARM
Cc1noc([N-]S(=O)(=O)c2ccc(NC(=O)c3ccco3)cc2)c1C	ZINC000000941890	219344479	/nfs/dbraw/zinc/34/44/79/219344479.db2.gz	FDTKITUPSIAJDR-UHFFFAOYSA-N	-1	0	361.379	2.938	50	0		FFAARM
O=C(Oc1ccc(/C=C2\NC(=O)[N-]C2=O)cc1)c1ccc(F)c(Cl)c1	ZINC000001024939	219354024	/nfs/dbraw/zinc/35/40/24/219354024.db2.gz	BPPMTMUBKAXUFF-AUWJEWJLSA-N	-1	0	360.728	2.879	50	0		FFAARM
COC(=O)c1sc(C(C)(C)C)cc1NC(=O)c1nccnc1C(=O)[O-]	ZINC000001032537	219354892	/nfs/dbraw/zinc/35/48/92/219354892.db2.gz	IEJLOGOSICZXJU-UHFFFAOYSA-N	-1	0	363.395	2.573	50	0		FFAARM
Cc1ccc(NC(=O)Cn2cc(/C=C3/NC(=O)[N-]C3=O)c3ccccc32)cc1	ZINC000001095587	219367957	/nfs/dbraw/zinc/36/79/57/219367957.db2.gz	XQIXSCBJOBOYLE-LICLKQGHSA-N	-1	0	374.400	2.769	50	0		FFAARM
CC(C)(C)NC(=O)c1cccc(N2C(=O)c3ccc(C(=O)[O-])cc3C2=O)c1	ZINC000001211337	219390095	/nfs/dbraw/zinc/39/00/95/219390095.db2.gz	NXMMGKCWIKUXOJ-UHFFFAOYSA-N	-1	0	366.373	2.714	50	0		FFAARM
O=C([O-])CC[C@H]1CCCCN1C(=O)CCCc1ccc2c(c1)CC(=O)N2	ZINC000237981180	222912616	/nfs/dbraw/zinc/91/26/16/222912616.db2.gz	FIJLHERVCKFIJH-MRXNPFEDSA-N	-1	0	358.438	2.750	50	0		FFAARM
CC(C)Cc1ccc(CCC(=O)[N-]S(=O)(=O)c2ncccc2F)cc1	ZINC000240900746	222918222	/nfs/dbraw/zinc/91/82/22/222918222.db2.gz	ITODTADVKVUPMW-UHFFFAOYSA-N	-1	0	364.442	2.857	50	0		FFAARM
COc1ccc(C)cc1S(=O)(=O)NC[C@@H](CC(=O)[O-])c1ccccc1	ZINC000003623215	219523053	/nfs/dbraw/zinc/52/30/53/219523053.db2.gz	OVFBGQVMIPVPID-OAHLLOKOSA-N	-1	0	363.435	2.540	50	0		FFAARM
Cc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccccc4F)c=3c2=O)cc1C	ZINC000006770830	219767908	/nfs/dbraw/zinc/76/79/08/219767908.db2.gz	NHOKGYZPFLDVRX-DLBZAZTESA-N	-1	0	352.369	2.936	50	0		FFAARM
CC1=C(C)C[C@@H](C(=O)N2CCN(CCc3ccccc3)CC2)[C@H](C(=O)[O-])C1	ZINC000006731454	219763603	/nfs/dbraw/zinc/76/36/03/219763603.db2.gz	YVSBYFWGAAAUSZ-WOJBJXKFSA-N	-1	0	370.493	2.821	50	0		FFAARM
Cc1nc(-c2ccc(C)cc2C)sc1C(=O)N1CCOC[C@@H]1C(=O)[O-]	ZINC000299747294	223079167	/nfs/dbraw/zinc/07/91/67/223079167.db2.gz	CLTBMAZVNZEJST-CQSZACIVSA-N	-1	0	360.435	2.661	50	0		FFAARM
O=C([O-])[C@@H]1Cc2ccccc2CN1C(=O)c1coc(Br)c1	ZINC000299745979	223079842	/nfs/dbraw/zinc/07/98/42/223079842.db2.gz	UKWJTGLEUOATAO-LBPRGKRZSA-N	-1	0	350.168	2.694	50	0		FFAARM
COc1ccc(C(=O)N2CCO[C@@H](CC(=O)[O-])C2)cc1-c1ccccc1	ZINC000299753080	223080073	/nfs/dbraw/zinc/08/00/73/223080073.db2.gz	WSXAADKVFXLYMJ-INIZCTEOSA-N	-1	0	355.390	2.678	50	0		FFAARM
O=C([O-])c1ccc(CCC(=O)N2CCC(OC3CCOCC3)CC2)cc1	ZINC000299749128	223080534	/nfs/dbraw/zinc/08/05/34/223080534.db2.gz	JJROIRVDPNRKCU-UHFFFAOYSA-N	-1	0	361.438	2.504	50	0		FFAARM
CCCSc1nc(=NC(=O)CN2CCC[C@H](C(F)(F)F)C2)s[n-]1	ZINC000008718478	219867654	/nfs/dbraw/zinc/86/76/54/219867654.db2.gz	RAXAICUHECXTEO-VIFPVBQESA-N	-1	0	368.450	2.675	50	0		FFAARM
O=C([O-])c1cnn(-c2nccc(-c3ccc4c(c3)OCO4)n2)c1C1CC1	ZINC000299794982	223100374	/nfs/dbraw/zinc/10/03/74/223100374.db2.gz	LDSUNRIMQGNYDQ-UHFFFAOYSA-N	-1	0	350.334	2.634	50	0		FFAARM
O=C(NC1CC1)c1cccc([N-]S(=O)(=O)c2cc(F)cc(F)c2)c1	ZINC000012541958	220005117	/nfs/dbraw/zinc/00/51/17/220005117.db2.gz	AHLRZJOSENYWEE-UHFFFAOYSA-N	-1	0	352.362	2.658	50	0		FFAARM
COC(=O)c1cccc(S(=O)(=O)[N-]c2cnc(-c3ccccc3)nc2)c1	ZINC000012740236	220023784	/nfs/dbraw/zinc/02/37/84/220023784.db2.gz	CXLFXUULXQKFHM-UHFFFAOYSA-N	-1	0	369.402	2.731	50	0		FFAARM
CCc1ccc(OCC(=O)N(C)Cc2nc(=O)c3sccc3[n-]2)cc1	ZINC000012752868	220024409	/nfs/dbraw/zinc/02/44/09/220024409.db2.gz	QWXKZCRAPINDOU-UHFFFAOYSA-N	-1	0	357.435	2.584	50	0		FFAARM
CN(Cc1cn(-c2ccccc2)nc1-c1ccco1)C(=O)/C=C/C(=O)[O-]	ZINC000013115498	220057308	/nfs/dbraw/zinc/05/73/08/220057308.db2.gz	JIJZUACJWYQFCU-MDZDMXLPSA-N	-1	0	351.362	2.732	50	0		FFAARM
CCCNc1nnc(SCC(=O)Nc2cc(F)ccc2C(=O)[O-])s1	ZINC000013273418	220062953	/nfs/dbraw/zinc/06/29/53/220062953.db2.gz	OOOUUEJZLPGEOG-UHFFFAOYSA-N	-1	0	370.431	2.928	50	0		FFAARM
COc1cc2c(cc1OC)[C@@H](CC(=O)[O-])N(C(=O)c1ccc(C)o1)CC2	ZINC000013182816	220061575	/nfs/dbraw/zinc/06/15/75/220061575.db2.gz	NJLSYSSXBZSZRO-CQSZACIVSA-N	-1	0	359.378	2.820	50	0		FFAARM
CN(C)C(=O)Cc1ccc([N-]S(=O)(=O)c2ccc(Cl)s2)cc1	ZINC000013849480	220098590	/nfs/dbraw/zinc/09/85/90/220098590.db2.gz	INSUAIMFHHMBAR-UHFFFAOYSA-N	-1	0	358.872	2.833	50	0		FFAARM
O=C([O-])c1cc(Br)cc2[nH]nc(I)c21	ZINC000014983949	220138140	/nfs/dbraw/zinc/13/81/40/220138140.db2.gz	FBUJAALZKMKCAH-UHFFFAOYSA-N	-1	0	366.940	2.628	50	0		FFAARM
O=C([O-])[C@H]1CC=CC[C@H]1C(=O)Nc1sccc1C(=O)NCc1ccco1	ZINC000017076583	220205836	/nfs/dbraw/zinc/20/58/36/220205836.db2.gz	RHNLMMNMLNXGEK-OLZOCXBDSA-N	-1	0	374.418	2.877	50	0		FFAARM
O=C(CSc1nc([O-])cc(=O)[nH]1)N(c1ccccc1)c1ccccc1	ZINC000018042568	220221244	/nfs/dbraw/zinc/22/12/44/220221244.db2.gz	JYVALTAMHSZGRR-UHFFFAOYSA-N	-1	0	353.403	2.933	50	0		FFAARM
O=C([O-])[C@H]1Cc2ccccc2CN1C(=O)c1ccc(Br)o1	ZINC000020082169	220312267	/nfs/dbraw/zinc/31/22/67/220312267.db2.gz	BBSWJIHVUGIOOG-LLVKDONJSA-N	-1	0	350.168	2.694	50	0		FFAARM
Cc1nn(-c2ccc(NC(=O)c3c(C(=O)[O-])cnn3C)cc2)c(C)c1Cl	ZINC000020615245	220336702	/nfs/dbraw/zinc/33/67/02/220336702.db2.gz	ZHEUXUCMYHPAEO-UHFFFAOYSA-N	-1	0	373.800	2.827	50	0		FFAARM
[O-]c1nnn(-c2ccccc2)c1CN1CCO[C@@H](c2ccc(F)cc2)C1	ZINC000057086078	221084024	/nfs/dbraw/zinc/08/40/24/221084024.db2.gz	FSDGHRAZIDGUFS-GOSISDBHSA-N	-1	0	354.385	2.686	50	0		FFAARM
O=C([O-])c1cc(S(=O)(=O)Nc2cccc(Cl)c2)cc2c1OCCO2	ZINC000057115609	221084046	/nfs/dbraw/zinc/08/40/46/221084046.db2.gz	BNRNPNUPVHVRBX-UHFFFAOYSA-N	-1	0	369.782	2.610	50	0		FFAARM
Cc1ccc(F)cc1NS(=O)(=O)c1ccc(OCC(=O)[O-])c(C)c1	ZINC000058368371	221115647	/nfs/dbraw/zinc/11/56/47/221115647.db2.gz	PCMUJFGIHHETBD-UHFFFAOYSA-N	-1	0	353.371	2.707	50	0		FFAARM
C[C@]1(C(=O)[O-])CCN(C(=O)C2(c3ccc(Br)cc3)CC2)C1	ZINC000062913483	221140318	/nfs/dbraw/zinc/14/03/18/221140318.db2.gz	ZBHIXIDRABQUPM-HNNXBMFYSA-N	-1	0	352.228	2.804	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)c1cccc(NC(=O)C2CCCC2)c1)C(F)(F)F	ZINC000065422622	221216888	/nfs/dbraw/zinc/21/68/88/221216888.db2.gz	BCBHZKXFUZZGDA-ZDUSSCGKSA-N	-1	0	372.343	2.951	50	0		FFAARM
O=C([O-])c1cccnc1CN1CCC[C@H]1c1nc(-c2ccncc2)no1	ZINC000065425747	221217185	/nfs/dbraw/zinc/21/71/85/221217185.db2.gz	ZUPWMPKQNVIJKY-HNNXBMFYSA-N	-1	0	351.366	2.562	50	0		FFAARM
C[C@@H](c1nnc(SCC(=O)[O-])n1-c1cccc(Cl)c1)n1ccnc1	ZINC000067840181	221292193	/nfs/dbraw/zinc/29/21/93/221292193.db2.gz	VKVWHHPCEFZXKC-JTQLQIEISA-N	-1	0	363.830	2.903	50	0		FFAARM
COc1ccc(NC(=O)c2ccco2)cc1NC(=O)[C@@H]1[C@@H](C(=O)[O-])C1(C)C	ZINC000071280254	221337576	/nfs/dbraw/zinc/33/75/76/221337576.db2.gz	GAPPSYFMDMHCDV-GJZGRUSLSA-N	-1	0	372.377	2.836	50	0		FFAARM
CC1(C)[C@H](C(=O)Nc2nc(-c3nc4ccccc4[nH]3)cs2)[C@@H]1C(=O)[O-]	ZINC000071282986	221338195	/nfs/dbraw/zinc/33/81/95/221338195.db2.gz	HKTAXUCDVCQXCX-NWDGAFQWSA-N	-1	0	356.407	2.982	50	0		FFAARM
CC(C)NC(=O)c1ccc(NC(=O)[C@H]2[C@@H](C(=O)[O-])C2(C)C)cc1Cl	ZINC000071286201	221340136	/nfs/dbraw/zinc/34/01/36/221340136.db2.gz	JHUGOOTYSSAQHB-OLZOCXBDSA-N	-1	0	352.818	2.774	50	0		FFAARM
CNC(=O)c1ccc(OC)c(NC(=O)CC2(C(=O)[O-])CCCCCC2)c1	ZINC000071817306	221379988	/nfs/dbraw/zinc/37/99/88/221379988.db2.gz	WAHQEJJWWFZXRF-UHFFFAOYSA-N	-1	0	362.426	2.809	50	0		FFAARM
COc1ccc(CN(C)c2nccc(-c3cc(C(=O)[O-])ccn3)n2)cc1	ZINC000071763757	221371969	/nfs/dbraw/zinc/37/19/69/221371969.db2.gz	YNTBSCOVIWXPMD-UHFFFAOYSA-N	-1	0	350.378	2.882	50	0		FFAARM
C[C@@]([N-]S(=O)(=O)c1cnc2n1CCC2)(c1ccccc1)C(F)(F)F	ZINC000328614149	258116381	/nfs/dbraw/zinc/11/63/81/258116381.db2.gz	QWXCCGGDRZZRET-CQSZACIVSA-N	-1	0	359.373	2.585	50	0		FFAARM
O=C([O-])c1nc(N2CCC(CCN3CCCC3=O)CC2)ccc1Cl	ZINC000096161487	132221556	/nfs/dbraw/zinc/22/15/56/132221556.db2.gz	WNHKZFAOAIEBEL-UHFFFAOYSA-N	-1	0	351.834	2.662	50	0		FFAARM
Cc1nn(CC(=O)N2CCC[C@H](c3ccc(C(=O)[O-])cc3)C2)c(C)c1C	ZINC000095360301	221860106	/nfs/dbraw/zinc/86/01/06/221860106.db2.gz	OAXLTBHNBSBSCM-SFHVURJKSA-N	-1	0	355.438	2.913	50	0		FFAARM
CC(C)Oc1cccc([C@@H](C(=O)[O-])N2CCN(Cc3ccccn3)CC2)c1	ZINC000095371823	221874764	/nfs/dbraw/zinc/87/47/64/221874764.db2.gz	VHXJAUFBYCXIBE-FQEVSTJZSA-N	-1	0	369.465	2.812	50	0		FFAARM
Cc1ccc(NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1C(=O)[O-]	ZINC000096113658	222031084	/nfs/dbraw/zinc/03/10/84/222031084.db2.gz	IMJPFAVDWLRBKV-KGLIPLIRSA-N	-1	0	367.405	2.506	50	0	biogenic	FFAARM
COc1ccc(/C=C\C(=O)[O-])cc1S(=O)(=O)Nc1ccc(F)cc1F	ZINC000096747822	222129285	/nfs/dbraw/zinc/12/92/85/222129285.db2.gz	IQJYLXPXPYNRKQ-CLTKARDFSA-N	-1	0	369.345	2.872	50	0		FFAARM
CC(C)(c1ccccc1)c1ccc(OCCNC(=O)COCC(=O)[O-])cc1	ZINC000004694633	263336341	/nfs/dbraw/zinc/33/63/41/263336341.db2.gz	PNVUKCHTLCHMHY-UHFFFAOYSA-N	-1	0	371.433	2.609	50	0		FFAARM
CN(C(=O)CSc1nnc(-c2ccccc2)c(=O)[n-]1)c1ccccc1	ZINC000005625560	263342167	/nfs/dbraw/zinc/34/21/67/263342167.db2.gz	NQUGBYITVLDYTA-UHFFFAOYSA-N	-1	0	352.419	2.587	50	0		FFAARM
O=C([O-])CCCc1nnc(-c2ccccc2I)o1	ZINC000037729329	506430498	/nfs/dbraw/zinc/43/04/98/506430498.db2.gz	NQIJYLVZUJNRCI-UHFFFAOYSA-N	-1	0	358.135	2.749	50	0		FFAARM
CCOc1ccc(NC(=O)c2sc3[nH]c(=O)c(C(=O)[O-])cc3c2N)cc1	ZINC000002694785	506288137	/nfs/dbraw/zinc/28/81/37/506288137.db2.gz	ROFXZOZJFBEOMF-UHFFFAOYSA-N	-1	0	373.390	2.521	50	0		FFAARM
CC(=O)Nc1cccc(NS(=O)(=O)c2cc(C(=O)[O-])ccc2C)c1C	ZINC000032754983	506289841	/nfs/dbraw/zinc/28/98/41/506289841.db2.gz	PRPAJCCAHKMNPQ-UHFFFAOYSA-N	-1	0	362.407	2.761	50	0		FFAARM
CC1=C(C)C[C@H](C(=O)Nc2sc3c(c2C(N)=O)CCC3)[C@H](C(=O)[O-])C1	ZINC000002821381	506296726	/nfs/dbraw/zinc/29/67/26/506296726.db2.gz	ZSIOQPWHGGVIDW-NWDGAFQWSA-N	-1	0	362.451	2.721	50	0		FFAARM
C[C@@H](c1ccccc1)N1C(=O)C[C@H](Sc2ncccc2C(=O)[O-])C1=O	ZINC000002879552	506299637	/nfs/dbraw/zinc/29/96/37/506299637.db2.gz	OZFMZIOAGPZXNE-FZMZJTMJSA-N	-1	0	356.403	2.761	50	0		FFAARM
O=C(CCCn1c(=O)c2sccc2[n-]c1=S)Nc1nccs1	ZINC000002925438	506302186	/nfs/dbraw/zinc/30/21/86/506302186.db2.gz	UTPRRSLFMRMIKO-UHFFFAOYSA-N	-1	0	352.466	2.996	50	0		FFAARM
COc1ccccc1-n1cnnc1SCc1nc(=O)c2sccc2[n-]1	ZINC000003302280	506320427	/nfs/dbraw/zinc/32/04/27/506320427.db2.gz	IBNLFDSLXGNSCI-UHFFFAOYSA-N	-1	0	371.447	2.866	50	0		FFAARM
O=C([O-])[C@H]1CCCC[C@H]1C(=O)N1CCN(c2ccc(Cl)cc2)CC1	ZINC000003684650	506349850	/nfs/dbraw/zinc/34/98/50/506349850.db2.gz	PRUPQCIQHAZBHA-CVEARBPZSA-N	-1	0	350.846	2.880	50	0		FFAARM
O=C([O-])[C@H]1CC=CC[C@@H]1C(=O)N1CCN(C/C=C/c2ccccc2)CC1	ZINC000004179532	506363794	/nfs/dbraw/zinc/36/37/94/506363794.db2.gz	JLTLXEFNRIBPCX-BDJRERGKSA-N	-1	0	354.450	2.511	50	0		FFAARM
COc1cccc(-c2nnc(CCC(=O)NCc3ccccc3)c(=O)[n-]2)c1	ZINC000034764585	506369944	/nfs/dbraw/zinc/36/99/44/506369944.db2.gz	OIFZAWWLJJSJFB-UHFFFAOYSA-N	-1	0	364.405	2.502	50	0		FFAARM
O=C(CCc1nnc(-c2ccc(Cl)cc2)[n-]c1=O)NCc1ccccn1	ZINC000034768116	506371062	/nfs/dbraw/zinc/37/10/62/506371062.db2.gz	PGZDEGZCGXQHHJ-UHFFFAOYSA-N	-1	0	369.812	2.542	50	0		FFAARM
O=C([O-])CCc1ccc(S(=O)(=O)Nc2ccc(F)c(F)c2F)cc1	ZINC000034887436	506372002	/nfs/dbraw/zinc/37/20/02/506372002.db2.gz	UDCNIQRLIRBKIY-UHFFFAOYSA-N	-1	0	359.325	2.922	50	0		FFAARM
COc1ccc(-n2c(=O)c3[n-][nH]n(Cc4cc(C)ccc4C)c=3c2=O)cc1	ZINC000004483540	506377519	/nfs/dbraw/zinc/37/75/19/506377519.db2.gz	NCBVPFXHKRDSBD-MSOLQXFVSA-N	-1	0	364.405	2.805	50	0		FFAARM
COc1ccccc1C[C@@H](C(=O)Nc1cc(C)cc(C)c1)c1nnn[n-]1	ZINC000004673217	506386591	/nfs/dbraw/zinc/38/65/91/506386591.db2.gz	NFQDZWHKNLKWIU-MRXNPFEDSA-N	-1	0	351.410	2.790	50	0		FFAARM
O=C([O-])[C@H]1CC=CC[C@@H]1C(=O)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000006726759	506500172	/nfs/dbraw/zinc/50/01/72/506500172.db2.gz	CMRMAQFDMFBWPC-IRXDYDNUSA-N	-1	0	362.857	2.651	50	0		FFAARM
O=C([O-])[C@H]1C2CCC(CC2)[C@@H]1C(=O)N1CCN(Cc2ccc(F)cc2)CC1	ZINC000006727044	506500513	/nfs/dbraw/zinc/50/05/13/506500513.db2.gz	BEYAEIJMMUGRIU-VHZYLWGESA-N	-1	0	374.456	2.607	50	0		FFAARM
Cc1c2c(nn1-c1ccccc1)c(N1CCC[C@@H](C(=O)[O-])C1)nnc2C	ZINC000006751583	506504428	/nfs/dbraw/zinc/50/44/28/506504428.db2.gz	FSQMUSFZAPJBLX-CQSZACIVSA-N	-1	0	351.410	2.733	50	0		FFAARM
O=C([O-])c1cc(S(=O)(=O)N2CC=C(c3ccccc3)CC2)ccc1O	ZINC000006848544	506512437	/nfs/dbraw/zinc/51/24/37/506512437.db2.gz	RWDZQCJLWRRYBJ-UHFFFAOYSA-N	-1	0	359.403	2.568	50	0		FFAARM
O=c1ccc(-c2ccc(S(=O)(=O)[N-]c3ccc(Cl)cc3F)o2)n[nH]1	ZINC000006974039	506521664	/nfs/dbraw/zinc/52/16/64/506521664.db2.gz	OBRSKXXZXSWRRE-UHFFFAOYSA-N	-1	0	369.761	2.623	50	0		FFAARM
Cc1ccc([N-]S(=O)(=O)c2ccc(-c3ccc(=O)[nH]n3)o2)c(Cl)c1	ZINC000006973984	506522119	/nfs/dbraw/zinc/52/21/19/506522119.db2.gz	TXSGCAZUTFNIEO-UHFFFAOYSA-N	-1	0	365.798	2.793	50	0		FFAARM
COc1ccc(NC(C)=O)cc1[N-]S(=O)(=O)c1cccc(C(C)=O)c1	ZINC000007051199	506528616	/nfs/dbraw/zinc/52/86/16/506528616.db2.gz	WAWGUFCDLRAOTE-UHFFFAOYSA-N	-1	0	362.407	2.657	50	0		FFAARM
COc1ccc([N-]S(=O)(=O)c2ccc3c(c2)OCCCO3)c(OC)c1	ZINC000007057316	506531131	/nfs/dbraw/zinc/53/11/31/506531131.db2.gz	OIDWPMFROJWGOC-UHFFFAOYSA-N	-1	0	365.407	2.666	50	0		FFAARM
O=C(/C=C/c1cc2c(c(Cl)c1)OCO2)[N-]S(=O)(=O)c1cccs1	ZINC000042243169	506612481	/nfs/dbraw/zinc/61/24/81/506612481.db2.gz	RLDPWKQKVWTTBG-ONEGZZNKSA-N	-1	0	371.823	2.649	50	0		FFAARM
CC(C)=C[C@H]1[C@H](C(=O)[N-]S(=O)(=O)c2ccc3c(c2)OCCO3)C1(C)C	ZINC000042267856	506613415	/nfs/dbraw/zinc/61/34/15/506613415.db2.gz	ZVTAAJWGRPQSJT-XJKSGUPXSA-N	-1	0	365.451	2.501	50	0		FFAARM
CS(=O)(=O)c1cc(C(=O)c2ccccc2[O-])cn2c3ccccc3nc12	ZINC000008941469	506673552	/nfs/dbraw/zinc/67/35/52/506673552.db2.gz	GFJHYTITUBRMKP-UHFFFAOYSA-N	-1	0	366.398	2.828	50	0		FFAARM
CN1c2cc([N-]S(=O)(=O)c3cccs3)ccc2OCC(C)(C)C1=O	ZINC000009169776	506686283	/nfs/dbraw/zinc/68/62/83/506686283.db2.gz	VQTVKZCIFUHVJG-UHFFFAOYSA-N	-1	0	366.464	2.930	50	0		FFAARM
CC[C@@H](C)C1C(=O)N=C(SCC(=O)Nc2ccccc2OC)N=C1[O-]	ZINC000009310870	506689511	/nfs/dbraw/zinc/68/95/11/506689511.db2.gz	QVUNEIQCRABDCI-SNVBAGLBSA-N	-1	0	363.439	2.728	50	0		FFAARM
O=C([O-])[C@@H](Cc1cc(=O)[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000009330880	506691323	/nfs/dbraw/zinc/69/13/23/506691323.db2.gz	ALLWOAVDORUJLA-MRXNPFEDSA-N	-1	0	370.792	2.607	50	0	world	FFAARM
CC(=O)c1ccccc1[N-]S(=O)(=O)c1ccc2c(c1)C[C@@H](C)N2C(C)=O	ZINC000009338404	506691620	/nfs/dbraw/zinc/69/16/20/506691620.db2.gz	FHZYKVURSGEFCJ-GFCCVEGCSA-N	-1	0	372.446	2.988	50	0		FFAARM
CCC1C(=O)N=C(S[C@H](C)C(=O)Nc2cccc(Cl)c2)N=C1[O-]	ZINC000010059011	506724978	/nfs/dbraw/zinc/72/49/78/506724978.db2.gz	KXZBSEOXKDHADM-MRVPVSSYSA-N	-1	0	353.831	2.811	50	0		FFAARM
O=C([O-])CCC(=O)N1N=C(c2ccc[nH]2)C[C@@H]1c1ccc2nccnc2c1	ZINC000012390115	506858505	/nfs/dbraw/zinc/85/85/05/506858505.db2.gz	GGZKPQUEIREBDT-QGZVFWFLSA-N	-1	0	363.377	2.500	50	0		FFAARM
O=C([O-])[C@H]1CN(C(=O)c2ccc(Br)o2)c2ccccc2O1	ZINC000013435072	506940653	/nfs/dbraw/zinc/94/06/53/506940653.db2.gz	LURZDNWKUNPQNL-LLVKDONJSA-N	-1	0	352.140	2.535	50	0		FFAARM
CCOc1ccc(-n2c(SCC(=O)[O-])nnc2-c2ccncc2)cc1	ZINC000028402193	507723776	/nfs/dbraw/zinc/72/37/76/507723776.db2.gz	MQRILHUFQAOUSP-UHFFFAOYSA-N	-1	0	356.407	2.905	50	0		FFAARM
COC(=O)c1[n-]c(=NC(=O)c2ccccn2)sc1Cc1ccccc1	ZINC000072402121	507782970	/nfs/dbraw/zinc/78/29/70/507782970.db2.gz	DTAVCRYIPJJFOV-UHFFFAOYSA-N	-1	0	353.403	3.168	50	0		FFAARM
Cc1cc2cccc(C(=O)N3CCC(C(=O)[O-])(n4cccn4)CC3)c2o1	ZINC000072420985	507787208	/nfs/dbraw/zinc/78/72/08/507787208.db2.gz	TUDTXVVCXNWPHU-UHFFFAOYSA-N	-1	0	353.378	2.654	50	0		FFAARM
Cc1ncccc1OC1(C(=O)[O-])CCN(C(=O)c2cccc(F)c2)CC1	ZINC000072430179	507789626	/nfs/dbraw/zinc/78/96/26/507789626.db2.gz	VAHGOPBIDAFYBI-UHFFFAOYSA-N	-1	0	358.369	2.668	50	0		FFAARM
Cc1cc(C(=O)N2CCC(Oc3ccc(C)nc3)(C(=O)[O-])CC2)c(C)o1	ZINC000072467803	507794410	/nfs/dbraw/zinc/79/44/10/507794410.db2.gz	NROJGNJNDQASSS-UHFFFAOYSA-N	-1	0	358.394	2.738	50	0		FFAARM
O=C(CCc1cc(=O)[n-]o1)N1CC[C@@](O)(c2ccccc2)[C@H]2CCCC[C@@H]21	ZINC000072475147	507795458	/nfs/dbraw/zinc/79/54/58/507795458.db2.gz	BEPZDQJYKQBORU-BBTUJRGHSA-N	-1	0	370.449	2.992	50	0		FFAARM
O=C([O-])C1(n2cccn2)CCN(C(=O)c2cc3ccccc3s2)CC1	ZINC000072480244	507797463	/nfs/dbraw/zinc/79/74/63/507797463.db2.gz	LTRVGPWTGHMRRK-UHFFFAOYSA-N	-1	0	355.419	2.814	50	0		FFAARM
COc1ccc(Oc2ccc(S(=O)(=O)[N-]c3noc(C)n3)cc2)cc1	ZINC000089718476	507859215	/nfs/dbraw/zinc/85/92/15/507859215.db2.gz	GAZNWPQIEUMXRX-UHFFFAOYSA-N	-1	0	361.379	2.980	50	0		FFAARM
O=C([O-])[C@H]1CCCN(C(=O)C2(c3ccccc3Cl)CCOCC2)C1	ZINC000109621856	507972556	/nfs/dbraw/zinc/97/25/56/507972556.db2.gz	QYJUCSBIXPMZOK-ZDUSSCGKSA-N	-1	0	351.830	2.711	50	0		FFAARM
O=C([O-])c1ccc(S(=O)(=O)Nc2c(F)cccc2-n2cccn2)cc1	ZINC000075606917	508120988	/nfs/dbraw/zinc/12/09/88/508120988.db2.gz	WZJUPYXCXFSDBQ-UHFFFAOYSA-N	-1	0	361.354	2.510	50	0		FFAARM
CCOc1cc(F)cc([C@H](C(=O)[O-])N2CCN(Cc3cccnc3)CC2)c1	ZINC000095372313	508179288	/nfs/dbraw/zinc/17/92/88/508179288.db2.gz	MIMCGLCLXABNHL-LJQANCHMSA-N	-1	0	373.428	2.563	50	0		FFAARM
C[C@H](c1ccc(S(C)(=O)=O)cc1)n1cc(-c2ccc(C(=O)[O-])cc2)nn1	ZINC000095377900	508180468	/nfs/dbraw/zinc/18/04/68/508180468.db2.gz	BMMYWYKXWZKCRH-GFCCVEGCSA-N	-1	0	371.418	2.656	50	0		FFAARM
Cn1ccnc1CN1CCN([C@@H](C(=O)[O-])c2csc3ccccc32)CC1	ZINC000095384515	508182232	/nfs/dbraw/zinc/18/22/32/508182232.db2.gz	POWHZMJLIYEMHK-GOSISDBHSA-N	-1	0	370.478	2.578	50	0		FFAARM
CCC[C@@H](NC(=O)CSCc1nc2ccccc2s1)c1nnn[n-]1	ZINC000095411830	508184332	/nfs/dbraw/zinc/18/43/32/508184332.db2.gz	ZBOZFWRQTLPQKH-LLVKDONJSA-N	-1	0	362.484	2.700	50	0		FFAARM
COc1ccc(CCC(=O)NCc2ccccc2OCC(=O)[O-])cc1F	ZINC000095425347	508185241	/nfs/dbraw/zinc/18/52/41/508185241.db2.gz	JCOWYXHDLINEFQ-UHFFFAOYSA-N	-1	0	361.369	2.547	50	0		FFAARM
COC(=O)c1[n-]c(=NC(=O)Cc2c(C)noc2C)sc1-c1ccccc1	ZINC000095472992	508188123	/nfs/dbraw/zinc/18/81/23/508188123.db2.gz	QYRYXRBZMWBSLM-UHFFFAOYSA-N	-1	0	371.418	3.383	50	0		FFAARM
O=C([O-])[C@@H]1[C@@H]2C=C[C@@]3(CN(c4ccc(C(F)(F)F)cc4Cl)C(=O)[C@@H]13)O2	ZINC000095495821	508188827	/nfs/dbraw/zinc/18/88/27/508188827.db2.gz	QLXZJAHCWHTALL-YFCNSXCBSA-N	-1	0	373.714	2.730	50	0		FFAARM
O=C(Nc1nc[nH]n1)c1nn(-c2c(Cl)cc(Cl)cc2Cl)cc1[O-]	ZINC000095964482	508199893	/nfs/dbraw/zinc/19/98/93/508199893.db2.gz	OSXGIDQYXSMOKT-UHFFFAOYSA-N	-1	0	373.587	2.909	50	0		FFAARM
Cn1ccnc1[C@@H](Nc1nccc(-c2cc(C(=O)[O-])ccn2)n1)C1CC1	ZINC000077375600	508307014	/nfs/dbraw/zinc/30/70/14/508307014.db2.gz	PLKBSVYWDBBELS-HNNXBMFYSA-N	-1	0	350.382	2.534	50	0		FFAARM
CCOc1ccc(-c2ccnc(NCc3nccn3C)n2)cc1C(=O)[O-]	ZINC000077471033	508320681	/nfs/dbraw/zinc/32/06/81/508320681.db2.gz	PUOVQAALAZIALI-UHFFFAOYSA-N	-1	0	353.382	2.586	50	0		FFAARM
CC(C)C(=O)Nc1ccc(Cl)c(C(=O)N2CCC[C@H](C(=O)[O-])C2)c1	ZINC000136128674	508672454	/nfs/dbraw/zinc/67/24/54/508672454.db2.gz	KUPOLNRWQDQLLG-NSHDSACASA-N	-1	0	352.818	2.871	50	0		FFAARM
CC(C)C(=O)Nc1ccc(Cl)c(C(=O)N2CCC[C@@H](C(=O)[O-])C2)c1	ZINC000136128712	508672552	/nfs/dbraw/zinc/67/25/52/508672552.db2.gz	KUPOLNRWQDQLLG-LLVKDONJSA-N	-1	0	352.818	2.871	50	0		FFAARM
Cc1nc(C(=O)N2CCC[C@@H](C(=O)[O-])C2)nn1-c1ccccc1C(C)C	ZINC000136129332	508672804	/nfs/dbraw/zinc/67/28/04/508672804.db2.gz	WWPDKAPRXOBGEK-CQSZACIVSA-N	-1	0	356.426	2.636	50	0		FFAARM
O=C([O-])CC[C@H](NC(=O)[C@@H]1CC(=O)Nc2cc(F)ccc21)c1ccccc1	ZINC000139244638	508785949	/nfs/dbraw/zinc/78/59/49/508785949.db2.gz	FTAHKNJFWRCLTG-CVEARBPZSA-N	-1	0	370.380	2.974	50	0		FFAARM
O=C(N[C@@H]1CCN(C2CCCCC2)C1=O)c1ccc2[n-]c(=S)oc2c1	ZINC000151200071	508977189	/nfs/dbraw/zinc/97/71/89/508977189.db2.gz	GGDXNPSMXBYIMR-CQSZACIVSA-N	-1	0	359.451	2.780	50	0		FFAARM
Cc1nc(COc2ccccc2/C=C\C(=O)NC2(C(=O)[O-])CC2)cs1	ZINC000222164539	509312113	/nfs/dbraw/zinc/31/21/13/509312113.db2.gz	XRAJFIGMOZIXTA-SREVYHEPSA-N	-1	0	358.419	2.777	50	0		FFAARM
CC(C)[S@@](=O)c1ccc(C(=O)N2CCC[C@H](CCC(=O)[O-])C2)cc1	ZINC000236696500	509483556	/nfs/dbraw/zinc/48/35/56/509483556.db2.gz	LBCDLKXXRPZFQB-JBEBIEQOSA-N	-1	0	351.468	2.920	50	0		FFAARM
CC(C)c1cc(C(=O)N(CCC(=O)[O-])C[C@H]2CCCO2)nn1C(C)(C)C	ZINC000236881556	509523776	/nfs/dbraw/zinc/52/37/76/509523776.db2.gz	ORYCTYLHCINCMT-CQSZACIVSA-N	-1	0	365.474	2.857	50	0		FFAARM
COc1ccc(-c2n[nH]cc2C(=O)N2CCC[C@@H](CCC(=O)[O-])C2)cc1	ZINC000237387157	509637171	/nfs/dbraw/zinc/63/71/71/509637171.db2.gz	DBXLDNIFIQLFQT-ZDUSSCGKSA-N	-1	0	357.410	2.802	50	0		FFAARM
Cc1c(C(=O)N(C[C@H](C)C(=O)[O-])C2CC2)nnn1-c1ccccc1Cl	ZINC000170067874	509666862	/nfs/dbraw/zinc/66/68/62/509666862.db2.gz	OBVFIEOKUPNTDT-JTQLQIEISA-N	-1	0	362.817	2.554	50	0		FFAARM
CCCCC[C@H](NC(=O)[C@@H]1CCCN(C(=O)c2ccccc2)C1)C(=O)[O-]	ZINC000170592110	509674503	/nfs/dbraw/zinc/67/45/03/509674503.db2.gz	QOZOFHGPWOJWST-SJORKVTESA-N	-1	0	360.454	2.689	50	0		FFAARM
Cc1nc(-c2ccc(C)cc2)c(CC(=O)N2CCO[C@@H](CC(=O)[O-])C2)s1	ZINC000237689656	509712367	/nfs/dbraw/zinc/71/23/67/509712367.db2.gz	DRLXHTVDJCOOAP-HNNXBMFYSA-N	-1	0	374.462	2.672	50	0		FFAARM
Cc1nc2ccccc2c(C)c1CC(=O)N(CCC(=O)[O-])C[C@@H]1CCCO1	ZINC000237751323	509727594	/nfs/dbraw/zinc/72/75/94/509727594.db2.gz	MEDFDUCSNGNWPZ-INIZCTEOSA-N	-1	0	370.449	2.876	50	0		FFAARM
O=C([O-])[C@H]1CN(C(=O)/C=C(/c2ccc(Cl)cc2)C(F)(F)F)CCO1	ZINC000237966268	509787728	/nfs/dbraw/zinc/78/77/28/509787728.db2.gz	NLJJQJZENVJRRS-SEVUFMINSA-N	-1	0	363.719	2.598	50	0		FFAARM
O=C([O-])[C@H]1CCCN(C(=O)CCCc2nc(-c3ccc(F)cc3)no2)C1	ZINC000238068465	509813349	/nfs/dbraw/zinc/81/33/49/509813349.db2.gz	XXPLZHUBNSJJDT-ZDUSSCGKSA-N	-1	0	361.373	2.522	50	0		FFAARM
O=C([O-])[C@H]1CCCN1Cc1nc(-c2ccc(Br)s2)no1	ZINC000238102484	509821646	/nfs/dbraw/zinc/82/16/46/509821646.db2.gz	FYEYYLPVJZHLAK-SSDOTTSWSA-N	-1	0	358.217	2.610	50	0		FFAARM
O=C([O-])[C@@H](CNC(=O)c1cc(-c2ccc(F)cc2)n[nH]1)Cc1ccccc1	ZINC000238193603	509832427	/nfs/dbraw/zinc/83/24/27/509832427.db2.gz	DZAFFTVYKQFKIK-OAHLLOKOSA-N	-1	0	367.380	2.889	50	0		FFAARM
Cc1nc(CC(C)C)oc1C(=O)[N-]S(=O)(=O)Cc1cccc(F)c1	ZINC000252499038	509844013	/nfs/dbraw/zinc/84/40/13/509844013.db2.gz	RUEIWOLKTBHCTM-UHFFFAOYSA-N	-1	0	354.403	2.580	50	0		FFAARM
CC(C)n1ccnc1C1CCN(CC(=O)Nc2cccc(C(=O)[O-])c2)CC1	ZINC000243956956	509855958	/nfs/dbraw/zinc/85/59/58/509855958.db2.gz	CEUNIWRHEVJTNJ-UHFFFAOYSA-N	-1	0	370.453	2.980	50	0		FFAARM
COc1ccccc1[C@@H]1CCC[N@@H+]1CCC(=O)N1CCC(C(=O)[O-])CC1	ZINC000244866571	509872960	/nfs/dbraw/zinc/87/29/60/509872960.db2.gz	VYMFTERATXILEU-KRWDZBQOSA-N	-1	0	360.454	2.545	50	0		FFAARM
CO[C@@H](CNS(=O)(=O)CCC(F)(F)F)c1cc2ccccc2o1	ZINC000244975079	509877462	/nfs/dbraw/zinc/87/74/62/509877462.db2.gz	IAOZNOPNVLAYND-ZDUSSCGKSA-N	-1	0	351.346	2.992	50	0		FFAARM
Cc1nc(C)c(C)c(N[C@H]2C[C@@H](c3cc(=O)[nH]c(N4CCCC4)n3)C2)n1	ZINC000253534797	509886225	/nfs/dbraw/zinc/88/62/25/509886225.db2.gz	DNKJVCVRUZPKLR-GASCZTMLSA-N	-1	0	354.458	2.856	50	0		FFAARM
C[C@@H](c1ccccc1)N1C[C@@H](C(=O)Nc2cccc(CC(=O)[O-])c2)CC1=O	ZINC000263144419	510583377	/nfs/dbraw/zinc/58/33/77/510583377.db2.gz	KETJNWHZLTUWRN-YOEHRIQHSA-N	-1	0	366.417	2.862	50	0		FFAARM
O=C([O-])C1CCC(NC(=O)c2coc(-c3c(F)cccc3F)n2)CC1	ZINC000263147301	510584693	/nfs/dbraw/zinc/58/46/93/510584693.db2.gz	HFRWMHAAYLPFIZ-UHFFFAOYSA-N	-1	0	350.321	2.993	50	0		FFAARM
COc1ccc(Cl)cc1/C=C/C(=O)N(CCC(=O)[O-])C1CCOCC1	ZINC000328594776	533830561	/nfs/dbraw/zinc/83/05/61/533830561.db2.gz	BKHFNUMCGABNBR-GORDUTHDSA-N	-1	0	367.829	2.844	50	0		FFAARM
O=C([O-])[C@@H]1CCN(C(=O)NCc2ccccc2OCc2ccccc2)C1	ZINC000311360493	511775646	/nfs/dbraw/zinc/77/56/46/511775646.db2.gz	GTBNODCGVPKKCZ-QGZVFWFLSA-N	-1	0	354.406	2.882	50	0		FFAARM
COc1ccccc1/C=C(/C(=O)N1CCO[C@@H](C(=O)[O-])C1)c1ccccc1	ZINC000328595275	533941310	/nfs/dbraw/zinc/94/13/10/533941310.db2.gz	PTXWLLSDBYLQOC-XEYRCQSKSA-N	-1	0	367.401	2.548	50	0		FFAARM
Cc1nc(-c2ccc(C(=O)N3[C@@H]4CCCC[C@@H]4C[C@H]3C(=O)[O-])cc2)n[nH]1	ZINC000408513823	513084260	/nfs/dbraw/zinc/08/42/60/513084260.db2.gz	SWSNDZJHLOZNPE-OAGGEKHMSA-N	-1	0	354.410	2.638	50	0		FFAARM
CC(C)C[C@H](NC(=O)N(C)Cc1cc(-c2cccs2)n[nH]1)C(=O)[O-]	ZINC000426647062	514005380	/nfs/dbraw/zinc/00/53/80/514005380.db2.gz	JSTZLZLNNJUYRT-ZDUSSCGKSA-N	-1	0	350.444	2.779	50	0		FFAARM
CO[C@@H](CS(=O)(=O)[N-]c1noc(C(C)(C)C)n1)c1ccc(F)cc1	ZINC000530156019	517598100	/nfs/dbraw/zinc/59/81/00/517598100.db2.gz	LIFOXQXATFUDMN-LBPRGKRZSA-N	-1	0	357.407	2.636	50	0		FFAARM
C[C@@H]1Cc2cc(C(=O)N(C)Cc3ccc(OCC(=O)[O-])cc3)ccc2O1	ZINC000580096907	519005906	/nfs/dbraw/zinc/00/59/06/519005906.db2.gz	SODUVURAGSNXLV-CYBMUJFWSA-N	-1	0	355.390	2.746	50	0		FFAARM
CCOc1cc(C(=O)N[C@H]2CCC[C@H](SC)C2)ccc1OCC(=O)[O-]	ZINC000268950096	520667919	/nfs/dbraw/zinc/66/79/19/520667919.db2.gz	PQILPCDQLDGXMG-KBPBESRZSA-N	-1	0	367.467	2.953	50	0		FFAARM
O=C([O-])[C@@H]1CCCN(C(=O)[C@@H]2C[C@@H]2c2cccc(Br)c2)C1	ZINC000299743124	534519143	/nfs/dbraw/zinc/51/91/43/534519143.db2.gz	LYDLREABJYIISG-MRVWCRGKSA-N	-1	0	352.228	2.876	50	0		FFAARM
COc1cccc([C@H](CC(=O)[O-])NC(=O)[C@H]2[C@@H]3c4ccccc4C[C@H]23)c1	ZINC000630123361	522635585	/nfs/dbraw/zinc/63/55/85/522635585.db2.gz	AHOITYNWCLIRRD-RAUXBKROSA-N	-1	0	351.402	2.913	50	0		FFAARM
O=C([O-])c1cnc(C2CCN(C(=O)[C@@H]3COc4ccccc4C3)CC2)s1	ZINC000630243003	522731310	/nfs/dbraw/zinc/73/13/10/522731310.db2.gz	QPSDHEIXTMCYML-AWEZNQCLSA-N	-1	0	372.446	2.799	50	0		FFAARM
COc1cccc(CC(=O)N2C[C@@H](c3cccc(F)c3)[C@H](C(=O)[O-])C2)c1	ZINC000091493943	525870603	/nfs/dbraw/zinc/87/06/03/525870603.db2.gz	VZCQGRUBZLXANR-ZWKOTPCHSA-N	-1	0	357.381	2.704	50	0		FFAARM
O=C([O-])[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)CCc1nc(-c2ccoc2)no1	ZINC000268938424	526290758	/nfs/dbraw/zinc/29/07/58/526290758.db2.gz	JDCPTIKURAPWJV-YUTCNCBUSA-N	-1	0	359.382	2.507	50	0		FFAARM
O=C([O-])COc1cccc(CNC(=O)[C@H]2C[C@H]2c2cccc(F)c2F)c1	ZINC000238021665	527618230	/nfs/dbraw/zinc/61/82/30/527618230.db2.gz	GFSLSLIVINFQFP-GJZGRUSLSA-N	-1	0	361.344	2.848	50	0		FFAARM
COc1ccccc1S(=O)(=O)N1CC[C@H](c2ccccc2C(=O)[O-])C1	ZINC000072145311	571173071	/nfs/dbraw/zinc/17/30/71/571173071.db2.gz	LREQPABZTUUMON-ZDUSSCGKSA-N	-1	0	361.419	2.572	50	0		FFAARM
Cc1cc(S(=O)(=O)N2CCc3ccc(F)c(C(=O)[O-])c3C2)c(C)s1	ZINC000585097843	571320443	/nfs/dbraw/zinc/32/04/43/571320443.db2.gz	AATXOOAXCSAVTE-UHFFFAOYSA-N	-1	0	369.439	2.949	50	0		FFAARM
CC(C)(C)OC(=O)N[C@H](Cc1ccc(O)c(Br)c1)C(=O)[O-]	ZINC000044295600	727985104	/nfs/dbraw/zinc/98/51/04/727985104.db2.gz	SQOXBCRLNHVHGU-SNVBAGLBSA-N	-1	0	360.204	2.675	50	0		FFAARM
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCC[C@H](CCC(=O)[O-])C1	ZINC000263098275	729679239	/nfs/dbraw/zinc/67/92/39/729679239.db2.gz	ILXGTQCKTUQOMD-QWHCGFSZSA-N	-1	0	366.845	2.562	50	0		FFAARM
O=C([O-])C1(NC(=O)C[C@H](Cc2ccccc2)c2ccco2)CCOCC1	ZINC000952964721	939809729	/nfs/dbraw/zinc/80/97/29/939809729.db2.gz	PGJLVKJFYYUBTH-INIZCTEOSA-N	-1	0	357.406	2.746	50	0		FFAARM
Cc1ccc(S(=O)(=O)[N-]c2nc3ccccc3nc2NCCCO)cc1	ZINC000022590774	964557858	/nfs/dbraw/zinc/55/78/58/964557858.db2.gz	JGDZCSIXWGKLPP-UHFFFAOYSA-N	-1	0	372.450	2.533	50	0		FFAARM
CC(C)Oc1ccc([C@H]2CC(=O)N(c3ccc(O)c(C(=O)[O-])c3)C2=O)cc1	ZINC000004907062	975381996	/nfs/dbraw/zinc/38/19/96/975381996.db2.gz	USSUOTMWDBLJDL-OAHLLOKOSA-N	-1	0	369.373	2.925	50	0		FFAARM
COc1ccccc1[C@@H]1CCCN1C(=O)c1cnc2c(cnn2C)c1O	ZINC000119214912	975741091	/nfs/dbraw/zinc/74/10/91/975741091.db2.gz	FDLMKNVJIQHPEU-HNNXBMFYSA-N	-1	0	352.394	2.660	50	0		FFAARM
CCn1c(N[C@@H]2COc3c(cccc3OC)C2)nc2cc(C(=O)[O-])cnc21	ZINC001506403116	1059494627	/nfs/dbraw/zinc/49/46/27/1059494627.db2.gz	RIJHKLGRYRUIRB-ZDUSSCGKSA-N	-1	0	368.393	2.574	50	0		FFAARM
CCn1c(NCc2[nH]nc3c2CCCCC3)nc2cc(C(=O)[O-])cnc21	ZINC001506416375	1059503771	/nfs/dbraw/zinc/50/37/71/1059503771.db2.gz	FPRHSKAXGVHQPG-UHFFFAOYSA-N	-1	0	354.414	2.754	50	0		FFAARM
Cc1ccc(/C=C/C(=O)[O-])cc1S(=O)(=O)N1CCc2ccccc2C1	ZINC000001184836	219386768	/nfs/dbraw/zinc/38/67/68/219386768.db2.gz	GKWFXEJJCJIWKZ-CMDGGOBGSA-N	-1	0	357.431	2.840	50	0		FFAARM
O=C([O-])CCN(C(=O)[C@@H]1C[C@@H]1c1ccc(F)c(F)c1)C1CCOCC1	ZINC000238067823	222913522	/nfs/dbraw/zinc/91/35/22/222913522.db2.gz	XEUOFGUYUYJKCA-ZIAGYGMSSA-N	-1	0	353.365	2.551	50	0		FFAARM
Cc1ccc(CN2C(=O)CC[C@@H]2C(=O)NCc2cccc(C(=O)[O-])c2)cc1	ZINC000237732747	222910282	/nfs/dbraw/zinc/91/02/82/222910282.db2.gz	KSKSPLCVSZRYCN-GOSISDBHSA-N	-1	0	366.417	2.501	50	0		FFAARM
O=c1c2[n-][nH]n(Cc3ccc(Cl)cc3)c=2c(=O)n1-c1ccc(F)cc1	ZINC000006817246	219774075	/nfs/dbraw/zinc/77/40/75/219774075.db2.gz	HBRFSERQPLYUFB-CABCVRRESA-N	-1	0	358.760	2.973	50	0		FFAARM
COc1ccc([C@@H](CC(=O)[O-])NC(=O)c2ccc3c(c2)CCO3)cc1OC	ZINC000299746606	223079256	/nfs/dbraw/zinc/07/92/56/223079256.db2.gz	YLUOWQQUPUMVKH-OAHLLOKOSA-N	-1	0	371.389	2.585	50	0		FFAARM
O=C([O-])[C@H]1CN(C(=O)/C(=C/c2ccc(F)cc2)c2cccs2)CCO1	ZINC000328595280	223116176	/nfs/dbraw/zinc/11/61/76/223116176.db2.gz	PZWFEKKJSPBYNS-YVGNARHYSA-N	-1	0	361.394	2.740	50	0		FFAARM
Cc1cc(C)c2c(-c3ccccc3)nc(S[C@@H](CCO)C(=O)[O-])n2n1	ZINC000012558622	220007395	/nfs/dbraw/zinc/00/73/95/220007395.db2.gz	OQJCEMVVHRTBKO-AWEZNQCLSA-N	-1	0	357.435	2.941	50	0		FFAARM
COc1ccc(/C=C/C(=O)[O-])cc1S(=O)(=O)Nc1ccccc1F	ZINC000013367154	220066319	/nfs/dbraw/zinc/06/63/19/220066319.db2.gz	ZJFDESXYWKTMQT-VQHVLOKHSA-N	-1	0	351.355	2.733	50	0		FFAARM
CC(=O)N1CCc2cc(NC(=O)C[C@H](C(=O)[O-])c3ccccc3)ccc21	ZINC000013468114	220067837	/nfs/dbraw/zinc/06/78/37/220067837.db2.gz	IFSMTTLIFDTSRY-KRWDZBQOSA-N	-1	0	352.390	2.793	50	0		FFAARM
COc1ccc(-n2c(CNC(=O)COc3ccccc3)n[n-]c2=S)cc1	ZINC000013571859	220076180	/nfs/dbraw/zinc/07/61/80/220076180.db2.gz	WJWVXWGEZVFNHW-UHFFFAOYSA-N	-1	0	370.434	2.634	50	0		FFAARM
Cc1cc(C)cc([N-]S(=O)(=O)c2ccc(-c3ccc(=O)[nH]n3)s2)c1	ZINC000020574739	220333897	/nfs/dbraw/zinc/33/38/97/220333897.db2.gz	ZTKKUUBAFBQJIT-UHFFFAOYSA-N	-1	0	361.448	2.916	50	0		FFAARM
Cc1ccc(NC(=O)CCC2=Nc3ccccc3S(=O)(=O)[N-]2)cc1F	ZINC000021661316	220362513	/nfs/dbraw/zinc/36/25/13/220362513.db2.gz	CPZBDGXDOAEXBR-UHFFFAOYSA-N	-1	0	361.398	2.875	50	0		FFAARM
COc1ccc([C@H](c2sc3ncnn3c2[O-])N2C[C@@H](C)O[C@@H](C)C2)cc1	ZINC000022609434	220390893	/nfs/dbraw/zinc/39/08/93/220390893.db2.gz	UHVPBRKGMCUSBA-TYNCELHUSA-N	-1	0	374.466	2.704	50	0		FFAARM
COc1cc2c(cc1OC)[C@H](CC(=O)[O-])N(C(=O)/C=C/c1ccco1)CC2	ZINC000299265699	533171773	/nfs/dbraw/zinc/17/17/73/533171773.db2.gz	JFHMTWQEBIFUCV-JFDDCEBESA-N	-1	0	371.389	2.911	50	0		FFAARM
Cc1cc(C(=O)[O-])cc(S(=O)(=O)Nc2ccccc2-n2cccn2)c1C	ZINC000048265365	221004538	/nfs/dbraw/zinc/00/45/38/221004538.db2.gz	WROUHGLBVZNYKD-UHFFFAOYSA-N	-1	0	371.418	2.988	50	0		FFAARM
CCc1[nH]nc(S(=O)(=O)[N-]c2ccc(C)c(Cl)c2)c1C(=O)OC	ZINC000048991576	221016120	/nfs/dbraw/zinc/01/61/20/221016120.db2.gz	AOPIWSYNDAZWEW-UHFFFAOYSA-N	-1	0	357.819	2.521	50	0		FFAARM
CCc1nc2ccccc2n1CCC(=O)Nc1c(C)nn(CC(=O)[O-])c1C	ZINC000055182508	221060638	/nfs/dbraw/zinc/06/06/38/221060638.db2.gz	UMIUDOQEEUPPJP-UHFFFAOYSA-N	-1	0	369.425	2.525	50	0		FFAARM
O=C(N[C@H](c1cccs1)C1CCCC1)c1c[nH]c2nc(=O)[n-]c(=O)c-2c1	ZINC000053108642	221043330	/nfs/dbraw/zinc/04/33/30/221043330.db2.gz	TUYKIOMKRGRVSP-AWEZNQCLSA-N	-1	0	370.434	2.747	50	0		FFAARM
O=C1OCCN1Cc1cccc([N-]S(=O)(=O)c2c(F)cccc2F)c1	ZINC000055609596	221072363	/nfs/dbraw/zinc/07/23/63/221072363.db2.gz	OFKOXTXPOYYNFS-UHFFFAOYSA-N	-1	0	368.361	2.718	50	0		FFAARM
Cc1ccc(O)c(S(=O)(=O)[N-]c2ccc(Cn3ccccc3=O)cc2)c1	ZINC000057118761	221083629	/nfs/dbraw/zinc/08/36/29/221083629.db2.gz	KEBNDFRCMCTQMV-UHFFFAOYSA-N	-1	0	370.430	2.711	50	0		FFAARM
COc1ccccc1C[C@@H](C(=O)Nc1cccc(C)c1C)c1nnn[n-]1	ZINC000057524720	221090288	/nfs/dbraw/zinc/09/02/88/221090288.db2.gz	GOUQZWDXRUYLHO-OAHLLOKOSA-N	-1	0	351.410	2.790	50	0		FFAARM
O=C([O-])c1ccc2c(c1)S[C@@H](CC(=O)Nc1ccccc1F)C(=O)N2	ZINC000061719806	221134537	/nfs/dbraw/zinc/13/45/37/221134537.db2.gz	HQWLCNPODZKIDB-AWEZNQCLSA-N	-1	0	360.366	2.966	50	0		FFAARM
O=C([O-])c1ccc2c(c1)S[C@H](CC(=O)Nc1ccccc1F)C(=O)N2	ZINC000061719805	221134606	/nfs/dbraw/zinc/13/46/06/221134606.db2.gz	HQWLCNPODZKIDB-CQSZACIVSA-N	-1	0	360.366	2.966	50	0		FFAARM
COc1cc(-c2ccno2)ccc1S(=O)(=O)[N-]c1ccc2c(c1)OCO2	ZINC000064979575	221160647	/nfs/dbraw/zinc/16/06/47/221160647.db2.gz	IYILOIFGFLIJCZ-UHFFFAOYSA-N	-1	0	374.374	2.880	50	0		FFAARM
COc1ccc(NC(=O)C[C@H]2Sc3cc(C(=O)[O-])ccc3NC2=O)cc1	ZINC000061721001	221135397	/nfs/dbraw/zinc/13/53/97/221135397.db2.gz	YZOBTSUZMJNNCH-OAHLLOKOSA-N	-1	0	372.402	2.835	50	0		FFAARM
Cc1cc(F)ccc1[N-]S(=O)(=O)c1cc(-c2ccc(=O)[nH]n2)cs1	ZINC000065119393	221170962	/nfs/dbraw/zinc/17/09/62/221170962.db2.gz	HAMLPANQELXJNK-UHFFFAOYSA-N	-1	0	365.411	2.747	50	0		FFAARM
O=C(CCc1cc(=O)[n-]o1)N1CC[C@@H](c2ccc3ccccc3c2)[C@H](O)C1	ZINC000065396956	221210805	/nfs/dbraw/zinc/21/08/05/221210805.db2.gz	AVVRTMDHMXYORY-RBUKOAKNSA-N	-1	0	366.417	2.843	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)c1cccc(NC(=O)C2CCCC2)c1)C(F)(F)F	ZINC000065422625	221217369	/nfs/dbraw/zinc/21/73/69/221217369.db2.gz	BCBHZKXFUZZGDA-CYBMUJFWSA-N	-1	0	372.343	2.951	50	0		FFAARM
CC(=O)c1cn(CC(=O)N[C@H](Cc2ccccc2)C(=O)[O-])c2ccccc12	ZINC000071376095	221344973	/nfs/dbraw/zinc/34/49/73/221344973.db2.gz	LWMVLYKZVQOGNL-GOSISDBHSA-N	-1	0	364.401	2.656	50	0		FFAARM
O=C([O-])[C@]1(Cc2ccccc2)CCCN(c2nnnn2-c2ccccc2)C1	ZINC000071747586	221360090	/nfs/dbraw/zinc/36/00/90/221360090.db2.gz	DQBNFYDIHHWMJB-FQEVSTJZSA-N	-1	0	363.421	2.576	50	0		FFAARM
CC(C)c1nn(C)c2sc(C(=O)N3CCCC[C@@H]3c3n[nH]c(=O)[n-]3)cc12	ZINC000329481039	258139808	/nfs/dbraw/zinc/13/98/08/258139808.db2.gz	VRKPJVOFYMMDDC-LLVKDONJSA-N	-1	0	374.470	2.949	50	0		FFAARM
CC(NCc1cccc(F)c1)=C1C(=O)[N-]C(=O)N(c2ccc(C)cc2)C1=O	ZINC000005884659	533416930	/nfs/dbraw/zinc/41/69/30/533416930.db2.gz	BHWCJUWCQRURGA-GHRIWEEISA-N	-1	0	367.380	2.781	50	0		FFAARM
Cc1[nH]cnc1-c1nccn1-c1ccc(N2CCC[C@H](C(=O)[O-])C2)cc1	ZINC000077505406	132188075	/nfs/dbraw/zinc/18/80/75/132188075.db2.gz	KTIYBTNTTODQNI-AWEZNQCLSA-N	-1	0	351.410	2.872	50	0		FFAARM
O=C([O-])c1cccc(N2CCC(c3nccn3Cc3ccncc3)CC2)n1	ZINC000091351002	132201436	/nfs/dbraw/zinc/20/14/36/132201436.db2.gz	OSOFNCRTOSJMMY-UHFFFAOYSA-N	-1	0	363.421	2.804	50	0		FFAARM
O=C([O-])[C@@]1(CC2CC2)CCCN(C(=O)c2ccccc2N2CCOCC2)C1	ZINC000091440364	132201663	/nfs/dbraw/zinc/20/16/63/132201663.db2.gz	ZDLZYICLIOKCKU-OAQYLSRUSA-N	-1	0	372.465	2.630	50	0		FFAARM
O=C([O-])c1cccc(N2CCC[C@@H](c3nccn3Cc3cccnc3)C2)n1	ZINC000091444865	132201861	/nfs/dbraw/zinc/20/18/61/132201861.db2.gz	JUMMFUHWWHWNAY-MRXNPFEDSA-N	-1	0	363.421	2.804	50	0		FFAARM
O=C([O-])c1ccc(N2CCC[C@@H](c3nccn3Cc3cccnc3)C2)nc1	ZINC000091651118	132203022	/nfs/dbraw/zinc/20/30/22/132203022.db2.gz	RCQQNOPZQOHWQG-QGZVFWFLSA-N	-1	0	363.421	2.804	50	0		FFAARM
Cc1ccc(N2C[C@H](C)N(Cc3ccc(OCC(=O)[O-])cc3)CC2=O)cc1	ZINC000091819859	132203960	/nfs/dbraw/zinc/20/39/60/132203960.db2.gz	AXPGLCCPNOQLPK-INIZCTEOSA-N	-1	0	368.433	2.696	50	0		FFAARM
CCOc1cc(F)cc([C@@H](C(=O)[O-])N2CCN(c3ncccc3C)CC2)c1	ZINC000095531537	132215231	/nfs/dbraw/zinc/21/52/31/132215231.db2.gz	MANPGWREHVFVKO-SFHVURJKSA-N	-1	0	373.428	2.876	50	0		FFAARM
Cc1cc(-c2nc(CCC(C)C)nn2CC(=O)[O-])ccc1N1CCOCC1	ZINC000097213094	132227951	/nfs/dbraw/zinc/22/79/51/132227951.db2.gz	TYQZJSYUEBXWOJ-UHFFFAOYSA-N	-1	0	372.469	2.763	50	0		FFAARM
O=C1CCCCN1c1cccc([N-]S(=O)(=O)c2c[nH]c3ncccc23)c1	ZINC000193885005	132266932	/nfs/dbraw/zinc/26/69/32/132266932.db2.gz	XDHHZXNUGCIXIC-UHFFFAOYSA-N	-1	0	370.434	2.881	50	0		FFAARM
CC(C)n1cnnc1SCC(=O)N[C@@H](C(=O)[O-])c1ccc(Cl)cc1	ZINC000095463957	221911966	/nfs/dbraw/zinc/91/19/66/221911966.db2.gz	DAOFTQQWZOJNRC-CYBMUJFWSA-N	-1	0	368.846	2.547	50	0		FFAARM
Cn1cc(S(=O)(=O)[N-]c2ccc3c(c2)C(=O)Nc2ccccc2O3)cn1	ZINC000096103575	222024319	/nfs/dbraw/zinc/02/43/19/222024319.db2.gz	AROVJGCITPVTTJ-UHFFFAOYSA-N	-1	0	370.390	2.579	50	0		FFAARM
O=C([O-])C1(Oc2ccccc2)CCN(C(=O)NCc2ccccc2)CC1	ZINC000096132411	222038855	/nfs/dbraw/zinc/03/88/55/222038855.db2.gz	SFLNUVJADRAEGV-UHFFFAOYSA-N	-1	0	354.406	2.894	50	0		FFAARM
C[C@@H]1CCc2cc(F)cc3c([O-])c(C(=O)NCc4cccnc4)c(=O)n1c23	ZINC000100630053	222248092	/nfs/dbraw/zinc/24/80/92/222248092.db2.gz	AIYVCKRQIPKGLQ-LLVKDONJSA-N	-1	0	367.380	2.678	50	0		FFAARM
COc1ccc(OC)c2c1s/c(=N\C(=O)c1ccc(C(=O)[O-])cc1)n2C	ZINC000100969445	222259903	/nfs/dbraw/zinc/25/99/03/222259903.db2.gz	DGHRPOLSCVVCED-HNENSFHCSA-N	-1	0	372.402	2.696	50	0		FFAARM
CCc1ccc(Cn2[nH][n-]c3c(=O)n(-c4ccc(F)cc4)c(=O)c2=3)cc1	ZINC000101167263	222264580	/nfs/dbraw/zinc/26/45/80/222264580.db2.gz	UUMNYXAVKLUMKN-IAGOWNOFSA-N	-1	0	352.369	2.882	50	0		FFAARM
COc1cccc(Cn2[nH][n-]c3c(=O)n(-c4ccc(Cl)cc4)c(=O)c2=3)c1	ZINC000101167170	222264699	/nfs/dbraw/zinc/26/46/99/222264699.db2.gz	STYUSGHAVRJFAX-JKSUJKDBSA-N	-1	0	370.796	2.842	50	0		FFAARM
Cc1cccc(C)c1N1C(=O)C[C@H](Nc2ccc(CC(=O)[O-])cc2)C1=O	ZINC000103292644	222332203	/nfs/dbraw/zinc/33/22/03/222332203.db2.gz	MEUBRYMECIZSKQ-INIZCTEOSA-N	-1	0	352.390	2.675	50	0		FFAARM
O=C1[C@@H]2ON=C(c3ccc(F)cc3)[C@H]2C(=O)N1c1ccc(F)c(Cl)c1	ZINC000101342565	222270588	/nfs/dbraw/zinc/27/05/88/222270588.db2.gz	XCEQNPAPSKVSAI-UKRRQHHQSA-N	-1	0	362.719	2.911	50	0		FFAARM
CCOc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccc(C)cc4)c=3c2=O)cc1	ZINC000101417765	222274087	/nfs/dbraw/zinc/27/40/87/222274087.db2.gz	VKSHFEONZXWLGA-ZWKOTPCHSA-N	-1	0	364.405	2.887	50	0		FFAARM
Cc1nc(-n2[n-]c(C)c(CC(=O)NCc3ccccc3)c2=O)sc1C	ZINC000101831552	222285575	/nfs/dbraw/zinc/28/55/75/222285575.db2.gz	QSGIGXHBVMNOAM-UHFFFAOYSA-N	-1	0	356.451	2.819	50	0		FFAARM
Cc1c2c(cc(=O)n1Cc1ccccn1)[n-]n(-c1ccc(F)cc1)c2=O	ZINC000102492519	222298291	/nfs/dbraw/zinc/29/82/91/222298291.db2.gz	DMURXEKHVSKZII-UHFFFAOYSA-N	-1	0	350.353	2.735	50	0		FFAARM
COc1ccc2c(c1)CCC[C@H]2CC(=O)NCc1nc(C(=O)[O-])cs1	ZINC000124131333	222527623	/nfs/dbraw/zinc/52/76/23/222527623.db2.gz	SWNFUJBDFSQGNC-LBPRGKRZSA-N	-1	0	360.435	2.976	50	0		FFAARM
Cc1noc2nc(C(C)C)cc(C(=O)[N-]S(=O)(=O)CC3CCC3)c12	ZINC000164824565	222557140	/nfs/dbraw/zinc/55/71/40/222557140.db2.gz	MILPDCVVXRLKKP-UHFFFAOYSA-N	-1	0	351.428	2.514	50	0		FFAARM
O=C([O-])C12C[C@H]3C[C@@H](C1)CC(n1ncc(NC4CC4)c(Cl)c1=O)(C3)C2	ZINC000002218934	263144897	/nfs/dbraw/zinc/14/48/97/263144897.db2.gz	OZHUHTXXRQLNNI-IMWAJYHESA-N	-1	0	363.845	2.851	50	0		FFAARM
CCOc1ccc([N-]S(=O)(=O)c2cc(OC)ccc2OC)cc1OC	ZINC000007109379	263349328	/nfs/dbraw/zinc/34/93/28/263349328.db2.gz	OBJBVAKTYSFLCX-UHFFFAOYSA-N	-1	0	367.423	2.912	50	0		FFAARM
COc1ccc(NC(C)=O)cc1S(=O)(=O)[N-]c1ccc2c(c1)CCC2	ZINC000009116348	263359362	/nfs/dbraw/zinc/35/93/62/263359362.db2.gz	PGHMCJJNWSXZTL-UHFFFAOYSA-N	-1	0	360.435	2.943	50	0		FFAARM
COc1ccc(S(=O)(=O)Nc2cccc(SC)c2)cc1C(=O)[O-]	ZINC000047949046	263406414	/nfs/dbraw/zinc/40/64/14/263406414.db2.gz	AZRXUBMHUZDBLG-UHFFFAOYSA-N	-1	0	353.421	2.916	50	0		FFAARM
CN(C(=O)c1ccc2[n-]c(=S)oc2c1)[C@H]1CCCC[C@H]1S(C)(=O)=O	ZINC000129824793	263454452	/nfs/dbraw/zinc/45/44/52/263454452.db2.gz	QSLZAEORGQCJSO-GXTWGEPZSA-N	-1	0	368.480	2.544	50	0		FFAARM
Cc1ccc(C)c(CC(=O)N2CCC[C@H](c3ccn(CC(=O)[O-])n3)C2)c1	ZINC000426563508	263635557	/nfs/dbraw/zinc/63/55/57/263635557.db2.gz	SAVFAUQJXPHNQW-INIZCTEOSA-N	-1	0	355.438	2.533	50	0		FFAARM
Cn1c2ccc(S(=O)(=O)[N-]c3cccc4cccnc43)cc2sc1=O	ZINC000001424661	506262504	/nfs/dbraw/zinc/26/25/04/506262504.db2.gz	STBUPZIZOSYORS-UHFFFAOYSA-N	-1	0	371.443	2.949	50	0		FFAARM
Cc1coc2c1cc1c(C)c(CCC(=O)NCCC(=O)[O-])c(=O)oc1c2C	ZINC000002104883	506272449	/nfs/dbraw/zinc/27/24/49/506272449.db2.gz	JAQGBORMWNSUTH-UHFFFAOYSA-N	-1	0	371.389	2.988	50	0	biogenic	FFAARM
CCOC(=O)[C@@]([N-]c1nccs1)(NC(=O)OC(C)C)C(F)(F)F	ZINC000002262220	506276903	/nfs/dbraw/zinc/27/69/03/506276903.db2.gz	FVJAQTANDABOPG-LLVKDONJSA-N	-1	0	355.338	2.511	50	0		FFAARM
O=C([O-])[C@H](Cc1c[nH]c2ccccc12)NC(=S)NCc1ccccc1	ZINC000002291742	506276976	/nfs/dbraw/zinc/27/69/76/506276976.db2.gz	MBHQACQXPLFDIS-KRWDZBQOSA-N	-1	0	353.447	2.828	50	0		FFAARM
O=C([O-])CC[C@@H](NC(=O)OCc1ccccc1)C(=O)OCc1ccccc1	ZINC000002545095	506283791	/nfs/dbraw/zinc/28/37/91/506283791.db2.gz	VWHKODOUMSMUAF-QGZVFWFLSA-N	-1	0	371.389	2.890	50	0	in-vitro	FFAARM
CCn1ncc(S(=O)(=O)[N-]c2cnn(Cc3ccccc3C)c2)c1C	ZINC000002804599	506294787	/nfs/dbraw/zinc/29/47/87/506294787.db2.gz	OHDWHEGLZJLAQP-UHFFFAOYSA-N	-1	0	359.455	2.565	50	0		FFAARM
Cc1cc(C)c(S(=O)(=O)N(CCc2ccccc2)CC(=O)[O-])c(C)c1	ZINC000002848290	506296111	/nfs/dbraw/zinc/29/61/11/506296111.db2.gz	SGCZXEPEPXHJPJ-UHFFFAOYSA-N	-1	0	361.463	2.930	50	0		FFAARM
Cc1nn(CC(=O)Nc2ccc(C(=O)[O-])cc2)c(C)c1Br	ZINC000002809227	506297283	/nfs/dbraw/zinc/29/72/83/506297283.db2.gz	ZUJDLAQCQJOYRX-UHFFFAOYSA-N	-1	0	352.188	2.599	50	0		FFAARM
O=C(CSc1n[nH]c(-c2ccccc2)n1)NCc1cccc(C(=O)[O-])c1	ZINC000002879124	506300074	/nfs/dbraw/zinc/30/00/74/506300074.db2.gz	VUQBOPRBFLPMNM-UHFFFAOYSA-N	-1	0	368.418	2.578	50	0		FFAARM
O=S(=O)([O-])c1cc(OS(=O)(=O)c2ccccc2)cc2ccccc21	ZINC000003001606	506304825	/nfs/dbraw/zinc/30/48/25/506304825.db2.gz	TWDFOSWRLNTLAA-UHFFFAOYSA-N	-1	0	364.400	2.854	50	0		FFAARM
O=C(CCn1c(=O)c2ccccc2[n-]c1=S)NCCc1ccccc1	ZINC000003043459	506306898	/nfs/dbraw/zinc/30/68/98/506306898.db2.gz	DYNVTCBSBBHREI-UHFFFAOYSA-N	-1	0	353.447	2.808	50	0		FFAARM
CCOC(=O)c1c(CC)[nH]nc1S(=O)(=O)[N-]c1cccc(SC)c1	ZINC000033256065	506350373	/nfs/dbraw/zinc/35/03/73/506350373.db2.gz	NTAOUZZVLWJRAT-UHFFFAOYSA-N	-1	0	369.468	2.672	50	0		FFAARM
O=C([O-])COc1ccc(-c2n[nH]cc2-c2ccc3c(c2)OCCO3)c(O)c1	ZINC000003983845	506353828	/nfs/dbraw/zinc/35/38/28/506353828.db2.gz	ZJCQUSSUZDADTR-UHFFFAOYSA-N	-1	0	368.345	2.684	50	0	biogenic	FFAARM
Cc1ccccc1N1CCN(c2ccc(NC(=O)/C=C\C(=O)[O-])cc2)CC1	ZINC000033330673	506354408	/nfs/dbraw/zinc/35/44/08/506354408.db2.gz	SBZCRTNWUMXPLR-KHPPLWFESA-N	-1	0	365.433	2.901	50	0		FFAARM
O=C([O-])c1ccc2c(c1)nc1n(c2=O)CC/C1=C/c1ccc2c(c1)OCO2	ZINC000033404730	506357318	/nfs/dbraw/zinc/35/73/18/506357318.db2.gz	ARVRUKSFHSBNLP-GHXNOFRVSA-N	-1	0	362.341	2.768	50	0		FFAARM
NC(=O)c1c(NC(=O)[C@@H]2CCCC[C@H]2C(=O)[O-])sc2c1CCCCC2	ZINC000004150412	506363104	/nfs/dbraw/zinc/36/31/04/506363104.db2.gz	JTUBJJWMUUKQGL-GHMZBOCLSA-N	-1	0	364.467	2.945	50	0		FFAARM
O=C([O-])[C@@H]1CC=CC[C@@H]1C(=O)N1CCN(C/C=C/c2ccccc2)CC1	ZINC000004179535	506364708	/nfs/dbraw/zinc/36/47/08/506364708.db2.gz	JLTLXEFNRIBPCX-YLXGYYMFSA-N	-1	0	354.450	2.511	50	0		FFAARM
Cc1cccc(-c2nnc(CCC(=O)NCc3cccc(F)c3)c(=O)[n-]2)c1	ZINC000034768739	506369966	/nfs/dbraw/zinc/36/99/66/506369966.db2.gz	HEMOXCOXSRACMC-UHFFFAOYSA-N	-1	0	366.396	2.941	50	0		FFAARM
O=C(CCc1nnc(-c2ccc(F)cc2)[n-]c1=O)NCc1ccccc1	ZINC000034767760	506370891	/nfs/dbraw/zinc/37/08/91/506370891.db2.gz	VLFPXRODLHSMHB-UHFFFAOYSA-N	-1	0	352.369	2.632	50	0		FFAARM
CCCCN(C)C(=O)Cn1c(=O)c2[nH]c3ccc(OC)cc3c2[n-]c1=S	ZINC000004951684	506409411	/nfs/dbraw/zinc/40/94/11/506409411.db2.gz	LKXFBQLMPQRCIK-UHFFFAOYSA-N	-1	0	374.466	2.807	50	0		FFAARM
O=C([O-])c1cccc(NC(=O)/C(=C\c2ccco2)NC(=O)c2ccco2)c1	ZINC000004976736	506410948	/nfs/dbraw/zinc/41/09/48/506410948.db2.gz	UCCLXTPHXIPPIS-RVDMUPIBSA-N	-1	0	366.329	2.980	50	0		FFAARM
CCOC(=O)CSc1nnc(-c2ccco2)n1-c1ccc(C(=O)[O-])cc1	ZINC000005031120	506415754	/nfs/dbraw/zinc/41/57/54/506415754.db2.gz	VQHCEMMJRSKUCD-UHFFFAOYSA-N	-1	0	373.390	2.881	50	0		FFAARM
O=C1N(Cc2ccc(F)cc2)C(c2ccccc2)=N[C@@]1([O-])C(F)(F)F	ZINC000005307662	506434528	/nfs/dbraw/zinc/43/45/28/506434528.db2.gz	QCRLSCHZXUNJDR-INIZCTEOSA-N	-1	0	352.287	2.866	50	0		FFAARM
O=C1CCCN1c1ccc([N-]S(=O)(=O)c2cc(F)ccc2F)cc1	ZINC000005329199	506435963	/nfs/dbraw/zinc/43/59/63/506435963.db2.gz	CYHOBXBVUGUFKA-UHFFFAOYSA-N	-1	0	352.362	2.892	50	0		FFAARM
CC1=C(C)C[C@H](C(=O)[O-])[C@H](C(=O)N2CCN(CCc3ccccc3)CC2)C1	ZINC000006731453	506501108	/nfs/dbraw/zinc/50/11/08/506501108.db2.gz	YVSBYFWGAAAUSZ-UXHICEINSA-N	-1	0	370.493	2.821	50	0		FFAARM
Cc1ccc(CN2CCN(C(=O)[C@@H]3C4CCC(CC4)[C@@H]3C(=O)[O-])CC2)cc1	ZINC000006741074	506502492	/nfs/dbraw/zinc/50/24/92/506502492.db2.gz	KVZDBJRDXYZGOE-TUNPWDSISA-N	-1	0	370.493	2.776	50	0		FFAARM
Cc1ccccc1[N-]S(=O)(=O)c1nnc(NC(=O)CC(C)C)s1	ZINC000006778407	506505795	/nfs/dbraw/zinc/50/57/95/506505795.db2.gz	NBSHAOUHYBFLQV-UHFFFAOYSA-N	-1	0	354.457	2.632	50	0		FFAARM
CC[C@@H](C)c1ccc(S(=O)(=O)[N-]NC(=S)NCc2ccco2)cc1	ZINC000006953340	506520729	/nfs/dbraw/zinc/52/07/29/506520729.db2.gz	VSECGDYDZFHYRH-GFCCVEGCSA-N	-1	0	367.496	2.651	50	0		FFAARM
Cc1ccc(-n2nnnc2SCc2nc(=O)c3sccc3[n-]2)cc1C	ZINC000008980357	506675908	/nfs/dbraw/zinc/67/59/08/506675908.db2.gz	PDQPQQVXXPZIHZ-UHFFFAOYSA-N	-1	0	370.463	2.869	50	0		FFAARM
COc1ccccc1OCCSc1nnc(Cc2ccccc2)c(=O)[n-]1	ZINC000009305899	506689491	/nfs/dbraw/zinc/68/94/91/506689491.db2.gz	FBDZPXNXEJGHCZ-UHFFFAOYSA-N	-1	0	369.446	2.935	50	0		FFAARM
COC(=O)c1ccc(C)c(NS(=O)(=O)c2cc(C(=O)[O-])ccc2C)c1	ZINC000009338442	506691047	/nfs/dbraw/zinc/69/10/47/506691047.db2.gz	ZUGIGXMKAWHRNH-UHFFFAOYSA-N	-1	0	363.391	2.589	50	0		FFAARM
O=C(Nc1cc(=O)nc2[n-]c(CCc3ccccc3)nn21)C1CCCCC1	ZINC000009356878	506693090	/nfs/dbraw/zinc/69/30/90/506693090.db2.gz	XEGTVLNFNFJTNK-UHFFFAOYSA-N	-1	0	365.437	2.722	50	0		FFAARM
CN(Cc1nc(=O)c2sccc2[n-]1)C(=O)COc1ccc(Cl)cc1	ZINC000010720934	506751394	/nfs/dbraw/zinc/75/13/94/506751394.db2.gz	CZUYOCPYBNGEQS-UHFFFAOYSA-N	-1	0	363.826	2.675	50	0		FFAARM
Cn1ccc(-c2cc(C(F)(F)F)c3c(C4CC4)nn(CC(=O)[O-])c3n2)n1	ZINC000012396931	506860471	/nfs/dbraw/zinc/86/04/71/506860471.db2.gz	SOINQIRZJARPEI-UHFFFAOYSA-N	-1	0	365.315	2.813	50	0		FFAARM
COc1ccc(CCC(=O)N2C[C@@H](C(=O)[O-])Oc3ccccc32)cc1OC	ZINC000013433750	506941209	/nfs/dbraw/zinc/94/12/09/506941209.db2.gz	FGERLQDENWIDSE-SFHVURJKSA-N	-1	0	371.389	2.515	50	0		FFAARM
COc1ccc(S(=O)(=O)Nc2ccc(Cl)c(C(=O)[O-])c2)cc1F	ZINC000047318129	507307987	/nfs/dbraw/zinc/30/79/87/507307987.db2.gz	QMKLORUAOUHYNH-UHFFFAOYSA-N	-1	0	359.762	2.987	50	0		FFAARM
CCOC(=O)c1c(C)[nH]nc1S(=O)(=O)[N-]c1ccc(C(C)C)cc1	ZINC000047417578	507325840	/nfs/dbraw/zinc/32/58/40/507325840.db2.gz	IYBRXULZDWRPDW-UHFFFAOYSA-N	-1	0	351.428	2.819	50	0		FFAARM
CCC[C@H](NC(=O)[C@@H](NC(=O)OCc1ccccc1)[C@H](C)CC)C(=O)[O-]	ZINC000025664125	507520413	/nfs/dbraw/zinc/52/04/13/507520413.db2.gz	PROMKSSJWWAGTP-KBMXLJTQSA-N	-1	0	364.442	2.697	50	0		FFAARM
C[C@@H](C[N-]S(=O)(=O)c1c(F)cccc1F)N1CCc2ccccc2C1	ZINC000028322796	507719145	/nfs/dbraw/zinc/71/91/45/507719145.db2.gz	ODUZGIXZDKQIRS-ZDUSSCGKSA-N	-1	0	366.433	2.690	50	0		FFAARM
O=C([O-])c1cc(-c2cccc3c2OCC3)cc(S(=O)(=O)N2CCCC2)c1	ZINC000072133291	507754433	/nfs/dbraw/zinc/75/44/33/507754433.db2.gz	DOTWOAUGCDQZPG-UHFFFAOYSA-N	-1	0	373.430	2.771	50	0		FFAARM
CC(=O)N[C@@H](CC(=O)NC1(C(=O)[O-])CCCCC1)c1ccc(Cl)cc1	ZINC000072276991	507772588	/nfs/dbraw/zinc/77/25/88/507772588.db2.gz	WJEBYJXQTFTVQR-HNNXBMFYSA-N	-1	0	366.845	2.811	50	0		FFAARM
CC(C)c1ccn(C2(C(=O)[O-])CCN(Cc3nccn3C(C)C)CC2)n1	ZINC000072419489	507786859	/nfs/dbraw/zinc/78/68/59/507786859.db2.gz	RYBYSJFGDRQLSM-UHFFFAOYSA-N	-1	0	359.474	2.860	50	0		FFAARM
O=C([O-])CCc1cc2n(n1)CCCN(C(=O)C[C@H]1CCc3ccccc31)C2	ZINC000072429843	507789958	/nfs/dbraw/zinc/78/99/58/507789958.db2.gz	QJFVVUCIJHABRG-MRXNPFEDSA-N	-1	0	367.449	2.753	50	0		FFAARM
CC(C)c1cc(C(=O)N2CCC(Oc3ccccc3)(C(=O)[O-])CC2)[nH]n1	ZINC000072432531	507790648	/nfs/dbraw/zinc/79/06/48/507790648.db2.gz	FMJPIOSOIRVOSH-UHFFFAOYSA-N	-1	0	357.410	2.672	50	0		FFAARM
COc1ccc(F)c(F)c1CN1CCCn2nc(CCC(=O)[O-])cc2C1	ZINC000072454713	507793057	/nfs/dbraw/zinc/79/30/57/507793057.db2.gz	IIXUGHBTWJQCSU-UHFFFAOYSA-N	-1	0	365.380	2.593	50	0		FFAARM
COC(=O)c1[n-]c(=NC(=O)Cn2ccc3c2cccc3Cl)sc1C	ZINC000079480919	507966269	/nfs/dbraw/zinc/96/62/69/507966269.db2.gz	DOSOHOUGPUDZLA-UHFFFAOYSA-N	-1	0	363.826	3.485	50	0		FFAARM
COc1ccccc1[C@@H]1CN(C(=O)CCc2c(C)noc2C)C[C@H]1C(=O)[O-]	ZINC000091745941	508007584	/nfs/dbraw/zinc/00/75/84/508007584.db2.gz	DPWHHKIHNUNRAM-DLBZAZTESA-N	-1	0	372.421	2.559	50	0		FFAARM
CCc1nnc(-c2cc(S(=O)(=O)[N-]c3ccc(C(C)=O)cc3)c[nH]2)o1	ZINC000075427967	508106741	/nfs/dbraw/zinc/10/67/41/508106741.db2.gz	OAWURQXUQJWDOO-UHFFFAOYSA-N	-1	0	360.395	2.631	50	0		FFAARM
O=C([O-])c1ccc([C@H]2CCCN(C(=O)c3nnc4n3CCCCC4)C2)cc1	ZINC000095390261	508183384	/nfs/dbraw/zinc/18/33/84/508183384.db2.gz	JCHBOZBTOKCFJS-INIZCTEOSA-N	-1	0	368.437	2.723	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)c1cc(=O)[nH]c2ccccc21)c1ccc(F)cc1	ZINC000095498402	508189641	/nfs/dbraw/zinc/18/96/41/508189641.db2.gz	PJTXOYZKKOWICI-INIZCTEOSA-N	-1	0	354.337	2.613	50	0		FFAARM
COc1ccc(-c2cc(C(=O)N[C@H](C(=O)[O-])c3ccc(F)cc3)[nH]n2)cc1	ZINC000095524449	508195460	/nfs/dbraw/zinc/19/54/60/508195460.db2.gz	KIXOMVJNBVBSGU-KRWDZBQOSA-N	-1	0	369.352	2.780	50	0		FFAARM
COc1ccc(-c2cc(C(=O)N[C@@H](C(=O)[O-])c3ccc(F)cc3)[nH]n2)cc1	ZINC000095524450	508195694	/nfs/dbraw/zinc/19/56/94/508195694.db2.gz	KIXOMVJNBVBSGU-QGZVFWFLSA-N	-1	0	369.352	2.780	50	0		FFAARM
C[C@@]1(CNC(=O)c2nn(-c3ccccc3C(F)(F)F)cc2[O-])CCCO1	ZINC000153109176	508548572	/nfs/dbraw/zinc/54/85/72/508548572.db2.gz	OJTKKHKYMHWEQH-INIZCTEOSA-N	-1	0	369.343	2.896	50	0		FFAARM
O=C([O-])[C@H]1CCCN(C(=O)c2ccccc2C(=O)c2ccc(F)cc2)C1	ZINC000136145331	508674614	/nfs/dbraw/zinc/67/46/14/508674614.db2.gz	ZPNBSORIHXXCEK-AWEZNQCLSA-N	-1	0	355.365	2.994	50	0		FFAARM
COc1ccc2nc(C3CC3)cc(C(=O)N(C)C[C@@H](C)c3nnn[n-]3)c2c1	ZINC000124244981	508803008	/nfs/dbraw/zinc/80/30/08/508803008.db2.gz	VBZRJHOPKHLIKY-LLVKDONJSA-N	-1	0	366.425	2.510	50	0		FFAARM
O=C(c1ccc2[n-]c(=S)oc2c1)N1CCC([C@H](O)C(F)(F)F)CC1	ZINC000131468485	508935653	/nfs/dbraw/zinc/93/56/53/508935653.db2.gz	YEHWAJBRQAUWFN-LBPRGKRZSA-N	-1	0	360.357	2.892	50	0		FFAARM
Cc1ccc(OCc2cccc(C(=O)[N-]S(=O)(=O)C3CCCC3)c2)cn1	ZINC000151194760	508976377	/nfs/dbraw/zinc/97/63/77/508976377.db2.gz	CUFJXDAGIAPIEF-UHFFFAOYSA-N	-1	0	374.462	2.971	50	0		FFAARM
O=C([O-])CCC(=O)N1N=C(c2ccco2)C[C@H]1c1cnc2ccccc2n1	ZINC000225510254	509374629	/nfs/dbraw/zinc/37/46/29/509374629.db2.gz	WRACSHHHGATZRP-INIZCTEOSA-N	-1	0	364.361	2.765	50	0		FFAARM
CC1CCC(NC(=O)c2cc(N3CCCC3=O)ccc2F)(C(=O)[O-])CC1	ZINC000236814388	509508405	/nfs/dbraw/zinc/50/84/05/509508405.db2.gz	ABWVDXILOIRTIY-UHFFFAOYSA-N	-1	0	362.401	2.716	50	0		FFAARM
COc1ccc2nc(C3CC3)cc(C(=O)[N-]S(=O)(=O)CC3CCC3)c2c1	ZINC000164961365	509548189	/nfs/dbraw/zinc/54/81/89/509548189.db2.gz	DKRBFQCHTYCSJJ-UHFFFAOYSA-N	-1	0	374.462	2.981	50	0		FFAARM
COCCn1c(C)c(C)c2cc(C(=O)N3CCC(C(=O)[O-])CC3)ccc21	ZINC000237133376	509579840	/nfs/dbraw/zinc/57/98/40/509579840.db2.gz	JJNRDSILOJJKDG-UHFFFAOYSA-N	-1	0	358.438	2.841	50	0		FFAARM
C[S@](=O)C[C@@H](NC(=O)c1ccc2[n-]c(=S)oc2c1)c1ccccc1	ZINC000170649106	509698668	/nfs/dbraw/zinc/69/86/68/509698668.db2.gz	KWDZMZFXSKQPSO-SHACYNPGSA-N	-1	0	360.460	2.966	50	0		FFAARM
Cc1noc(C)c1COc1cccc(C(=O)N2CCC[C@H](C(=O)[O-])C2)c1	ZINC000237641034	509699436	/nfs/dbraw/zinc/69/94/36/509699436.db2.gz	RWQQZNUFYYIUNU-HNNXBMFYSA-N	-1	0	358.394	2.807	50	0		FFAARM
Cc1oc(C)c(S(=O)(=O)N[C@H]2CCC[C@@H](C(F)(F)F)C2)c1C(=O)[O-]	ZINC000237647206	509701821	/nfs/dbraw/zinc/70/18/21/509701821.db2.gz	LSGMSBXMNLNBCV-ZJUUUORDSA-N	-1	0	369.361	2.994	50	0		FFAARM
Cc1nc(-c2ccc(C(=O)N3[C@H](C(=O)[O-])C[C@@H]4CCCC[C@@H]43)cc2)n[nH]1	ZINC000237739051	509723366	/nfs/dbraw/zinc/72/33/66/509723366.db2.gz	SWSNDZJHLOZNPE-JYJNAYRXSA-N	-1	0	354.410	2.638	50	0		FFAARM
O=C([O-])[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1cc(N2CCCC2=O)ccc1F	ZINC000237981701	509790472	/nfs/dbraw/zinc/79/04/72/509790472.db2.gz	ITGQBULXBUWDHJ-ZLIFDBKOSA-N	-1	0	374.412	2.810	50	0		FFAARM
O=C([O-])[C@H]1CCCN(C(=O)c2cc3ccc(Br)cc3[nH]2)C1	ZINC000238078027	509816485	/nfs/dbraw/zinc/81/64/85/509816485.db2.gz	FHRAHYXPHOLHNI-JTQLQIEISA-N	-1	0	351.200	2.867	50	0		FFAARM
NS(=O)(=O)c1ccc(NN=Cc2cc(Cl)cc(Cl)c2[O-])cc1	ZINC000254861056	509911750	/nfs/dbraw/zinc/91/17/50/509911750.db2.gz	ZMTYLEAYFPPVGU-UHFFFAOYSA-N	-1	0	360.222	2.792	50	0		FFAARM
COc1cc(NC(=O)Cc2c(C)nn(C(F)F)c2C)ccc1C(=O)[O-]	ZINC000263077033	510549852	/nfs/dbraw/zinc/54/98/52/510549852.db2.gz	YTUZZRCFFKLGMD-UHFFFAOYSA-N	-1	0	353.325	2.783	50	0		FFAARM
COc1cccc([C@@H]2CCN2C(=O)NCCc2nc(C(=O)[O-])cs2)c1	ZINC000426535617	513972426	/nfs/dbraw/zinc/97/24/26/513972426.db2.gz	DYNZUHFGWZDSBA-AWEZNQCLSA-N	-1	0	361.423	2.549	50	0		FFAARM
Cc1nc(COc2ccccc2/C=C\C(=O)N2CC[C@H](C(=O)[O-])C2)cs1	ZINC000606441130	521068872	/nfs/dbraw/zinc/06/88/72/521068872.db2.gz	RTKZJQAFJPXUFJ-XHPSBEMXSA-N	-1	0	372.446	2.977	50	0		FFAARM
Cc1cc(C)c2nc(C3CC3)cc(C(=O)N3CCO[C@H](C(=O)[O-])C3)c2c1	ZINC000178281097	524352096	/nfs/dbraw/zinc/35/20/96/524352096.db2.gz	PACYRTAGDRZRIV-KRWDZBQOSA-N	-1	0	354.406	2.655	50	0		FFAARM
C[C@@H]1CCc2c(sc(NC(=O)[C@@H]3CC=CC[C@H]3C(=O)[O-])c2C(N)=O)C1	ZINC000239159646	524722698	/nfs/dbraw/zinc/72/26/98/524722698.db2.gz	MOAACRFRNIIRHU-GMTAPVOTSA-N	-1	0	362.451	2.577	50	0		FFAARM
CCC(NCc1ccco1)=C1C(=O)[N-]C(=O)N(c2ccc(Cl)cc2)C1=O	ZINC000020332119	535226819	/nfs/dbraw/zinc/22/68/19/535226819.db2.gz	BYCRLPYCYBBHKA-CCEZHUSRSA-N	-1	0	373.796	2.970	50	0		FFAARM
CCCc1cc(=O)n2nc(CNc3ccc(Br)cc3)[n-]c2n1	ZINC000101803320	570824145	/nfs/dbraw/zinc/82/41/45/570824145.db2.gz	HWHPFJTWYIDPNH-UHFFFAOYSA-N	-1	0	362.231	2.745	50	0		FFAARM
O=C(/N=c1\[n-]nc2ccccn21)c1ccccc1SC[C@@H]1CCCO1	ZINC000046083036	570924204	/nfs/dbraw/zinc/92/42/04/570924204.db2.gz	BUDRDISMYHVILD-ZDUSSCGKSA-N	-1	0	354.435	2.675	50	0		FFAARM
O=C([O-])C[C@H](NCc1ccco1)C(=O)Nc1nc(-c2ccccc2)cs1	ZINC000008771278	571132316	/nfs/dbraw/zinc/13/23/16/571132316.db2.gz	LPNJEDWBOQUBJM-AWEZNQCLSA-N	-1	0	371.418	2.975	50	0		FFAARM
Cc1cc(C(=O)NC[C@@H](CC(=O)[O-])c2ccc(Cl)cc2)c(=O)[nH]c1C	ZINC000095362987	728480357	/nfs/dbraw/zinc/48/03/57/728480357.db2.gz	JLEMRCOMIJTVCG-CYBMUJFWSA-N	-1	0	362.813	2.633	50	0		FFAARM
COc1ccc(S(=O)(=O)[N-]C(=O)/C=C(/C)c2ccncc2)c(C)c1C	ZINC000125715284	728686641	/nfs/dbraw/zinc/68/66/41/728686641.db2.gz	GAWZINJOOYZTRA-QXMHVHEDSA-N	-1	0	360.435	2.615	50	0		FFAARM
COc1ccc(-c2nsc(NC(=O)N[C@@H]3CC[C@H](C(=O)[O-])C3)n2)cc1	ZINC000647702945	730758765	/nfs/dbraw/zinc/75/87/65/730758765.db2.gz	BXUIOMJPCNXCHV-WDEREUQCSA-N	-1	0	362.411	2.589	50	0		FFAARM
Cc1coc(-c2ccc(C)c(S(=O)(=O)N3CCCC[C@@H]3C(=O)[O-])c2)n1	ZINC000656512830	731586613	/nfs/dbraw/zinc/58/66/13/731586613.db2.gz	SFDMGPKEFSVOCP-CQSZACIVSA-N	-1	0	364.423	2.586	50	0		FFAARM
COc1cc(OC)c(OC)cc1CNC(=O)CCc1ccccc1C(=O)[O-]	ZINC000262197112	967059693	/nfs/dbraw/zinc/05/96/93/967059693.db2.gz	RTQPMODIFPDPOB-UHFFFAOYSA-N	-1	0	373.405	2.660	50	0		FFAARM
CCN(C(=O)c1ccc(C(=O)[O-])cc1F)[C@@H]1CCN(c2ccccc2)C1=O	ZINC000262462431	973349048	/nfs/dbraw/zinc/34/90/48/973349048.db2.gz	VYKVRAHBIVZIRP-QGZVFWFLSA-N	-1	0	370.380	2.792	50	0		FFAARM
CCn1c(C)nc2cc(C(=O)NN=Cc3ccccc3C(=O)[O-])ccc21	ZINC000254420799	1014372203	/nfs/dbraw/zinc/37/22/03/1014372203.db2.gz	WSKRJRCILMOAGM-UHFFFAOYSA-N	-1	0	350.378	2.827	50	0		FFAARM
CC(C)c1noc([C@@H](C)NS(=O)(=O)c2cc(C(=O)[O-])ccc2Cl)n1	ZINC000822285058	998843464	/nfs/dbraw/zinc/84/34/64/998843464.db2.gz	NWKGAWRVLQCNTH-MRVPVSSYSA-N	-1	0	373.818	2.584	50	0		FFAARM
COc1ccc(C)cc1[C@@H](C(=O)[O-])N1CC[NH+](CCc2ccccc2)CC1	ZINC001506397872	1059489919	/nfs/dbraw/zinc/48/99/19/1059489919.db2.gz	FILXYWKMSIYVDG-NRFANRHFSA-N	-1	0	368.477	2.990	50	0		FFAARM
Cc1cccc([C@H](C(=O)[O-])N2CCN(CCc3ccccc3)C(=O)C2)c1	ZINC001506422622	1059511690	/nfs/dbraw/zinc/51/16/90/1059511690.db2.gz	ACXQNMKRXBKLBP-HXUWFJFHSA-N	-1	0	352.434	2.508	50	0		FFAARM
Cc1ccc(C(=O)Nc2ccc(S(=O)(=O)[N-]c3nccc(C)n3)cc2)o1	ZINC000000656512	219310662	/nfs/dbraw/zinc/31/06/62/219310662.db2.gz	VEDZRMLNIIKSBE-UHFFFAOYSA-N	-1	0	372.406	2.740	50	0		FFAARM
COc1ccc(OC)c([C@@H]2N[C@@H](C(=O)[O-])Cc3c4ccccc4[nH]c32)c1	ZINC000000754302	219318515	/nfs/dbraw/zinc/31/85/15/219318515.db2.gz	IQTPIYGSTAUKJL-APWZRJJASA-N	-1	0	352.390	2.873	50	0	biogenic	FFAARM
CCOC(=O)Cc1csc([N-]S(=O)(=O)c2ccc(Cl)cc2)n1	ZINC000000826222	219328275	/nfs/dbraw/zinc/32/82/75/219328275.db2.gz	IITATKCUYSUFMF-UHFFFAOYSA-N	-1	0	360.844	2.703	50	0		FFAARM
CCOC(=O)c1ccc([N-]S(=O)(=O)c2cc(OC)ccc2OC)cc1	ZINC000001141582	219379289	/nfs/dbraw/zinc/37/92/89/219379289.db2.gz	DSXGADJJNYHAGC-UHFFFAOYSA-N	-1	0	365.407	2.681	50	0		FFAARM
CC(=O)[N-]S(=O)(=O)c1ccc(NC(=O)C[C@H](C)c2ccccc2)cc1	ZINC000001151507	219381036	/nfs/dbraw/zinc/38/10/36/219381036.db2.gz	MFSDUWFVFGLXGX-ZDUSSCGKSA-N	-1	0	360.435	2.644	50	0		FFAARM
CCC[C@@H](NC(=O)[C@H](C)Oc1ccc2c(C)c(C)c(=O)oc2c1)C(=O)[O-]	ZINC000002148872	219429525	/nfs/dbraw/zinc/42/95/25/219429525.db2.gz	VLNIJXQNIVYZFO-SWLSCSKDSA-N	-1	0	361.394	2.547	50	0	biogenic	FFAARM
CC[C@@H](Cc1ccccc1Br)C(=O)N1CC[C@@H](C(=O)[O-])C1	ZINC000237036945	222904045	/nfs/dbraw/zinc/90/40/45/222904045.db2.gz	JFTXSXGVGIJUMI-WCQYABFASA-N	-1	0	354.244	2.951	50	0		FFAARM
Cc1nc(COc2cccc(/C=C/C(=O)N3CC[C@H](C(=O)[O-])C3)c2)cs1	ZINC000237758865	222911234	/nfs/dbraw/zinc/91/12/34/222911234.db2.gz	VAPRWQWJYSLSOV-NFAHFFEMSA-N	-1	0	372.446	2.977	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)[C@H]1CC(=O)Nc2ccccc21)c1ccc(F)cc1	ZINC000237963171	222912621	/nfs/dbraw/zinc/91/26/21/222912621.db2.gz	RFBAPSSIFUKBQD-HOCLYGCPSA-N	-1	0	356.353	2.584	50	0		FFAARM
Cc1c(C(=O)N2CCC[C@@H]2C(=O)[O-])cnn1-c1cccc(C(F)(F)F)c1	ZINC000237749274	222909562	/nfs/dbraw/zinc/90/95/62/222909562.db2.gz	PXANDBHKTJCBCI-CQSZACIVSA-N	-1	0	367.327	2.889	50	0		FFAARM
Cc1coc2cc3oc(=O)c(CC(=O)N[C@@H](C(=O)[O-])C(C)C)c(C)c3cc12	ZINC000011865646	219938236	/nfs/dbraw/zinc/93/82/36/219938236.db2.gz	XGBGZWIFZKNMDM-GOSISDBHSA-N	-1	0	371.389	2.924	50	0		FFAARM
Cc1ccc(CSCCNS(=O)(=O)c2ccsc2C(=O)[O-])cc1	ZINC000012881717	220038925	/nfs/dbraw/zinc/03/89/25/220038925.db2.gz	UJXDXQCCRPQRHX-UHFFFAOYSA-N	-1	0	371.505	2.966	50	0		FFAARM
COc1ccc(C(=O)[O-])cc1S(=O)(=O)N[C@@H](C)c1ccc(F)cc1	ZINC000013069914	220056155	/nfs/dbraw/zinc/05/61/55/220056155.db2.gz	ZNXYLZHEXGNNFL-JTQLQIEISA-N	-1	0	353.371	2.572	50	0		FFAARM
Cc1ccccc1CNC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)[O-]	ZINC000013237097	220062252	/nfs/dbraw/zinc/06/22/52/220062252.db2.gz	ZZGZVCOWJDRVRD-SFHVURJKSA-N	-1	0	351.406	2.971	50	0		FFAARM
COC(=O)c1cc(-c2ccc(OC)cc2)nc2nc(SC)[nH]c(=O)c21	ZINC000013120441	220059151	/nfs/dbraw/zinc/05/91/51/220059151.db2.gz	FUHOQWANNLBPTQ-UHFFFAOYSA-N	-1	0	357.391	2.502	50	0		FFAARM
COc1ccc([C@H](CC(=O)[O-])NC(=O)Cc2ccc3c(c2)CCO3)cc1	ZINC000013427024	220067192	/nfs/dbraw/zinc/06/71/92/220067192.db2.gz	RCCTYPVZGQCXDI-KRWDZBQOSA-N	-1	0	355.390	2.505	50	0		FFAARM
COc1ccccc1[N-]S(=O)(=O)c1cc(-c2ccc(=O)[nH]n2)ccc1C	ZINC000015669270	220158189	/nfs/dbraw/zinc/15/81/89/220158189.db2.gz	VOYRWYJSAMXREG-UHFFFAOYSA-N	-1	0	371.418	2.555	50	0		FFAARM
O=C1CCSc2ccc(S(=O)(=O)[N-]c3ccc(Cl)cn3)cc2N1	ZINC000015728378	220162097	/nfs/dbraw/zinc/16/20/97/220162097.db2.gz	GOMRVTHAPYDEAB-UHFFFAOYSA-N	-1	0	369.855	2.970	50	0		FFAARM
O=C(Nc1cc(=O)nc2[n-]c(CCc3ccccc3)nn21)c1cccs1	ZINC000016956968	220199013	/nfs/dbraw/zinc/19/90/13/220199013.db2.gz	IDKPWJFHGWBUJE-UHFFFAOYSA-N	-1	0	365.418	2.929	50	0		FFAARM
COCCCn1c(=O)c2ccc(C(=O)Nc3ccncc3)cc2[n-]c1=S	ZINC000017586065	220217414	/nfs/dbraw/zinc/21/74/14/220217414.db2.gz	PGONDTNYOUPZAF-UHFFFAOYSA-N	-1	0	370.434	2.743	50	0		FFAARM
CCc1ccccc1[N-]S(=O)(=O)c1cc(Br)cnc1N	ZINC000020467576	220327454	/nfs/dbraw/zinc/32/74/54/220327454.db2.gz	KABWXHMAEFFXJN-UHFFFAOYSA-N	-1	0	356.245	2.790	50	0		FFAARM
COc1cccc(-c2nc(CC(=O)N[C@@H](CC(C)C)C(=O)[O-])cs2)c1	ZINC000020722778	220339318	/nfs/dbraw/zinc/33/93/18/220339318.db2.gz	LJEMHVBPFIKAKI-HNNXBMFYSA-N	-1	0	362.451	2.977	50	0		FFAARM
COc1cccc([N-]S(=O)(=O)c2cc(-c3noc(C)n3)cs2)c1	ZINC000021701598	220363195	/nfs/dbraw/zinc/36/31/95/220363195.db2.gz	FZYCDZSHJBYKSN-UHFFFAOYSA-N	-1	0	351.409	2.916	50	0		FFAARM
O=C1OCCN1c1cccc([N-]S(=O)(=O)c2ccc(F)c(F)c2F)c1	ZINC000031720045	220644230	/nfs/dbraw/zinc/64/42/30/220644230.db2.gz	DWQFFERPZNEUIS-UHFFFAOYSA-N	-1	0	372.324	2.861	50	0		FFAARM
CCc1ccc(O)c(C(=O)N2CCC[C@@H](C(=O)Nc3nccs3)C2)c1	ZINC000058228503	221110453	/nfs/dbraw/zinc/11/04/53/221110453.db2.gz	SBJGHAPSERHPMA-CYBMUJFWSA-N	-1	0	359.451	2.902	50	0		FFAARM
CCOc1ccccc1[N-]S(=O)(=O)c1ccc2c(c1)sc(=O)n2C	ZINC000064947093	221157753	/nfs/dbraw/zinc/15/77/53/221157753.db2.gz	SPYAQSARLPZFGN-UHFFFAOYSA-N	-1	0	364.448	2.800	50	0		FFAARM
COCc1nc(C(=O)[N-]S(=O)(=O)c2c(C)c(C)cc(C)c2C)cs1	ZINC000065042120	221165615	/nfs/dbraw/zinc/16/56/15/221165615.db2.gz	FQZITGOZKMBWSE-UHFFFAOYSA-N	-1	0	368.480	2.642	50	0		FFAARM
C[C@@H](NC(=O)CSc1nc2[nH]c(=O)cc([O-])c2s1)c1ccccc1	ZINC000065362042	221202077	/nfs/dbraw/zinc/20/20/77/221202077.db2.gz	BNZQAEVLJBQKMH-SECBINFHSA-N	-1	0	361.448	2.660	50	0		FFAARM
Cc1cc(-n2c(SCC(=O)[O-])nnc2-c2ccc(Cl)s2)n(C)n1	ZINC000065528605	221231002	/nfs/dbraw/zinc/23/10/02/221231002.db2.gz	ILEYFSOZURRWFD-UHFFFAOYSA-N	-1	0	369.859	2.868	50	0		FFAARM
CCOc1ccc(S(=O)(=O)N(C)c2ccc(F)cc2)cc1C(=O)[O-]	ZINC000065667746	221235740	/nfs/dbraw/zinc/23/57/40/221235740.db2.gz	PBNDQHOOKYBXIU-UHFFFAOYSA-N	-1	0	353.371	2.748	50	0		FFAARM
CCn1nc(C(=O)[O-])c2c1CCN(C(=O)CSc1ccccc1C)C2	ZINC000067946906	221308008	/nfs/dbraw/zinc/30/80/08/221308008.db2.gz	VRESMONCWBERFA-UHFFFAOYSA-N	-1	0	359.451	2.587	50	0		FFAARM
CC1(C)[C@H](C(=O)[O-])[C@@H]1C(=O)Nc1nc(-c2nc3ccccc3[nH]2)cs1	ZINC000071282989	221337972	/nfs/dbraw/zinc/33/79/72/221337972.db2.gz	HKTAXUCDVCQXCX-NEPJUHHUSA-N	-1	0	356.407	2.982	50	0		FFAARM
COc1ccccc1-c1cc(C(=O)[O-])cc(S(=O)(=O)N2CCCC2)c1	ZINC000071638840	221353579	/nfs/dbraw/zinc/35/35/79/221353579.db2.gz	AGYCFNUXWUPMCV-UHFFFAOYSA-N	-1	0	361.419	2.845	50	0		FFAARM
CCc1ccc(N2C[C@@H](C(=O)NC3(C(=O)[O-])CCCCC3)CC2=O)cc1	ZINC000071892824	221386099	/nfs/dbraw/zinc/38/60/99/221386099.db2.gz	FQHQAXWBRRUYAJ-HNNXBMFYSA-N	-1	0	358.438	2.506	50	0		FFAARM
Cc1ccc(CN2CCN(c3ncc(C(=O)[O-])cc3Cl)CC2=O)cc1	ZINC000095510639	132213277	/nfs/dbraw/zinc/21/32/77/132213277.db2.gz	VFRXYZYOQSUMCT-UHFFFAOYSA-N	-1	0	359.813	2.590	50	0		FFAARM
O=C([O-])[C@H]1CCCC[C@@H]1C(=O)N1CCN(c2ccc(Cl)cc2)CC1	ZINC000004638506	132297706	/nfs/dbraw/zinc/29/77/06/132297706.db2.gz	PRUPQCIQHAZBHA-HOTGVXAUSA-N	-1	0	350.846	2.880	50	0		FFAARM
CN1C(=O)CCc2cc([N-]S(=O)(=O)c3ccc(F)cc3F)ccc21	ZINC000009828258	132381481	/nfs/dbraw/zinc/38/14/81/132381481.db2.gz	BAVDMDLTMZJAIQ-UHFFFAOYSA-N	-1	0	352.362	2.675	50	0		FFAARM
C[C@@](CC(=O)Nc1cccc(N2CCOCC2)c1)(C(=O)[O-])c1ccccc1	ZINC000055151369	136126006	/nfs/dbraw/zinc/12/60/06/136126006.db2.gz	QXLVUPKPLFEPPY-NRFANRHFSA-N	-1	0	368.433	2.894	50	0		FFAARM
Cc1nc([C@H]2CCCN(c3ccc(C(=O)[O-])cn3)C2)cc(N2CCCC2)n1	ZINC000072475866	136149227	/nfs/dbraw/zinc/14/92/27/136149227.db2.gz	QVCFGGGWIBYAOB-INIZCTEOSA-N	-1	0	367.453	2.862	50	0		FFAARM
O=C([O-])CCc1cc2n(n1)CCCN(C(=O)Nc1ccc(F)c(F)c1)C2	ZINC000072479121	221553853	/nfs/dbraw/zinc/55/38/53/221553853.db2.gz	HVFKVLJVFFCMEB-UHFFFAOYSA-N	-1	0	364.352	2.616	50	0		FFAARM
Cc1nc(C)c(CC(=O)N2C[C@@H](c3cccc(F)c3)[C@H](C(=O)[O-])C2)s1	ZINC000091737520	221790985	/nfs/dbraw/zinc/79/09/85/221790985.db2.gz	UIDLCUALDWMPEN-LSDHHAIUSA-N	-1	0	362.426	2.768	50	0		FFAARM
C[C@H](NC(=O)c1nn(-c2ccccc2C(F)(F)F)cc1[O-])[C@H]1CCCO1	ZINC000095356834	221856943	/nfs/dbraw/zinc/85/69/43/221856943.db2.gz	RDTARVLMQGKLPT-IINYFYTJSA-N	-1	0	369.343	2.894	50	0		FFAARM
O=C([O-])c1cc(S(=O)(=O)NC2CCC(C(F)(F)F)CC2)ccc1F	ZINC000095947634	221978222	/nfs/dbraw/zinc/97/82/22/221978222.db2.gz	FOVHRPPSIUDRDV-UHFFFAOYSA-N	-1	0	369.336	2.923	50	0		FFAARM
CC(=O)Nc1cc(C(=O)N[C@H](C(=O)[O-])c2ccccc2Cl)ccc1F	ZINC000095989729	221986878	/nfs/dbraw/zinc/98/68/78/221986878.db2.gz	BYAQIWFZILBDPS-HNNXBMFYSA-N	-1	0	364.760	2.993	50	0		FFAARM
C[C@H](Oc1cccc(/C=C2/SC(N3CCCCC3)=NC2=O)c1)C(=O)[O-]	ZINC000096291704	222111821	/nfs/dbraw/zinc/11/18/21/222111821.db2.gz	HXSVHMKBHADUMG-YGRGUWMTSA-N	-1	0	360.435	2.995	50	0		FFAARM
C[C@@H](Oc1cccc(/C=C2/SC(N3CCCCC3)=NC2=O)c1)C(=O)[O-]	ZINC000096291705	222112287	/nfs/dbraw/zinc/11/22/87/222112287.db2.gz	HXSVHMKBHADUMG-PKVLTRFUSA-N	-1	0	360.435	2.995	50	0		FFAARM
COc1cc2nc(S[C@@H](C(=O)[O-])c3ccccc3)[nH]c(=O)c2cc1OC	ZINC000096309047	222113272	/nfs/dbraw/zinc/11/32/72/222113272.db2.gz	RYGPDXHAAHBAJE-OAHLLOKOSA-N	-1	0	372.402	2.858	50	0		FFAARM
Cc1cccc(NC(=O)c2c[nH]nc2S(=O)(=O)[N-]c2ccc(F)cc2)c1	ZINC000096361181	222117068	/nfs/dbraw/zinc/11/70/68/222117068.db2.gz	UQFGKAIMBQRTHQ-UHFFFAOYSA-N	-1	0	374.397	2.910	50	0		FFAARM
COc1ccc(-n2c(=O)c3[n-][nH]n(-c4ccc(F)c(Cl)c4)c=3c2=O)cc1	ZINC000097076902	222156699	/nfs/dbraw/zinc/15/66/99/222156699.db2.gz	JLCQVCJVEGUNCQ-CABCVRRESA-N	-1	0	374.759	2.986	50	0		FFAARM
O=C([O-])/C=C\c1ccc(S(=O)(=O)Nc2ccc(-n3cccn3)cc2)cc1	ZINC000097079620	222156995	/nfs/dbraw/zinc/15/69/95/222156995.db2.gz	MPPMIDHKJFFHGI-WCIBSUBMSA-N	-1	0	369.402	2.771	50	0		FFAARM
CCN(CCc1nc2cc(OC)ccc2[nH]1)C(=O)c1cccc(C(=O)[O-])c1	ZINC000097521968	222188979	/nfs/dbraw/zinc/18/89/79/222188979.db2.gz	WRCURZUZNNMORG-UHFFFAOYSA-N	-1	0	367.405	2.975	50	0		FFAARM
CC(=O)c1[n-]n(-c2ccc(C)cc2)c2c(O)n(-c3ccc(C)cc3)c(=O)c1-2	ZINC000100563730	222247086	/nfs/dbraw/zinc/24/70/86/222247086.db2.gz	DFPRLVSTULKADY-IEBWSBKVSA-N	-1	0	361.401	2.627	50	0		FFAARM
Cc1ccc(C)c(Cn2[nH][n-]c3c(=O)n(-c4ccc(F)cc4)c(=O)c2=3)c1	ZINC000101167236	222265014	/nfs/dbraw/zinc/26/50/14/222265014.db2.gz	XUJUBVXBJAEIIF-IRXDYDNUSA-N	-1	0	352.369	2.936	50	0		FFAARM
COc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccc(Cl)cc4)c=3c2=O)cc1	ZINC000101167312	222265524	/nfs/dbraw/zinc/26/55/24/222265524.db2.gz	IQHMSWNFNCCDSA-HZPDHXFCSA-N	-1	0	370.796	2.842	50	0		FFAARM
C[C@@H](CCc1ccccc1)NC(=O)c1ccc2c(c1)[n-]c(=S)n(C)c2=O	ZINC000102176348	222290877	/nfs/dbraw/zinc/29/08/77/222290877.db2.gz	AGONZKHSEBBNLW-ZDUSSCGKSA-N	-1	0	367.474	2.973	50	0		FFAARM
Cn1c(=O)c2ccc(C(=O)NCc3cc4ccccc4[nH]3)cc2[n-]c1=S	ZINC000104044235	222348903	/nfs/dbraw/zinc/34/89/03/222348903.db2.gz	GARVGWYBYPATLN-UHFFFAOYSA-N	-1	0	364.430	2.634	50	0		FFAARM
O=C([O-])[C@@H]1CC=CC[C@@H]1C(=O)Nc1ccc(I)cc1	ZINC000004610425	263335214	/nfs/dbraw/zinc/33/52/14/263335214.db2.gz	CNBCFMDYNFYBIT-NWDGAFQWSA-N	-1	0	371.174	2.897	50	0		FFAARM
O=S(=O)([N-]c1ncn(Cc2ccccc2F)n1)c1ccc(Cl)cc1	ZINC000002779159	506291610	/nfs/dbraw/zinc/29/16/10/506291610.db2.gz	SNSJGYKTSXYYCY-UHFFFAOYSA-N	-1	0	366.805	2.920	50	0		FFAARM
CCn1cc(S(=O)(=O)[N-]c2c(C)nn(Cc3ccccc3C)c2C)cn1	ZINC000002804633	506295051	/nfs/dbraw/zinc/29/50/51/506295051.db2.gz	KIIDJCXABJCTDN-UHFFFAOYSA-N	-1	0	373.482	2.874	50	0		FFAARM
O=C(CCCCn1c(=S)[n-]c2ccsc2c1=O)NC[C@H]1CCCO1	ZINC000002925495	506302310	/nfs/dbraw/zinc/30/23/10/506302310.db2.gz	USKWRJSTEMCUTA-LLVKDONJSA-N	-1	0	367.496	2.586	50	0		FFAARM
C[C@H](Sc1nc(CC(=O)[O-])cs1)C(=O)Nc1cccnc1Cl	ZINC000032885509	506304612	/nfs/dbraw/zinc/30/46/12/506304612.db2.gz	YYRVERINJYYYOZ-ZETCQYMHSA-N	-1	0	357.844	2.938	50	0		FFAARM
C[C@@H](Sc1nc(CC(=O)[O-])cs1)C(=O)Nc1cccnc1Cl	ZINC000032885508	506305854	/nfs/dbraw/zinc/30/58/54/506305854.db2.gz	YYRVERINJYYYOZ-SSDOTTSWSA-N	-1	0	357.844	2.938	50	0		FFAARM
CC(=O)Nc1ccc(N2CCN(c3ccccc3F)CC2)c(C(=O)[O-])c1	ZINC000033078667	506332837	/nfs/dbraw/zinc/33/28/37/506332837.db2.gz	KFRJYPUGNRYSDP-UHFFFAOYSA-N	-1	0	357.385	2.809	50	0		FFAARM
O=C([O-])[C@H](Cc1ccccc1)NS(=O)(=O)c1cccc(C(F)(F)F)c1	ZINC000003640619	506347379	/nfs/dbraw/zinc/34/73/79/506347379.db2.gz	JFDJLMGVJXHLOF-AWEZNQCLSA-N	-1	0	373.352	2.680	50	0		FFAARM
O=C([O-])c1cc(S(=O)(=O)NCc2ccco2)c(Cl)cc1Cl	ZINC000003884926	506352165	/nfs/dbraw/zinc/35/21/65/506352165.db2.gz	LTLCPKPWNLFQRV-UHFFFAOYSA-N	-1	0	350.179	2.763	50	0		FFAARM
Cc1nn2c([n-]1)nc(C)c(NC(=O)Nc1ccc(F)c(Cl)c1)c2=O	ZINC000033266177	506353627	/nfs/dbraw/zinc/35/36/27/506353627.db2.gz	MHRQFQQNFYEXSN-UHFFFAOYSA-N	-1	0	350.741	2.883	50	0		FFAARM
O=C([O-])[C@@H]1Sc2[nH]c(=O)sc2[C@@H]2c3cc(Cl)ccc3OC(=O)[C@@H]12	ZINC000004597842	506384586	/nfs/dbraw/zinc/38/45/86/506384586.db2.gz	GLRLETCXFWLLIY-NQMVMOMDSA-N	-1	0	369.807	2.728	50	0		FFAARM
CCc1nc2sc([C@H](c3cccs3)N3CCOCC3)c([O-])n2n1	ZINC000004584942	506385304	/nfs/dbraw/zinc/38/53/04/506385304.db2.gz	NMAABRBUKWUVCF-LBPRGKRZSA-N	-1	0	350.469	2.542	50	0		FFAARM
COc1ccc2c(c1)c([C@H](C(=O)[O-])[N@H+]1C[C@H](C)C[C@H](C)C1)cn2CC(=O)[O-]	ZINC000036364797	506402619	/nfs/dbraw/zinc/40/26/19/506402619.db2.gz	QUFIIVDVAHUQMH-QHRIQVFBSA-N	-1	0	374.437	2.838	50	0		FFAARM
CC(=O)c1cn(CC(=O)N[C@@H](Cc2ccccc2)C(=O)[O-])c2ccccc12	ZINC000036369821	506404317	/nfs/dbraw/zinc/40/43/17/506404317.db2.gz	LWMVLYKZVQOGNL-SFHVURJKSA-N	-1	0	364.401	2.656	50	0	biogenic	FFAARM
CCOc1ccccc1-n1nnc(C(=O)Nc2ccc(C(=O)[O-])cc2)c1C	ZINC000004938503	506407789	/nfs/dbraw/zinc/40/77/89/506407789.db2.gz	XVBFRYFMOFYFQL-UHFFFAOYSA-N	-1	0	366.377	2.925	50	0		FFAARM
O=S(=O)([N-]c1ccc(-c2ccc3nncn3n2)cc1)c1ccccc1F	ZINC000005150822	506424702	/nfs/dbraw/zinc/42/47/02/506424702.db2.gz	DRJOTILBRDMNLY-UHFFFAOYSA-N	-1	0	369.381	2.731	50	0		FFAARM
COc1ccccc1C[C@@H](C(=O)Nc1ccc(C)cc1C)c1nnn[n-]1	ZINC000005489132	506445892	/nfs/dbraw/zinc/44/58/92/506445892.db2.gz	HXXBQDGYZYCCTN-OAHLLOKOSA-N	-1	0	351.410	2.790	50	0		FFAARM
Cc1ccc(C(=O)[C@H](C)OC(=O)c2ccccc2[N-]S(C)(=O)=O)cc1	ZINC000005574128	506449986	/nfs/dbraw/zinc/44/99/86/506449986.db2.gz	ANEAMSJGPDBRNQ-ZDUSSCGKSA-N	-1	0	361.419	2.795	50	0		FFAARM
COc1cc(/C=C2\N=C(c3ccccc3)OC2=O)ccc1OCC(=O)[O-]	ZINC000006005076	506464962	/nfs/dbraw/zinc/46/49/62/506464962.db2.gz	IEZGRTNVIQKOBB-ZROIWOOFSA-N	-1	0	353.330	2.503	50	0		FFAARM
Cc1cc(=O)[nH]c(-c2cccc(NC(=O)Cc3ccccc3C(=O)[O-])c2)n1	ZINC000040158794	506478025	/nfs/dbraw/zinc/47/80/25/506478025.db2.gz	CLERQGRRRJXMND-UHFFFAOYSA-N	-1	0	363.373	2.625	50	0		FFAARM
O=C([O-])C1CCN(C(=O)Cn2ccc3ccc(Br)cc32)CC1	ZINC000040266217	506479147	/nfs/dbraw/zinc/47/91/47/506479147.db2.gz	IJGJIAPBOBUZNC-UHFFFAOYSA-N	-1	0	365.227	2.727	50	0		FFAARM
C[C@H](NC(=O)Cn1ccc2ccc(OCc3ccccc3)cc21)C(=O)[O-]	ZINC000040284530	506479386	/nfs/dbraw/zinc/47/93/86/506479386.db2.gz	JLVXZZQBQAVEQM-AWEZNQCLSA-N	-1	0	352.390	2.810	50	0		FFAARM
Cc1ccc(CNC(=O)CCCC2=Nc3ccccc3S(=O)(=O)[N-]2)cc1	ZINC000006546411	506488024	/nfs/dbraw/zinc/48/80/24/506488024.db2.gz	PATKFTIHJJIZJM-UHFFFAOYSA-N	-1	0	371.462	2.804	50	0		FFAARM
O=C([O-])C[C@H](NC1=NS(=O)(=O)c2ccccc21)c1ccc(Cl)cc1	ZINC000006787264	506507548	/nfs/dbraw/zinc/50/75/48/506507548.db2.gz	YMINENMWBIFFFZ-ZDUSSCGKSA-N	-1	0	364.810	2.595	50	0		FFAARM
O=C([O-])[C@H]1C[C@H]1C(=O)Nc1ccc(C(O)(C(F)(F)F)C(F)(F)F)cc1	ZINC000006863208	506512491	/nfs/dbraw/zinc/51/24/91/506512491.db2.gz	QCBAODFXUVDXOG-BDAKNGLRSA-N	-1	0	371.233	2.658	50	0		FFAARM
CCOC(=O)c1c(C)n(C)c(C)c1S(=O)(=O)[N-]c1ccccc1OC	ZINC000006887616	506513384	/nfs/dbraw/zinc/51/33/84/506513384.db2.gz	MPKRAGKRWZPOKD-UHFFFAOYSA-N	-1	0	366.439	2.628	50	0		FFAARM
COc1ccc(C(=O)Nc2cc3c(cc2C(=O)[O-])OCCCO3)c(OC)c1	ZINC000006936838	506519390	/nfs/dbraw/zinc/51/93/90/506519390.db2.gz	RDFZENTXYRTIEB-UHFFFAOYSA-N	-1	0	373.361	2.816	50	0		FFAARM
Cc1ccc(Sc2ccc(S(=O)(=O)NCC(=O)[O-])cc2)cc1C	ZINC000006941396	506519618	/nfs/dbraw/zinc/51/96/18/506519618.db2.gz	DCJKHLWKZVBUFU-UHFFFAOYSA-N	-1	0	351.449	2.818	50	0		FFAARM
O=C(NC1CC1)c1cccc([N-]S(=O)(=O)c2c(F)cccc2F)c1	ZINC000007325541	506552105	/nfs/dbraw/zinc/55/21/05/506552105.db2.gz	DBWDBEOHBDZYOX-UHFFFAOYSA-N	-1	0	352.362	2.658	50	0		FFAARM
CC1(C)COc2ccc([N-]S(=O)(=O)c3ccccc3F)cc2NC1=O	ZINC000009173227	506685004	/nfs/dbraw/zinc/68/50/04/506685004.db2.gz	QBGHIYOBBRWMGN-UHFFFAOYSA-N	-1	0	364.398	2.984	50	0		FFAARM
COc1cc2[nH]c(=O)c(C(=O)Nc3ccc(F)cc3)c([O-])c2cc1OC	ZINC000009332343	506691201	/nfs/dbraw/zinc/69/12/01/506691201.db2.gz	MEDOLQANOCIPLF-UHFFFAOYSA-N	-1	0	358.325	2.642	50	0		FFAARM
CC(=O)Nc1cc(C(=O)COC(=O)c2ccc3c(c2)CCC3)ccc1[O-]	ZINC000009479504	506699683	/nfs/dbraw/zinc/69/96/83/506699683.db2.gz	HGWWODGCWSPLPB-UHFFFAOYSA-N	-1	0	353.374	2.879	50	0		FFAARM
CCC1C(=O)N=C(S[C@@H](C)C(=O)Nc2ccc(Cl)cc2)N=C1[O-]	ZINC000010059409	506725120	/nfs/dbraw/zinc/72/51/20/506725120.db2.gz	PJQUSERPDJDJRU-QMMMGPOBSA-N	-1	0	353.831	2.811	50	0		FFAARM
O=C([N-]n1cnc2c(cnn2-c2ccccc2)c1=O)c1cc2ccccc2o1	ZINC000010251331	506733864	/nfs/dbraw/zinc/73/38/64/506733864.db2.gz	ALRLPFCYEJXXNI-UHFFFAOYSA-N	-1	0	371.356	2.712	50	0		FFAARM
CC(=O)[C@@H]1[C@@H](c2ccc(C(F)(F)F)cc2)NC(=O)N[C@@]1(O)C(F)(F)F	ZINC000012377539	506855441	/nfs/dbraw/zinc/85/54/41/506855441.db2.gz	XTKAMUGCTADIQP-FOGDFJRCSA-N	-1	0	370.249	2.515	50	0		FFAARM
CCOC(=O)N1CCN([C@@H](C(=O)[O-])c2c[nH]c3ccc(Cl)cc32)CC1	ZINC000012408940	506860268	/nfs/dbraw/zinc/86/02/68/506860268.db2.gz	SKTXPNPLTCLDFJ-OAHLLOKOSA-N	-1	0	365.817	2.721	50	0		FFAARM
CCS(=O)(=O)c1ccc([O-])c(NC(=O)c2nccc3ccccc32)c1	ZINC000060201060	507519115	/nfs/dbraw/zinc/51/91/15/507519115.db2.gz	NGGSQUNPWZTOKQ-UHFFFAOYSA-N	-1	0	356.403	2.986	50	0		FFAARM
CCS(=O)(=O)c1ccc([O-])c(NC(=O)c2ccc(C(F)(F)F)nc2)c1	ZINC000026346502	507581099	/nfs/dbraw/zinc/58/10/99/507581099.db2.gz	LZVOONPURVURRT-UHFFFAOYSA-N	-1	0	374.340	2.852	50	0		FFAARM
O=C([O-])c1cccc(NC(=O)CN2C(=O)S/C(=C/c3ccco3)C2=O)c1	ZINC000028296876	507719536	/nfs/dbraw/zinc/71/95/36/507719536.db2.gz	YMDKMJHDSYRNNC-MDWZMJQESA-N	-1	0	372.358	2.653	50	0		FFAARM
CCOC(=O)c1ccc(S(=O)(=O)[N-]c2cnc3onc(C)c3c2)cc1	ZINC000072301073	507773555	/nfs/dbraw/zinc/77/35/55/507773555.db2.gz	ZKYMIQIIWACVEN-UHFFFAOYSA-N	-1	0	361.379	2.509	50	0		FFAARM
CCOc1ccc(C(=O)N2CCC(Oc3ccccc3)(C(=O)[O-])CC2)o1	ZINC000072408729	507785074	/nfs/dbraw/zinc/78/50/74/507785074.db2.gz	SEIKRSLVXOUTLT-UHFFFAOYSA-N	-1	0	359.378	2.817	50	0		FFAARM
Cc1ccccc1OC1(C(=O)[O-])CCN(C(=O)[C@H](C)n2cccc2)CC1	ZINC000072419847	507787213	/nfs/dbraw/zinc/78/72/13/507787213.db2.gz	WGEUQGLHJPIMDC-INIZCTEOSA-N	-1	0	356.422	2.882	50	0		FFAARM
C[C@H]1CCc2sc(C(=O)N3CCn4nc(CCC(=O)[O-])cc4C3)cc2C1	ZINC000072462604	507793898	/nfs/dbraw/zinc/79/38/98/507793898.db2.gz	AKNPHVKPPATWPS-LBPRGKRZSA-N	-1	0	373.478	2.743	50	0		FFAARM
CCOc1ccccc1NC(=O)N1CCCn2nc(CCC(=O)[O-])cc2C1	ZINC000072478637	507797102	/nfs/dbraw/zinc/79/71/02/507797102.db2.gz	BNRQOPJEUYJMFH-UHFFFAOYSA-N	-1	0	372.425	2.737	50	0		FFAARM
CCc1cnc(C)nc1N1C[C@@H](c2cccc(OC)c2OC)[C@H](C(=O)[O-])C1	ZINC000091255388	507976456	/nfs/dbraw/zinc/97/64/56/507976456.db2.gz	RGAAKOZRRJLNOY-JKSUJKDBSA-N	-1	0	371.437	2.669	50	0		FFAARM
CC[C@@]1(C(=O)[O-])CCCN(C(=O)c2c(Cl)c(C(F)(F)F)nn2C)C1	ZINC000091602567	507995894	/nfs/dbraw/zinc/99/58/94/507995894.db2.gz	PMSFOTAWXLMTHA-CYBMUJFWSA-N	-1	0	367.755	2.809	50	0		FFAARM
O=S(=O)([N-]c1ccnc2ccncc12)c1ccc2c(c1)OCCCO2	ZINC000075109682	508083745	/nfs/dbraw/zinc/08/37/45/508083745.db2.gz	OZFOZCULEHEVGZ-UHFFFAOYSA-N	-1	0	357.391	2.592	50	0		FFAARM
CCSc1nnc([N-]C(=O)c2coc(NC(=O)C3CCC3)n2)s1	ZINC000075172297	508087485	/nfs/dbraw/zinc/08/74/85/508087485.db2.gz	WMNKQVRWZFTISO-UHFFFAOYSA-N	-1	0	353.429	2.629	50	0		FFAARM
O=C([O-])C1(NC(=O)[C@@H]2CC(=O)N(c3ccccc3Cl)C2)CCCCC1	ZINC000095348427	508174028	/nfs/dbraw/zinc/17/40/28/508174028.db2.gz	IKYWDAWBOTVEHB-GFCCVEGCSA-N	-1	0	364.829	2.597	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)c1cccc(-n2cccn2)c1)c1ccc(F)cc1	ZINC000095362409	508175820	/nfs/dbraw/zinc/17/58/20/508175820.db2.gz	SPHPNZHCMUGFEV-KRWDZBQOSA-N	-1	0	353.353	2.957	50	0		FFAARM
COc1ccc([C@H](C(=O)[O-])N2CCN(Cc3ccsc3)CC2)cc1F	ZINC000095383540	508182284	/nfs/dbraw/zinc/18/22/84/508182284.db2.gz	NBDKBRVRWLDVGK-QGZVFWFLSA-N	-1	0	364.442	2.839	50	0		FFAARM
Cc1ccc(Cl)c([C@@H](C(=O)[O-])N2CCN(Cc3cccnc3)CC2)c1	ZINC000095389404	508183546	/nfs/dbraw/zinc/18/35/46/508183546.db2.gz	KCCWTQAMRCAPHU-SFHVURJKSA-N	-1	0	359.857	2.987	50	0		FFAARM
CCC[C@H](NC(=O)CSCc1nc2ccccc2s1)c1nnn[n-]1	ZINC000095411829	508184543	/nfs/dbraw/zinc/18/45/43/508184543.db2.gz	ZBOZFWRQTLPQKH-NSHDSACASA-N	-1	0	362.484	2.700	50	0		FFAARM
COC(=O)c1[n-]c(=NC(=O)c2cc(C(C)C)nc3onc(C)c32)sc1C	ZINC000095476136	508188457	/nfs/dbraw/zinc/18/84/57/508188457.db2.gz	DLTIAQDHYJDJQX-UHFFFAOYSA-N	-1	0	374.422	3.458	50	0		FFAARM
COC(=O)c1[n-]c(=NC(=O)c2cc(-c3ccco3)[nH]n2)sc1CC(C)C	ZINC000095474885	508188540	/nfs/dbraw/zinc/18/85/40/508188540.db2.gz	IQYSPLXGUISMNT-UHFFFAOYSA-N	-1	0	374.422	3.364	50	0		FFAARM
Cc1cc2ncc(C(=O)N3CCCC[C@@H]3CCc3ccccc3)c(=O)n2[n-]1	ZINC000102589329	508278035	/nfs/dbraw/zinc/27/80/35/508278035.db2.gz	VAJSPWIGZBKJGK-QGZVFWFLSA-N	-1	0	364.449	2.959	50	0		FFAARM
CC(C)c1nc(C(=O)N2CCCC[C@H]2C(=O)[O-])nn1-c1ccccc1F	ZINC000128630925	508621201	/nfs/dbraw/zinc/62/12/01/508621201.db2.gz	NSBJJUAUUJUWJI-AWEZNQCLSA-N	-1	0	360.389	2.609	50	0		FFAARM
O=C([O-])CC[C@@H](NC(=O)[C@@H]1CC(=O)Nc2cc(F)ccc21)c1ccccc1	ZINC000139244529	508786172	/nfs/dbraw/zinc/78/61/72/508786172.db2.gz	FTAHKNJFWRCLTG-HZPDHXFCSA-N	-1	0	370.380	2.974	50	0		FFAARM
O=C(c1ccc2[n-]c(=S)oc2c1)N1CCOC[C@@H]1[C@@H]1CCCCC1=O	ZINC000160522339	508997975	/nfs/dbraw/zinc/99/79/75/508997975.db2.gz	CMYIKAVMSGHPPK-GXTWGEPZSA-N	-1	0	360.435	2.717	50	0		FFAARM
O=C([O-])c1nc[nH]c1C(=O)N1CCC[C@@H]1c1nc2cc(Cl)ccc2[nH]1	ZINC000216429060	509261653	/nfs/dbraw/zinc/26/16/53/509261653.db2.gz	KXAHMPQHYQJDFC-LLVKDONJSA-N	-1	0	359.773	2.615	50	0		FFAARM
CC(C)c1nc(CN2CCc3nc(-c4ccc(C(=O)[O-])cc4)[nH]c3C2)no1	ZINC000220447493	509300799	/nfs/dbraw/zinc/30/07/99/509300799.db2.gz	GBGQVRBQKNKKEE-UHFFFAOYSA-N	-1	0	367.409	2.840	50	0		FFAARM
CN1Cc2ccc(NC(=O)C[C@H](CC(=O)[O-])c3ccccc3F)cc2C1=O	ZINC000223077953	509328688	/nfs/dbraw/zinc/32/86/88/509328688.db2.gz	DOFAWSAIEZXXSM-CYBMUJFWSA-N	-1	0	370.380	2.998	50	0		FFAARM
O=S(=O)([N-]c1nncn1Cc1ccccc1)c1cccc2cccnc21	ZINC000225401793	509370673	/nfs/dbraw/zinc/37/06/73/509370673.db2.gz	RTRYRUWSPITWCK-UHFFFAOYSA-N	-1	0	365.418	2.675	50	0		FFAARM
CC(=O)N1CCc2cc(C(=O)N[C@@H](CC(=O)[O-])c3ccccc3C)ccc21	ZINC000236591526	509460711	/nfs/dbraw/zinc/46/07/11/509460711.db2.gz	CTVSXCSSAYEFFY-SFHVURJKSA-N	-1	0	366.417	2.850	50	0		FFAARM
CC(C)Oc1cc(Br)ccc1C(=O)N1CC[C@H](C(=O)[O-])C1	ZINC000236612443	509464432	/nfs/dbraw/zinc/46/44/32/509464432.db2.gz	XHKHLZGYCKHDEY-JTQLQIEISA-N	-1	0	356.216	2.783	50	0		FFAARM
C[C@@H](CC(=O)N1CCO[C@@H](CC(=O)[O-])C1)c1ccccc1C(F)(F)F	ZINC000237335165	509624816	/nfs/dbraw/zinc/62/48/16/509624816.db2.gz	YTXHGXRYPXMVLD-RYUDHWBXSA-N	-1	0	359.344	2.901	50	0		FFAARM
Cc1nc(C(F)(F)F)ccc1C(=O)N(CCC(=O)[O-])C1CCOCC1	ZINC000237563889	509679398	/nfs/dbraw/zinc/67/93/98/509679398.db2.gz	BLAXQCIENZDDLD-UHFFFAOYSA-N	-1	0	360.332	2.505	50	0		FFAARM
CC(C)[C@H]1CC[C@@H](C)CCN1C(=O)Cc1csc([N-]S(C)(=O)=O)n1	ZINC000170629876	509686462	/nfs/dbraw/zinc/68/64/62/509686462.db2.gz	SDNVLKRQEPLOKI-TZMCWYRMSA-N	-1	0	373.544	2.730	50	0		FFAARM
CCn1c(=O)c2ccc(C(=O)N[C@@H](C)CC(C)(C)OC)cc2[n-]c1=S	ZINC000170640973	509691278	/nfs/dbraw/zinc/69/12/78/509691278.db2.gz	FXEUBTHFBAWLHF-NSHDSACASA-N	-1	0	363.483	2.639	50	0		FFAARM
C[C@@]1(C(=O)[O-])CCN(C(=O)C2(c3cccc(Br)c3)CC2)C1	ZINC000237642300	509699313	/nfs/dbraw/zinc/69/93/13/509699313.db2.gz	WLBAENZXMBPKIL-OAHLLOKOSA-N	-1	0	352.228	2.804	50	0		FFAARM
Cc1c(C(=O)N(CCC(=O)[O-])C[C@@H]2CCCO2)cnn1-c1ccccc1C	ZINC000237735954	509722546	/nfs/dbraw/zinc/72/25/46/509722546.db2.gz	SKHWVAZEARYKIY-INIZCTEOSA-N	-1	0	371.437	2.585	50	0		FFAARM
Cc1nn(-c2ccc(F)cc2)c(Cl)c1C(=O)N1CC[C@](C)(C(=O)[O-])C1	ZINC000237768661	509730671	/nfs/dbraw/zinc/73/06/71/509730671.db2.gz	WDABVDQIAOMZIJ-KRWDZBQOSA-N	-1	0	365.792	2.910	50	0		FFAARM
O=C([O-])COc1cccc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2F)c1	ZINC000238019980	509800755	/nfs/dbraw/zinc/80/07/55/509800755.db2.gz	UNCIWMATWHYULM-JKSUJKDBSA-N	-1	0	361.344	2.848	50	0		FFAARM
O=C([O-])C1CCN(C(=O)[C@@H]2C[C@@H]2c2cccc(Br)c2)CC1	ZINC000238026408	509803158	/nfs/dbraw/zinc/80/31/58/509803158.db2.gz	GSPSFIRDDMQGAD-ZIAGYGMSSA-N	-1	0	352.228	2.876	50	0		FFAARM
O=C([O-])C[C@H]1CN(C(=O)CC(c2ccccc2)c2ccccc2)CCO1	ZINC000238051333	509808849	/nfs/dbraw/zinc/80/88/49/509808849.db2.gz	KOAMHGZBGFOLLU-SFHVURJKSA-N	-1	0	353.418	2.911	50	0		FFAARM
O=C([O-])[C@H]1CCCN(C(=O)C2(c3cccc(Br)c3)CC2)C1	ZINC000238067458	509812769	/nfs/dbraw/zinc/81/27/69/509812769.db2.gz	MNMQYBGYNYNJLA-NSHDSACASA-N	-1	0	352.228	2.804	50	0		FFAARM
O=C([O-])[C@H]1CCCN1CC(=O)N(CCc1ccccc1)Cc1ccccc1	ZINC000238090546	509820100	/nfs/dbraw/zinc/82/01/00/509820100.db2.gz	SYSZHUPCUHPKLY-HXUWFJFHSA-N	-1	0	366.461	2.807	50	0		FFAARM
O=C([O-])CCN(C[C@H]1CCCO1)C(=O)c1cc(F)ccc1Br	ZINC000238105914	509821544	/nfs/dbraw/zinc/82/15/44/509821544.db2.gz	UYGDYWVDJFACCI-LLVKDONJSA-N	-1	0	374.206	2.684	50	0		FFAARM
O=C([O-])[C@@H]1CC=CC[C@H]1C(=O)N1CCN(C/C=C\c2ccccc2)CC1	ZINC000252614681	509854833	/nfs/dbraw/zinc/85/48/33/509854833.db2.gz	JLTLXEFNRIBPCX-ZHHAWYBESA-N	-1	0	354.450	2.511	50	0		FFAARM
COc1cc(C)c(CN(C)Cc2c([O-])nnn2-c2ccccc2)cc1OC	ZINC000193990451	510165609	/nfs/dbraw/zinc/16/56/09/510165609.db2.gz	CZVOKNXTTKDUAV-UHFFFAOYSA-N	-1	0	368.437	2.931	50	0		FFAARM
CCc1ccccc1NC(=O)N1CCC[C@@H](c2ccn(CC(=O)[O-])n2)C1	ZINC000426504446	513962748	/nfs/dbraw/zinc/96/27/48/513962748.db2.gz	GOHKYNKLCQENPS-OAHLLOKOSA-N	-1	0	356.426	2.942	50	0		FFAARM
C[C@@H](NC(=O)C1(C(=O)[O-])CCC1)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000567969160	518806539	/nfs/dbraw/zinc/80/65/39/518806539.db2.gz	POIUUHPKHMYAFX-CYBMUJFWSA-N	-1	0	367.405	2.766	50	0		FFAARM
O=C([O-])CCN(C(=O)[C@@H]1SCCc2sccc21)C1CCOCC1	ZINC000574495327	519181277	/nfs/dbraw/zinc/18/12/77/519181277.db2.gz	INGRRMUXWWZVJN-OAHLLOKOSA-N	-1	0	355.481	2.561	50	0		FFAARM
O=C([O-])CCc1ccc(C(=O)CN2c3ccccc3N3CCCN=C23)cc1	ZINC000334162637	534496962	/nfs/dbraw/zinc/49/69/62/534496962.db2.gz	DJIUTBRDXVTUMD-UHFFFAOYSA-N	-1	0	363.417	2.973	50	0		FFAARM
COc1ccc(Cl)cc1/C=C\C(=O)N(CCC(=O)[O-])C1CCOCC1	ZINC000606441049	521068152	/nfs/dbraw/zinc/06/81/52/521068152.db2.gz	BKHFNUMCGABNBR-DJWKRKHSSA-N	-1	0	367.829	2.844	50	0		FFAARM
O=C([O-])CCN(C(=O)/C=C\c1cccc2cccnc12)C1CCOCC1	ZINC000606440998	521068701	/nfs/dbraw/zinc/06/87/01/521068701.db2.gz	HKENCRHAOKXVQS-SREVYHEPSA-N	-1	0	354.406	2.730	50	0		FFAARM
CC[C@@](NC(=O)/C=C\c1ccc(C(=O)NC)cc1)(C(=O)[O-])c1ccccc1	ZINC000606445189	521070365	/nfs/dbraw/zinc/07/03/65/521070365.db2.gz	DQFHRJUMXCNPOH-SZRHCGQDSA-N	-1	0	366.417	2.566	50	0		FFAARM
CCOc1ccc([C@@H](C(=O)[O-])N2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000087489407	521216367	/nfs/dbraw/zinc/21/63/67/521216367.db2.gz	YFNIXSDTFXXPLJ-INIZCTEOSA-N	-1	0	364.442	2.764	50	0		FFAARM
O=C([O-])c1ccc(F)c2c1CN(C(=O)Cc1ccc3c(c1)CCO3)CC2	ZINC000630238778	522724409	/nfs/dbraw/zinc/72/44/09/522724409.db2.gz	OREUXBDMDYGFQS-UHFFFAOYSA-N	-1	0	355.365	2.586	50	0		FFAARM
O=C([O-])c1ccc2nc(/C=C\c3cn(C[C@H]4CCOC4)nn3)ccc2c1	ZINC000630950298	523267873	/nfs/dbraw/zinc/26/78/73/523267873.db2.gz	CFULCOVZJVKCBC-DSYXLKISSA-N	-1	0	350.378	2.731	50	0		FFAARM
Cc1c2ccc(C(F)(F)F)nc2sc1C(=O)N1CCO[C@H](C(=O)[O-])C1	ZINC000178279973	525962986	/nfs/dbraw/zinc/96/29/86/525962986.db2.gz	LNEBPRQDZJHRJZ-VIFPVBQESA-N	-1	0	374.340	2.549	50	0		FFAARM
Cc1noc(C)c1S(=O)(=O)[N-]Cc1sc(-c2ccco2)nc1C	ZINC000090593478	526614638	/nfs/dbraw/zinc/61/46/38/526614638.db2.gz	IPTCHHDSWIGJHV-UHFFFAOYSA-N	-1	0	353.425	2.795	50	0		FFAARM
O=C([O-])COc1cccc(CNC(=O)[C@H]2C[C@@H]2c2ccc(F)cc2F)c1	ZINC000238020744	527618524	/nfs/dbraw/zinc/61/85/24/527618524.db2.gz	UNCIWMATWHYULM-CVEARBPZSA-N	-1	0	361.344	2.848	50	0		FFAARM
CCn1ccnc1[C@@H]1CCCN(c2c3c(C)nn(C)c3ncc2C(=O)[O-])C1	ZINC000091587453	536118736	/nfs/dbraw/zinc/11/87/36/536118736.db2.gz	JATSLSCHVKTKGJ-CYBMUJFWSA-N	-1	0	368.441	2.575	50	0		FFAARM
CCc1cc(N2CCC(C(=O)[O-])(n3ccc(-c4ccco4)n3)CC2)ncn1	ZINC000072424119	536143353	/nfs/dbraw/zinc/14/33/53/536143353.db2.gz	AOQGECWLBVFTOC-UHFFFAOYSA-N	-1	0	367.409	2.576	50	0		FFAARM
O=C([O-])CCN(C(=O)c1ccc(Br)s1)C1CCOCC1	ZINC000119011152	570583871	/nfs/dbraw/zinc/58/38/71/570583871.db2.gz	GYMMAOMPUJEVQF-UHFFFAOYSA-N	-1	0	362.245	2.607	50	0		FFAARM
CC(C)(C)CS(=O)(=O)[N-]C(=O)c1cccc(OCc2cccnc2)c1	ZINC000113676355	570965898	/nfs/dbraw/zinc/96/58/98/570965898.db2.gz	IFQINSJNOLMLPP-UHFFFAOYSA-N	-1	0	362.451	2.766	50	0		FFAARM
CS(=O)(=O)[N-]c1nc(CC(=O)Nc2cccc3ccccc32)cs1	ZINC000013725602	571134448	/nfs/dbraw/zinc/13/44/48/571134448.db2.gz	GSBWEAJAEJVNRU-UHFFFAOYSA-N	-1	0	361.448	2.849	50	0		FFAARM
CN(C)C(=O)c1cccc(NC(=O)CC2(C(=O)[O-])Cc3ccccc3C2)c1	ZINC000169975734	571259781	/nfs/dbraw/zinc/25/97/81/571259781.db2.gz	MPBOWRNXWSYXGM-UHFFFAOYSA-N	-1	0	366.417	2.587	50	0		FFAARM
Cc1cc(C(=O)NC2(CC(=O)[O-])CCOCC2)c(Br)s1	ZINC000663122978	602161910	/nfs/dbraw/zinc/16/19/10/602161910.db2.gz	SHZJVWWHBUYXHH-UHFFFAOYSA-N	-1	0	362.245	2.573	50	0		FFAARM
C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCC[C@@H](CCC(=O)[O-])C1	ZINC000263098272	729679446	/nfs/dbraw/zinc/67/94/46/729679446.db2.gz	ILXGTQCKTUQOMD-OLZOCXBDSA-N	-1	0	366.845	2.562	50	0		FFAARM
CC(C)n1cc([N-]S(=O)(=O)c2cc(Cl)c3c(c2)CCC(=O)N3)cn1	ZINC000675030270	971516795	/nfs/dbraw/zinc/51/67/95/971516795.db2.gz	XEBVSMVFFFFSDQ-UHFFFAOYSA-N	-1	0	368.846	2.803	50	0		FFAARM
O=C([O-])[C@@H]1CCCN1C(=O)/C(=C/c1ccccc1)NC(=O)c1ccccc1	ZINC000022590700	964557893	/nfs/dbraw/zinc/55/78/93/964557893.db2.gz	NSPQTJMKTBCIGD-DNKLCNGGSA-N	-1	0	364.401	2.533	50	0		FFAARM
CC(C)n1cnc(S(=O)(=O)[N-]c2nnc(-c3ccc4c(c3)CCC4)o2)c1	ZINC000194812028	968656472	/nfs/dbraw/zinc/65/64/72/968656472.db2.gz	JEJGAMDOMCRXLJ-UHFFFAOYSA-N	-1	0	373.438	2.804	50	0		FFAARM
CS(=O)(=O)[N-]c1ccc(Cl)cc1C(=O)N1CCCc2occc2C1	ZINC000952847493	1010977812	/nfs/dbraw/zinc/97/78/12/1010977812.db2.gz	ARMJLSPUAQNRJY-UHFFFAOYSA-N	-1	0	368.842	2.893	50	0		FFAARM
CC1=Nc2nc(NC(=O)CCC(=O)[O-])nn2[C@@H](c2ccc(Cl)cc2)C1	ZINC000000780261	219320998	/nfs/dbraw/zinc/32/09/98/219320998.db2.gz	SPGMFGKWYCTDTN-GFCCVEGCSA-N	-1	0	361.789	2.654	50	0		FFAARM
O=C([O-])[C@@H]1CC=CC[C@H]1C(=O)Nc1ccc(C(=O)Nc2ccccn2)cc1	ZINC000000794589	219321894	/nfs/dbraw/zinc/32/18/94/219321894.db2.gz	YWBYNQIDGROGDX-HZPDHXFCSA-N	-1	0	365.389	2.939	50	0		FFAARM
O=C([O-])[C@@H]1CC=CC[C@H]1C(=O)Nc1ccc(C(=O)N2CCCCC2)cc1	ZINC000000794631	219321981	/nfs/dbraw/zinc/32/19/81/219321981.db2.gz	XLQUTUSBPFBIPN-IAGOWNOFSA-N	-1	0	356.422	2.918	50	0		FFAARM
COc1ccc2[nH]cc(CCN3C(=O)c4ccc(C(=O)[O-])cc4C3=O)c2c1	ZINC000001514078	219410324	/nfs/dbraw/zinc/41/03/24/219410324.db2.gz	IZPLFMIPIZZAAU-UHFFFAOYSA-N	-1	0	364.357	2.713	50	0		FFAARM
O=C([O-])[C@H]1CCCN(S(=O)(=O)Cc2c(Cl)cccc2Cl)C1	ZINC000226087402	222882187	/nfs/dbraw/zinc/88/21/87/222882187.db2.gz	ADFGVFHGIGFRKP-VIFPVBQESA-N	-1	0	352.239	2.620	50	0		FFAARM
C/C(=C/C(=O)N1CCO[C@@H](CC(=O)[O-])C1)c1ccccc1C(F)(F)F	ZINC000236628169	222904718	/nfs/dbraw/zinc/90/47/18/222904718.db2.gz	SXSNEJGJITZUHH-KGTBHZDVSA-N	-1	0	357.328	2.811	50	0		FFAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)c2ccc(CN3CCCC3=O)cc2)C1	ZINC000237969599	222912781	/nfs/dbraw/zinc/91/27/81/222912781.db2.gz	OJHGFFISJIBAOD-HNNXBMFYSA-N	-1	0	358.438	2.526	50	0		FFAARM
O=C([O-])[C@@H]1CCCN1C(=O)C1CCN(c2nc3ccccc3s2)CC1	ZINC000238058229	222913635	/nfs/dbraw/zinc/91/36/35/222913635.db2.gz	BZMHHGOKGDMHSY-AWEZNQCLSA-N	-1	0	359.451	2.588	50	0		FFAARM
COc1ccc(-n2ccc(C(=O)N3CCC[C@@H](CCC(=O)[O-])C3)n2)cc1	ZINC000237511211	222908176	/nfs/dbraw/zinc/90/81/76/222908176.db2.gz	WNTLMYWCWWZJAI-AWEZNQCLSA-N	-1	0	357.410	2.598	50	0		FFAARM
C[C@@H]1CCc2c(sc(NC(=O)[C@H]3CCCC[C@@H]3C(=O)[O-])c2C(N)=O)C1	ZINC000004646609	219591848	/nfs/dbraw/zinc/59/18/48/219591848.db2.gz	RIVQMHSILJEIBU-VWYCJHECSA-N	-1	0	364.467	2.801	50	0		FFAARM
CCOc1ccc(Cc2nnc(Nc3cccc(OC)c3)[n-]c2=O)cc1	ZINC000005154319	219655561	/nfs/dbraw/zinc/65/55/61/219655561.db2.gz	IYMCPHHKHYQARY-UHFFFAOYSA-N	-1	0	352.394	2.907	50	0		FFAARM
O=C([O-])[C@@H]1Cc2ccccc2CN1C(=O)c1cccc(Nc2cnccn2)c1	ZINC000299742015	223079581	/nfs/dbraw/zinc/07/95/81/223079581.db2.gz	AQWNRXKMCGVNEI-SFHVURJKSA-N	-1	0	374.400	2.872	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)C[C@@H]1CCCO1)c1ccc(OC(F)(F)F)cc1	ZINC000299382512	223077776	/nfs/dbraw/zinc/07/77/76/223077776.db2.gz	WVOJKUUBBCVWLX-STQMWFEESA-N	-1	0	361.316	2.786	50	0		FFAARM
O=C([O-])c1ccc(CCNC(=O)C[C@@H]2Sc3ccccc3NC2=O)cc1	ZINC000299745891	223078966	/nfs/dbraw/zinc/07/89/66/223078966.db2.gz	TWCFLHRZVZQJEK-INIZCTEOSA-N	-1	0	370.430	2.547	50	0		FFAARM
Cc1nc(-c2cccc(C(=O)N3[C@@H]4CCCC[C@@H]4C[C@H]3C(=O)[O-])c2)no1	ZINC000299750361	223080666	/nfs/dbraw/zinc/08/06/66/223080666.db2.gz	NFJURMYHIGVHLG-WQVCFCJDSA-N	-1	0	355.394	2.903	50	0		FFAARM
CCN(Cc1cccs1)S(=O)(=O)c1cc(C(=O)[O-])ccc1OC	ZINC000013094054	220057188	/nfs/dbraw/zinc/05/71/88/220057188.db2.gz	JWDPQPYBOWTQKD-UHFFFAOYSA-N	-1	0	355.437	2.666	50	0		FFAARM
COc1cc(NS(=O)(=O)/C=C/c2ccccc2)c(C(=O)[O-])cc1OC	ZINC000013263139	220062430	/nfs/dbraw/zinc/06/24/30/220062430.db2.gz	JGUYDNYAQLAFIQ-CMDGGOBGSA-N	-1	0	363.391	2.815	50	0		FFAARM
CCc1ccccc1NC(=O)CSc1nc2[nH]c(=O)cc([O-])c2s1	ZINC000013119403	220058968	/nfs/dbraw/zinc/05/89/68/220058968.db2.gz	QWJZBGURQRFJGO-UHFFFAOYSA-N	-1	0	361.448	2.983	50	0		FFAARM
O=C([O-])C1(c2ccccc2)CCN(C(=O)c2ccc3c(c2)OCCO3)CC1	ZINC000013185589	220060752	/nfs/dbraw/zinc/06/07/52/220060752.db2.gz	MAYQODWSVKYBSN-UHFFFAOYSA-N	-1	0	367.401	2.716	50	0		FFAARM
COc1ccc(CNC(=O)c2ccc(Br)o2)cc1C(=O)[O-]	ZINC000013392881	220067114	/nfs/dbraw/zinc/06/71/14/220067114.db2.gz	CXBWTNWQBVOVAT-UHFFFAOYSA-N	-1	0	354.156	2.679	50	0		FFAARM
O=C([O-])C[C@H](NC(=O)Cc1ccc(N2CCCC2=O)cc1)c1ccccc1	ZINC000013427915	220067177	/nfs/dbraw/zinc/06/71/77/220067177.db2.gz	KADOFTKQSJBZFA-SFHVURJKSA-N	-1	0	366.417	2.688	50	0		FFAARM
O=C([O-])[C@@H]1CC=CC[C@@H]1C(=O)Nc1ccccc1C(=O)N1CCCCC1	ZINC000013466555	220068184	/nfs/dbraw/zinc/06/81/84/220068184.db2.gz	XDRCEVQBCNZWTL-LSDHHAIUSA-N	-1	0	356.422	2.918	50	0		FFAARM
CCOc1ccccc1O[C@H]1C[C@@H](C(=O)[O-])N(C(=O)OC(C)(C)C)C1	ZINC000014632457	220128438	/nfs/dbraw/zinc/12/84/38/220128438.db2.gz	ATFWKWYOSDWBTJ-STQMWFEESA-N	-1	0	351.399	2.927	50	0		FFAARM
O=C([O-])[C@]1(NC(=O)OCC2c3ccccc3-c3ccccc32)CC[C@H](O)C1	ZINC000015446457	220155223	/nfs/dbraw/zinc/15/52/23/220155223.db2.gz	FPTJRPYTKCYJLR-ZSEKCTLFSA-N	-1	0	367.401	2.893	50	0		FFAARM
C[C@@H](CC(=O)[O-])CC(=O)Nc1sc2c(c1C(=O)NC1CC1)CCC2	ZINC000017072714	220201628	/nfs/dbraw/zinc/20/16/28/220201628.db2.gz	ITLXCYKHGQFXJE-SECBINFHSA-N	-1	0	350.440	2.568	50	0		FFAARM
CCN1C(=O)Cc2cc([N-]S(=O)(=O)c3cc(F)ccc3F)ccc21	ZINC000017288956	220211972	/nfs/dbraw/zinc/21/19/72/220211972.db2.gz	BJVZYTQRQZYTTQ-UHFFFAOYSA-N	-1	0	352.362	2.675	50	0		FFAARM
CCn1c(=O)c2ccc(C(=O)N3CCc4ccccc4C3)cc2[n-]c1=S	ZINC000017322081	220213286	/nfs/dbraw/zinc/21/32/86/220213286.db2.gz	XRHGTXLHMICRHA-UHFFFAOYSA-N	-1	0	365.458	2.904	50	0		FFAARM
Cc1cn2c(nc(C)c(S(=O)(=O)[N-]c3ccc(Cl)cc3)c2=O)s1	ZINC000020921949	220346510	/nfs/dbraw/zinc/34/65/10/220346510.db2.gz	SDFYKYHVLVIJKC-UHFFFAOYSA-N	-1	0	369.855	2.827	50	0		FFAARM
CCOc1cc2c(cc1[N-]S(=O)(=O)c1c(C)n[nH]c1C)O[C@@H](C)C2	ZINC000022244920	220380110	/nfs/dbraw/zinc/38/01/10/220380110.db2.gz	WNYSDJAGGHYJQQ-VIFPVBQESA-N	-1	0	351.428	2.549	50	0		FFAARM
COc1ccc([C@H](CC(=O)[O-])NC(=O)c2ccc3c(c2)CCO3)cc1OC	ZINC000299746605	533178044	/nfs/dbraw/zinc/17/80/44/533178044.db2.gz	YLUOWQQUPUMVKH-HNNXBMFYSA-N	-1	0	371.389	2.585	50	0		FFAARM
O=C([O-])c1ccc(S(=O)(=O)Nc2ccccc2Br)cc1	ZINC000035296278	220775923	/nfs/dbraw/zinc/77/59/23/220775923.db2.gz	QXHKMJWSRIXDBX-UHFFFAOYSA-N	-1	0	356.197	2.948	50	0		FFAARM
COc1ccc(-c2cc(C(=O)NCC(=O)[O-])c3ccccc3n2)cc1OC	ZINC000040312544	220901157	/nfs/dbraw/zinc/90/11/57/220901157.db2.gz	KARCVZBMMVXBOR-UHFFFAOYSA-N	-1	0	366.373	2.733	50	0	biogenic	FFAARM
Cc1c2c(cc(=O)n1Cc1ccccn1)[n-]n(-c1ccc(Cl)cc1)c2=O	ZINC000051129624	221033065	/nfs/dbraw/zinc/03/30/65/221033065.db2.gz	RRXPOWJDZVMMFU-UHFFFAOYSA-N	-1	0	366.808	2.886	50	0		FFAARM
COC(=O)c1cccc(S(=O)(=O)[N-]c2c(C)nn(C(C)C)c2C)c1	ZINC000055649056	221072282	/nfs/dbraw/zinc/07/22/82/221072282.db2.gz	RIJVJPKAXYIUMW-UHFFFAOYSA-N	-1	0	351.428	2.668	50	0		FFAARM
CCOc1ccc([N-]S(=O)(=O)c2ccccc2C(=O)OC)cc1F	ZINC000055678595	221073970	/nfs/dbraw/zinc/07/39/70/221073970.db2.gz	UDUWNQYJQAJSAF-UHFFFAOYSA-N	-1	0	353.371	2.812	50	0		FFAARM
COc1ccccc1[C@H]([N-]C(=O)C(F)(F)Br)c1nccn1C	ZINC000058293399	221113172	/nfs/dbraw/zinc/11/31/72/221113172.db2.gz	RTCOOLXJWTVQQZ-NSHDSACASA-N	-1	0	374.185	2.622	50	0		FFAARM
COc1ccc(/C=C/C(=O)[O-])cc1S(=O)(=O)N(C)c1ccccc1F	ZINC000058377204	221117040	/nfs/dbraw/zinc/11/70/40/221117040.db2.gz	OPYXBJGGQCMDEU-CSKARUKUSA-N	-1	0	365.382	2.757	50	0		FFAARM
O=C([O-])[C@@H]1CCN(S(=O)(=O)c2c(Cl)cc(Cl)cc2Cl)C1	ZINC000062132685	221139666	/nfs/dbraw/zinc/13/96/66/221139666.db2.gz	FFFLGSWXBBTUKY-ZCFIWIBFSA-N	-1	0	358.630	2.742	50	0		FFAARM
CCOC(=O)c1c(C)c(S(=O)(=O)[N-]c2ccccc2OC)c(C)n1C	ZINC000064863358	221154784	/nfs/dbraw/zinc/15/47/84/221154784.db2.gz	ZEBAHQAPBVIOFC-UHFFFAOYSA-N	-1	0	366.439	2.628	50	0		FFAARM
CCc1nc2sc(C)nn2c1S(=O)(=O)[N-]c1cc(F)ccc1C	ZINC000065183904	221176251	/nfs/dbraw/zinc/17/62/51/221176251.db2.gz	ZUIGAFXLRLHYLZ-UHFFFAOYSA-N	-1	0	354.432	2.910	50	0		FFAARM
Cc1n[nH]c(C)c1[C@@H](NC(=O)c1cc2cccc(Cl)c2n1C)C(=O)[O-]	ZINC000067446936	221254183	/nfs/dbraw/zinc/25/41/83/221254183.db2.gz	AITLLACKSUKRLS-CQSZACIVSA-N	-1	0	360.801	2.727	50	0		FFAARM
O=C([O-])CSc1nnc(-c2cc[nH]n2)n1-c1cccc(C(F)(F)F)c1	ZINC000067821752	221291139	/nfs/dbraw/zinc/29/11/39/221291139.db2.gz	SEWPTJRPXLKORE-UHFFFAOYSA-N	-1	0	369.328	2.853	50	0		FFAARM
CC(C)NS(=O)(=O)c1cc(C(=O)[O-])cc(-c2cccc3c2OCC3)c1	ZINC000071589624	221351344	/nfs/dbraw/zinc/35/13/44/221351344.db2.gz	URWFVFVIJUKTFJ-UHFFFAOYSA-N	-1	0	361.419	2.673	50	0		FFAARM
O=C([O-])C1(NC(=O)[C@@H]2CC(=O)N(c3cccc(Cl)c3)C2)CCCCC1	ZINC000071802768	221377766	/nfs/dbraw/zinc/37/77/66/221377766.db2.gz	DIZJRGSUZAWKEH-GFCCVEGCSA-N	-1	0	364.829	2.597	50	0		FFAARM
Cc1cc(N2CCC[C@@]3(CN(C)C(=O)O3)C2)nc(-c2ccccc2[O-])n1	ZINC000091289096	132200794	/nfs/dbraw/zinc/20/07/94/132200794.db2.gz	RVJNJWHXSYYGAI-LJQANCHMSA-N	-1	0	354.410	2.579	50	0		FFAARM
CC(C)Cc1cc(C(=O)N2CCN(c3cccc(C(=O)[O-])c3)CC2)on1	ZINC000095497200	132211691	/nfs/dbraw/zinc/21/16/91/132211691.db2.gz	DBPDDEINLAMMAW-UHFFFAOYSA-N	-1	0	357.410	2.534	50	0		FFAARM
Cc1cccc(C)c1NC(=O)C1=C([O-])c2ccccc2N(C)S1(=O)=O	ZINC000006055846	132831214	/nfs/dbraw/zinc/83/12/14/132831214.db2.gz	VUABFGVETJDZDF-UHFFFAOYSA-N	-1	0	358.419	2.948	50	0		FFAARM
O=c1nc(CN2CCN(c3cccc(Cl)c3)CC2)[n-]c2ccsc21	ZINC000057354944	136128687	/nfs/dbraw/zinc/12/86/87/136128687.db2.gz	GSQKZLVHGKWLDK-UHFFFAOYSA-N	-1	0	360.870	2.960	50	0		FFAARM
CCn1cc(C)c(C(=O)[O-])c1CC(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000064980669	136134317	/nfs/dbraw/zinc/13/43/17/136134317.db2.gz	IWXMPOPXDMHHIQ-UHFFFAOYSA-N	-1	0	373.428	2.545	50	0		FFAARM
O=C([O-])c1ccnc(-c2ccnc(N3CCO[C@H](c4ccccc4)C3)n2)c1	ZINC000072406899	136145085	/nfs/dbraw/zinc/14/50/85/136145085.db2.gz	WHVMMOYVWRGAHR-SFHVURJKSA-N	-1	0	362.389	2.815	50	0		FFAARM
Cc1ccccc1[C@@H]1CN(C(=O)CCn2cc(Cl)cn2)C[C@H]1C(=O)[O-]	ZINC000091819982	221802050	/nfs/dbraw/zinc/80/20/50/221802050.db2.gz	BRARJDUYFONTOL-JKSUJKDBSA-N	-1	0	361.829	2.562	50	0		FFAARM
Cc1c(C(=O)N2CC[C@@](F)(C(=O)[O-])C2)sc2nc(C3CC3)nc(C)c12	ZINC000095970844	221983711	/nfs/dbraw/zinc/98/37/11/221983711.db2.gz	YTZOYWKWOYUHAI-KRWDZBQOSA-N	-1	0	363.414	2.824	50	0		FFAARM
Cc1cc(S(=O)(=O)[N-]c2ccccn2)ccc1I	ZINC000096305689	222113356	/nfs/dbraw/zinc/11/33/56/222113356.db2.gz	BIDVUIPSCJNEOV-UHFFFAOYSA-N	-1	0	374.203	2.795	50	0		FFAARM
O=c1c2[n-][nH]n(-c3ccc(F)cc3)c=2c(=O)n1-c1ccc2c(c1)CCC2	ZINC000096500410	222123008	/nfs/dbraw/zinc/12/30/08/222123008.db2.gz	AOJNWZILBPWJHN-SJORKVTESA-N	-1	0	350.353	2.812	50	0		FFAARM
COc1ccc(/C=C\C(=O)[O-])cc1S(=O)(=O)[N-]c1cc(F)cc(F)c1	ZINC000096930709	222142987	/nfs/dbraw/zinc/14/29/87/222142987.db2.gz	YJZOBBAJTOENCC-HYXAFXHYSA-N	-1	0	369.345	2.872	50	0		FFAARM
COc1ccc([C@@H]2CC(c3ccco3)=NN2C(=O)CCC(=O)[O-])c(OC)c1	ZINC000097104894	222160346	/nfs/dbraw/zinc/16/03/46/222160346.db2.gz	HYJXVILVVXLLJV-HNNXBMFYSA-N	-1	0	372.377	2.839	50	0		FFAARM
COc1ccc2c(c1)[C@@H](c1nc(C3CCCC3)nn1CC(=O)[O-])CC(=O)N2	ZINC000097099369	222160414	/nfs/dbraw/zinc/16/04/14/222160414.db2.gz	WQSDKXKDRIGYRG-AWEZNQCLSA-N	-1	0	370.409	2.503	50	0		FFAARM
CCN1CCN(Cc2cc(-c3cccs3)ccc2OCC(=O)[O-])CC1=O	ZINC000097425486	222180643	/nfs/dbraw/zinc/18/06/43/222180643.db2.gz	CMACARJDCDBINO-UHFFFAOYSA-N	-1	0	374.462	2.543	50	0		FFAARM
Cc1ccc(-c2nc([C@@H](c3cccnc3)N3CCCC3)n(CC(=O)[O-])n2)o1	ZINC000097679864	222206415	/nfs/dbraw/zinc/20/64/15/222206415.db2.gz	DMRWIKJIWHVNOE-QGZVFWFLSA-N	-1	0	367.409	2.511	50	0		FFAARM
CCc1ccc(-n2c(=O)c3[n-][nH]n(Cc4ccc(F)cc4)c=3c2=O)cc1	ZINC000101168028	222264867	/nfs/dbraw/zinc/26/48/67/222264867.db2.gz	YNWWZRCPBFWBLT-DLBZAZTESA-N	-1	0	352.369	2.882	50	0		FFAARM
C[C@@H]1CCCC[C@@H]1NC(=O)CSc1nc(=O)cc([O-])n1C1CCCC1	ZINC000102137524	222290031	/nfs/dbraw/zinc/29/00/31/222290031.db2.gz	VIRVFJULUIPRBD-OCCSQVGLSA-N	-1	0	365.499	2.851	50	0		FFAARM
Cc1nn(-c2ccccc2)c2c1cc1c(=O)[n-]c(=O)nc-1n2-c1ccccc1	ZINC000002218866	263145041	/nfs/dbraw/zinc/14/50/41/263145041.db2.gz	BIDBWXGCZOFSHI-UHFFFAOYSA-N	-1	0	369.384	2.673	50	0		FFAARM
COc1cc2c(cc1OC)[C@@H](CC(=O)[O-])N(C(=O)c1ccccc1)CC2	ZINC000012505579	263371272	/nfs/dbraw/zinc/37/12/72/263371272.db2.gz	DZQPKVVYBUQCRW-MRXNPFEDSA-N	-1	0	355.390	2.918	50	0		FFAARM
O=C([O-])c1cc(S(=O)(=O)Nc2ccc3c[nH]nc3c2)ccc1Cl	ZINC000034863320	263397729	/nfs/dbraw/zinc/39/77/29/263397729.db2.gz	QAQJWYUNCXNMSB-UHFFFAOYSA-N	-1	0	351.771	2.715	50	0		FFAARM
O=C(CSc1nncc(=O)[n-]1)Nc1cc(C(F)(F)F)ccc1Cl	ZINC000001282342	506259093	/nfs/dbraw/zinc/25/90/93/506259093.db2.gz	KEJZDYGUVVVMIG-UHFFFAOYSA-N	-1	0	364.736	2.980	50	0		FFAARM
CCOC(=O)c1ccc(N=C2[N-]S(=O)(=O)C=C(c3ccccc3)O2)cc1	ZINC000001516561	506264445	/nfs/dbraw/zinc/26/44/45/506264445.db2.gz	ZTPFVYOIFCJYFB-UHFFFAOYSA-N	-1	0	372.402	2.990	50	0		FFAARM
Cc1coc2cc3oc(=O)c(CCC(=O)NCCC(=O)[O-])c(C)c3cc12	ZINC000002106371	506271928	/nfs/dbraw/zinc/27/19/28/506271928.db2.gz	FWOMWTOZTVGCOP-UHFFFAOYSA-N	-1	0	357.362	2.680	50	0	biogenic	FFAARM
CC[C@@H](C)[C@@H](C(=O)[O-])N1C(=O)N2CCc3c4ccccc4[nH]c3[C@]2(C)C1=O	ZINC000002159323	506274245	/nfs/dbraw/zinc/27/42/45/506274245.db2.gz	VMYWFCHFKKXGGP-LQGCGHSZSA-N	-1	0	369.421	2.703	50	0		FFAARM
CCCOc1ccc(N2C(=O)C[C@H](Nc3ccc(C(=O)[O-])cc3)C2=O)cc1	ZINC000002192286	506274567	/nfs/dbraw/zinc/27/45/67/506274567.db2.gz	AMMXNCBGDAKKEU-KRWDZBQOSA-N	-1	0	368.389	2.918	50	0		FFAARM
CC[C@H](C)[C@H](NS(=O)(=O)c1cccc2c1cccc2N(C)C)C(=O)[O-]	ZINC000002579062	506283555	/nfs/dbraw/zinc/28/35/55/506283555.db2.gz	NJTOKQLVHXSRPR-SJCJKPOMSA-N	-1	0	364.467	2.683	50	0		FFAARM
CC(C)(C)c1csc(NC(=O)[C@H](CC(=O)[O-])NCc2ccco2)n1	ZINC000002857247	506298932	/nfs/dbraw/zinc/29/89/32/506298932.db2.gz	DEQDDVZZYFDHPD-NSHDSACASA-N	-1	0	351.428	2.605	50	0		FFAARM
CCOC(CCn1c(=O)c2ccc(C(=O)OC)cc2[n-]c1=S)OCC	ZINC000002973984	506304689	/nfs/dbraw/zinc/30/46/89/506304689.db2.gz	XTCCNDQAQVYSBH-UHFFFAOYSA-N	-1	0	366.439	2.635	50	0		FFAARM
COC(=O)c1ccc2c(c1)[n-]c(=S)n(Cc1ccc(OC)cc1)c2=O	ZINC000003043379	506307720	/nfs/dbraw/zinc/30/77/20/506307720.db2.gz	IVLOTPJIUGLJFI-UHFFFAOYSA-N	-1	0	356.403	2.903	50	0		FFAARM
O=C([O-])c1cccc(NC(=O)Cc2sc(Nc3ccccc3)nc2O)c1	ZINC000003423984	506329788	/nfs/dbraw/zinc/32/97/88/506329788.db2.gz	XUQMMNGYEROGAT-CQSZACIVSA-N	-1	0	369.402	2.824	50	0		FFAARM
COc1ccc(N)cc1S(=O)(=O)[N-]c1ccc(Br)cc1	ZINC000003885622	506352216	/nfs/dbraw/zinc/35/22/16/506352216.db2.gz	WNUKMPUZMALMLG-UHFFFAOYSA-N	-1	0	357.229	2.841	50	0		FFAARM
Cc1cccc(C)c1NS(=O)(=O)c1ccc(NC(=O)/C=C/C(=O)[O-])cc1	ZINC000004270557	506367693	/nfs/dbraw/zinc/36/76/93/506367693.db2.gz	VGWDHAABGJWMFS-ZHACJKMWSA-N	-1	0	374.418	2.684	50	0		FFAARM
O=C([N-]C(=O)c1c(F)cccc1F)C(=O)Nc1ccc(Cl)cc1F	ZINC000004382866	506374452	/nfs/dbraw/zinc/37/44/52/506374452.db2.gz	NJXJFUCJROJMRK-UHFFFAOYSA-N	-1	0	356.687	2.652	50	0		FFAARM
CCc1ccc(NC(=O)[C@H](Cc2ccccc2OC)c2nnn[n-]2)cc1	ZINC000004576138	506383793	/nfs/dbraw/zinc/38/37/93/506383793.db2.gz	PQPYPHBSZNPMHV-MRXNPFEDSA-N	-1	0	351.410	2.736	50	0		FFAARM
CCOc1cc(/C=C2\SC(=O)N(CC)C2=O)ccc1OCC(=O)[O-]	ZINC000004660275	506387144	/nfs/dbraw/zinc/38/71/44/506387144.db2.gz	JXJGZDCYLWXSJY-JYRVWZFOSA-N	-1	0	351.380	2.605	50	0		FFAARM
CC[C@H](C)[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@H](C(=O)[O-])C(C)C	ZINC000004760126	506393415	/nfs/dbraw/zinc/39/34/15/506393415.db2.gz	XISNUVNLGJKNIK-CWRNSKLLSA-N	-1	0	364.442	2.553	50	0		FFAARM
COc1ccc2c(c1)c([C@@H](C(=O)[O-])[N@H+]1C[C@H](C)C[C@H](C)C1)cn2CC(=O)[O-]	ZINC000036364796	506401183	/nfs/dbraw/zinc/40/11/83/506401183.db2.gz	QUFIIVDVAHUQMH-QUJCMNEKSA-N	-1	0	374.437	2.838	50	0		FFAARM
COc1ccc([N-]S(=O)(=O)c2cccs2)cc1N1CCCC1=O	ZINC000005329673	506437242	/nfs/dbraw/zinc/43/72/42/506437242.db2.gz	LJFXSVINCDVXDO-UHFFFAOYSA-N	-1	0	352.437	2.684	50	0		FFAARM
C[C@H](NS(=O)(=O)c1ccccc1)c1n[n-]c(=S)n1-c1ccccc1	ZINC000005695629	506454315	/nfs/dbraw/zinc/45/43/15/506454315.db2.gz	LLQBBESLKILMFG-LBPRGKRZSA-N	-1	0	360.464	2.969	50	0		FFAARM
COc1ccc(NC(=O)c2ccccc2[N-]S(C)(=O)=O)cc1Cl	ZINC000006146429	506468797	/nfs/dbraw/zinc/46/87/97/506468797.db2.gz	YKIROZISWFBFQC-UHFFFAOYSA-N	-1	0	354.815	2.972	50	0		FFAARM
Cc1ccc(S(=O)(=O)Nc2ccc3c(c2)OCCCO3)cc1C(=O)[O-]	ZINC000040161427	506477799	/nfs/dbraw/zinc/47/77/99/506477799.db2.gz	IKPCCUMQODHFGU-UHFFFAOYSA-N	-1	0	363.391	2.655	50	0		FFAARM
O=C([O-])c1cccc(NC(=O)N2CCc3[nH]cnc3[C@@H]2c2ccncc2)c1	ZINC000040312900	506481754	/nfs/dbraw/zinc/48/17/54/506481754.db2.gz	MOEXCQNQTXHNIG-KRWDZBQOSA-N	-1	0	363.377	2.683	50	0	biogenic	FFAARM
O=C([O-])c1ccccc1NC(=O)N1CCc2[nH]cnc2[C@H]1c1ccncc1	ZINC000040309478	506481920	/nfs/dbraw/zinc/48/19/20/506481920.db2.gz	NJNKALKLBBBNRS-QGZVFWFLSA-N	-1	0	363.377	2.683	50	0	biogenic	FFAARM
O=C([O-])c1ccc(NC(=O)CSc2nc3ccccc3c(=O)[nH]2)cc1	ZINC000006508705	506486298	/nfs/dbraw/zinc/48/62/98/506486298.db2.gz	GXSLERYCOGXOHQ-UHFFFAOYSA-N	-1	0	355.375	2.764	50	0		FFAARM
Cc1ccc(CSc2ncc(Cl)c(C(=O)NCCC(=O)[O-])n2)cc1	ZINC000041156832	506495502	/nfs/dbraw/zinc/49/55/02/506495502.db2.gz	HNYBGWYUNQQTMW-UHFFFAOYSA-N	-1	0	365.842	2.935	50	0		FFAARM
O=C([O-])[C@H]1C2CCC(CC2)[C@H]1C(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000006715350	506500774	/nfs/dbraw/zinc/50/07/74/506500774.db2.gz	NPRFPORHLJRTSB-PCHAPFSGSA-N	-1	0	360.429	2.611	50	0		FFAARM
Cc1nc2sccn2c(=O)c1S(=O)(=O)[N-]c1ccc(Cl)cc1	ZINC000006859731	506511616	/nfs/dbraw/zinc/51/16/16/506511616.db2.gz	BQGRWDYNDXQMOV-UHFFFAOYSA-N	-1	0	355.828	2.519	50	0		FFAARM
Cc1nn(C)c(C)c1[N-]S(=O)(=O)c1cc(Br)ccc1C	ZINC000007420464	506561479	/nfs/dbraw/zinc/56/14/79/506561479.db2.gz	QZUMBTHAADAYTQ-UHFFFAOYSA-N	-1	0	358.261	2.909	50	0		FFAARM
O=C([N-]N1C(=O)NC2(CCCCC2)C1=O)c1cc2cc(Cl)ccc2o1	ZINC000008315916	506641792	/nfs/dbraw/zinc/64/17/92/506641792.db2.gz	FPBAPPBDWSJICV-UHFFFAOYSA-N	-1	0	361.785	2.986	50	0		FFAARM
COc1cc(NS(=O)(=O)c2ccc(F)cc2C)c(C(=O)[O-])cc1OC	ZINC000042666006	506652045	/nfs/dbraw/zinc/65/20/45/506652045.db2.gz	LRQQBNFGHQICOM-UHFFFAOYSA-N	-1	0	369.370	2.650	50	0		FFAARM
Cc1[nH]c(C)c(S(=O)(=O)[N-]c2cccc(F)c2)c1C(=O)N1CCCC1	ZINC000009684095	506708959	/nfs/dbraw/zinc/70/89/59/506708959.db2.gz	IXAHWIPLYBZZNW-UHFFFAOYSA-N	-1	0	365.430	2.807	50	0		FFAARM
CCCCCCc1c([O-])nc(SCC(N)=O)n(-c2ccccc2)c1=O	ZINC000009860975	506713814	/nfs/dbraw/zinc/71/38/14/506713814.db2.gz	ITJHGLQOAQDTRZ-UHFFFAOYSA-N	-1	0	361.467	2.638	50	0		FFAARM
CCOC(=O)[C@@]([N-]c1cc(Cl)ccc1OC)(NC(C)=O)C(F)(F)F	ZINC000012412259	506861209	/nfs/dbraw/zinc/86/12/09/506861209.db2.gz	WBVICDUBYHFJPZ-ZDUSSCGKSA-N	-1	0	368.739	2.718	50	0		FFAARM
Cc1cc(S(=O)(=O)Nc2ccc(F)c(F)c2F)sc1C(=O)[O-]	ZINC000045774664	507018445	/nfs/dbraw/zinc/01/84/45/507018445.db2.gz	SWNINSZBXLIXQI-UHFFFAOYSA-N	-1	0	351.327	2.973	50	0		FFAARM
O=C([O-])COc1cccc(C[N@@H+]2CC[C@@H](c3ccccc3C(=O)[O-])C2)c1	ZINC000072127125	507751363	/nfs/dbraw/zinc/75/13/63/507751363.db2.gz	SKSFHBDMARUQKB-OAHLLOKOSA-N	-1	0	355.390	2.838	50	0		FFAARM
O=C([O-])COc1cccc(C[N@@H+]2CC[C@H](c3ccccc3C(=O)[O-])C2)c1	ZINC000072127126	507751879	/nfs/dbraw/zinc/75/18/79/507751879.db2.gz	SKSFHBDMARUQKB-HNNXBMFYSA-N	-1	0	355.390	2.838	50	0		FFAARM
O=C([O-])[C@H]1c2nc[nH]c2CCN1C(=O)c1ccc2c(c1)[nH]c1c2CCCC1	ZINC000072474315	507795549	/nfs/dbraw/zinc/79/55/49/507795549.db2.gz	GUPUXPFFPWGDHD-GOSISDBHSA-N	-1	0	364.405	2.594	50	0		FFAARM
O=C(Nc1ccc([N-]S(=O)(=O)c2cccs2)cc1)[C@H]1CCCO1	ZINC000030531677	507809882	/nfs/dbraw/zinc/80/98/82/507809882.db2.gz	ZAHLBLOTFRWLBN-CYBMUJFWSA-N	-1	0	352.437	2.666	50	0		FFAARM
CC1(C)Cc2cc(S(=O)(=O)[N-]c3nnc(C(F)F)s3)ccc2O1	ZINC000079108548	507933914	/nfs/dbraw/zinc/93/39/14/507933914.db2.gz	RVDIVSVCUDMFOR-UHFFFAOYSA-N	-1	0	361.395	2.990	50	0		FFAARM
Cc1nc2cc(C(=O)N3C[C@@H](c4ccncc4)[C@H](C(=O)[O-])C3)ccc2s1	ZINC000091519422	507990525	/nfs/dbraw/zinc/99/05/25/507990525.db2.gz	GHBWMNQSKIVGBK-LSDHHAIUSA-N	-1	0	367.430	2.940	50	0		FFAARM
O=C([O-])CCn1cnc(-c2ccccc2)c1Cn1c(=O)oc2ccccc21	ZINC000092028252	508034665	/nfs/dbraw/zinc/03/46/65/508034665.db2.gz	YBJCUNDRCYQLSS-UHFFFAOYSA-N	-1	0	363.373	2.981	50	0		FFAARM
CCOC(=O)c1[nH]c(C)c(S(=O)(=O)[N-]c2ccc(C(C)=O)cc2)c1C	ZINC000075347988	508100053	/nfs/dbraw/zinc/10/00/53/508100053.db2.gz	OBBWEYBRDCUNIU-UHFFFAOYSA-N	-1	0	364.423	2.812	50	0		FFAARM
COc1cc(Cl)c(C)cc1[N-]S(=O)(=O)c1ccc2[nH]c(=O)oc2c1	ZINC000095351577	508174202	/nfs/dbraw/zinc/17/42/02/508174202.db2.gz	PRGQOLCTJLCNCL-UHFFFAOYSA-N	-1	0	368.798	2.892	50	0		FFAARM
C[C@@H](NC(=O)c1nn(-c2ccccc2C(F)(F)F)cc1[O-])[C@H]1CCCO1	ZINC000095356835	508175537	/nfs/dbraw/zinc/17/55/37/508175537.db2.gz	RDTARVLMQGKLPT-QMTHXVAHSA-N	-1	0	369.343	2.894	50	0		FFAARM
Cc1cc(C(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)[O-])nn1C(C)(C)C	ZINC000095424579	508185215	/nfs/dbraw/zinc/18/52/15/508185215.db2.gz	RYHIIRJQJXWPSL-QGZVFWFLSA-N	-1	0	368.437	2.854	50	0		FFAARM
CCOc1ccc2oc(=O)c(C(=O)Nc3cccc(C(=O)[O-])c3O)cc2c1	ZINC000095471133	508187959	/nfs/dbraw/zinc/18/79/59/508187959.db2.gz	IHBCUZBPCMENQD-UHFFFAOYSA-N	-1	0	369.329	2.848	50	0		FFAARM
O=C([O-])[C@H]1[C@H]2C(=O)N(c3ccc(C(F)(F)F)cc3Cl)C[C@@]23C=C[C@@H]1O3	ZINC000095495823	508189206	/nfs/dbraw/zinc/18/92/06/508189206.db2.gz	QLXZJAHCWHTALL-OXIQGZBJSA-N	-1	0	373.714	2.730	50	0		FFAARM
COc1ccc2c(cc(C(=O)N[C@@H](Cc3ccc(F)cc3)C(=O)[O-])n2C)c1	ZINC000095510792	508192644	/nfs/dbraw/zinc/19/26/44/508192644.db2.gz	UIDWKBUJDLYTKY-INIZCTEOSA-N	-1	0	370.380	2.752	50	0		FFAARM
Cc1c2cc(C)cc(C)c2[nH]c1C(=O)N[C@@H](Cc1ccncc1)C(=O)[O-]	ZINC000095521708	508195020	/nfs/dbraw/zinc/19/50/20/508195020.db2.gz	RLGLLYBLXKOJHY-INIZCTEOSA-N	-1	0	351.406	2.914	50	0		FFAARM
O=S(=O)([N-]c1cnn([C@@H]2CCOC2)c1)c1cccc(C(F)(F)F)c1	ZINC000096123272	508207696	/nfs/dbraw/zinc/20/76/96/508207696.db2.gz	MOZXBGPCYXWCDZ-GFCCVEGCSA-N	-1	0	361.345	2.664	50	0		FFAARM
COc1ccccc1OC1(C(=O)[O-])CCN(Cc2nccn2C(C)C)CC1	ZINC000082137088	508226732	/nfs/dbraw/zinc/22/67/32/508226732.db2.gz	GHAIWNVICKTZDP-UHFFFAOYSA-N	-1	0	373.453	2.971	50	0		FFAARM
O=C([O-])[C@H]1CCCCN1C(=O)c1nc(C2CC2)n(-c2ccccc2Cl)n1	ZINC000136522438	508699191	/nfs/dbraw/zinc/69/91/91/508699191.db2.gz	PSTMXDYTLQLCMF-CQSZACIVSA-N	-1	0	374.828	2.877	50	0		FFAARM
O=C(c1c([O-])cccc1F)N1CCC[C@@H](c2nnc3n2CCCCC3)C1	ZINC000119615844	508829309	/nfs/dbraw/zinc/82/93/09/508829309.db2.gz	KGNGNAMNMDLIAJ-CYBMUJFWSA-N	-1	0	358.417	2.869	50	0		FFAARM
Cc1ccc2ncccc2c1CNC(=O)c1cc(=O)n(-c2ccccc2)[n-]1	ZINC000216489049	509262581	/nfs/dbraw/zinc/26/25/81/509262581.db2.gz	GKQYYWBWOMCSRO-UHFFFAOYSA-N	-1	0	358.401	2.952	50	0		FFAARM
CN(Cc1ccccc1OC(F)(F)F)C(=O)c1ccc(C(=O)[O-])nc1	ZINC000237171376	509586761	/nfs/dbraw/zinc/58/67/61/509586761.db2.gz	YEVYWZAEFHVTDA-UHFFFAOYSA-N	-1	0	354.284	2.951	50	0		FFAARM
Cc1c(C(=O)N2CC[C@H](C(=O)[O-])C2)cnn1-c1cccc(C(F)(F)F)c1	ZINC000237765714	509730299	/nfs/dbraw/zinc/73/02/99/509730299.db2.gz	PVCVNGJRRMVNOA-NSHDSACASA-N	-1	0	367.327	2.746	50	0		FFAARM
Cc1nn(-c2ccc(F)cc2)c(Cl)c1C(=O)N1CCC[C@H](C(=O)[O-])C1	ZINC000237768233	509730634	/nfs/dbraw/zinc/73/06/34/509730634.db2.gz	LQMKGZSGWLPSKU-NSHDSACASA-N	-1	0	365.792	2.910	50	0		FFAARM
Cc1ccc(Br)cc1C(=O)N(CCC(=O)[O-])C1CCOCC1	ZINC000237782252	509733015	/nfs/dbraw/zinc/73/30/15/509733015.db2.gz	DBSGBKSASIXBMB-UHFFFAOYSA-N	-1	0	370.243	2.853	50	0		FFAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)COc2cccc(Br)c2)C1	ZINC000237950196	509783771	/nfs/dbraw/zinc/78/37/71/509783771.db2.gz	XKSDOHVVBHPKBG-LBPRGKRZSA-N	-1	0	370.243	2.931	50	0		FFAARM
O=C([O-])[C@H]1CN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CCO1	ZINC000237966767	509787540	/nfs/dbraw/zinc/78/75/40/509787540.db2.gz	CSQMKJGELXYALD-SNVBAGLBSA-N	-1	0	371.233	2.650	50	0		FFAARM
O=C([O-])CCN(Cc1ccc(F)c(F)c1)C(=O)[C@@H]1CC12CCOCC2	ZINC000238121863	509823628	/nfs/dbraw/zinc/82/36/28/509823628.db2.gz	QRYDQSBHPKSZMO-ZDUSSCGKSA-N	-1	0	353.365	2.585	50	0		FFAARM
O=C([O-])C[C@@H]1CN(C(=O)CC(c2ccccc2)c2ccccc2)CCO1	ZINC000238195385	509831867	/nfs/dbraw/zinc/83/18/67/509831867.db2.gz	KOAMHGZBGFOLLU-GOSISDBHSA-N	-1	0	353.418	2.911	50	0		FFAARM
O=C([O-])C[C@@H]1CN(C(=O)CCc2ccc(-c3ccccc3F)o2)CCO1	ZINC000238195551	509832441	/nfs/dbraw/zinc/83/24/41/509832441.db2.gz	YMFUUIPFGFJOHT-CQSZACIVSA-N	-1	0	361.369	2.720	50	0		FFAARM
Cn1cc(OCC(=O)Nc2cc(Cl)cc(Br)c2[O-])cn1	ZINC000253397619	509876995	/nfs/dbraw/zinc/87/69/95/509876995.db2.gz	ZQLYFEQQKSSJTN-UHFFFAOYSA-N	-1	0	360.595	2.559	50	0		FFAARM
Cc1oncc1[N-]S(=O)(=O)c1cnc(Cl)c(Br)c1	ZINC000253424090	509881182	/nfs/dbraw/zinc/88/11/82/509881182.db2.gz	AFYLMQUIHJPWHV-UHFFFAOYSA-N	-1	0	352.597	2.595	50	0		FFAARM
Cc1occc1-c1nnc(SCC(=O)[O-])n1N=Cc1ccc(O)cc1	ZINC000254742255	509908900	/nfs/dbraw/zinc/90/89/00/509908900.db2.gz	PQESIKAKBYJOHR-UHFFFAOYSA-N	-1	0	358.379	2.611	50	0		FFAARM
CC[C@](NC(=O)c1cccc(C(=O)N(C)C)c1)(C(=O)[O-])c1ccccc1	ZINC000262834669	510433141	/nfs/dbraw/zinc/43/31/41/510433141.db2.gz	YJGHWYOMUKLKGT-HXUWFJFHSA-N	-1	0	354.406	2.508	50	0		FFAARM
O=C([O-])[C@@H]1CCN(C(=O)CCCCOc2ccc(Br)cc2)C1	ZINC000178259162	510513305	/nfs/dbraw/zinc/51/33/05/510513305.db2.gz	LVXLBESCMHUHGJ-GFCCVEGCSA-N	-1	0	370.243	2.931	50	0		FFAARM
COc1ccc(-c2nnc(S(=O)(=O)Cc3ccccc3C)[n-]2)c(OC)c1	ZINC000195188712	510706737	/nfs/dbraw/zinc/70/67/37/510706737.db2.gz	LUCYCWCNVMRXNK-UHFFFAOYSA-N	-1	0	373.434	2.771	50	0		FFAARM
O=C([O-])[C@@]12CN(C(=O)c3cccc(=O)[nH]3)C[C@@H]1C[C@@H](c1ccccc1)CC2	ZINC000426489637	513955753	/nfs/dbraw/zinc/95/57/53/513955753.db2.gz	LLGVWIVHDNGLNX-QYWGDWMGSA-N	-1	0	366.417	2.898	50	0		FFAARM
CO[C@H](CS(=O)(=O)[N-]c1c(F)cccc1CO)c1ccc(F)cc1	ZINC000530133656	517584152	/nfs/dbraw/zinc/58/41/52/517584152.db2.gz	HSVJDTONEFBEAS-OAHLLOKOSA-N	-1	0	357.378	2.587	50	0		FFAARM
CSc1ncc(C(=O)[O-])c(-c2ccc([C@H](C)N3CCOCC3)cc2)n1	ZINC000534633689	517972687	/nfs/dbraw/zinc/97/26/87/517972687.db2.gz	IXPBHABLKIJPOS-LBPRGKRZSA-N	-1	0	359.451	2.957	50	0		FFAARM
CCOc1cc(C(=O)N[C@@H]2CCC[C@@H](SC)C2)ccc1OCC(=O)[O-]	ZINC000268950099	520664981	/nfs/dbraw/zinc/66/49/81/520664981.db2.gz	PQILPCDQLDGXMG-ZIAGYGMSSA-N	-1	0	367.467	2.953	50	0		FFAARM
Cc1nn(-c2ccccc2)c(C)c1/C=C\C(=O)N1CC[C@@](C)(C(=O)[O-])C1	ZINC000606441996	521069415	/nfs/dbraw/zinc/06/94/15/521069415.db2.gz	JJKDXGUXRIGTSF-GDCKJWNLSA-N	-1	0	353.422	2.826	50	0		FFAARM
Cc1oc(CN(C)C(=O)C[C@@H]2Sc3ccccc3NC2=O)cc1C(=O)[O-]	ZINC000299750597	534544578	/nfs/dbraw/zinc/54/45/78/534544578.db2.gz	OAOAFNFCRFOWMH-HNNXBMFYSA-N	-1	0	374.418	2.748	50	0		FFAARM
Cn1nc(C(=O)[O-])cc1C(=O)N(Cc1ccc(C(F)(F)F)cc1)C1CC1	ZINC000630108011	522623830	/nfs/dbraw/zinc/62/38/30/522623830.db2.gz	ZGRICJVEGSSLIT-UHFFFAOYSA-N	-1	0	367.327	2.942	50	0		FFAARM
Cc1conc1[N-]S(=O)(=O)c1cc(Br)cnc1Cl	ZINC000328594520	534759372	/nfs/dbraw/zinc/75/93/72/534759372.db2.gz	PYYNYSFWMNADFY-UHFFFAOYSA-N	-1	0	352.597	2.595	50	0		FFAARM
Cc1ccccc1[C@@H]1CN(C(=O)c2cc(CC(C)C)nn2C)C[C@H]1C(=O)[O-]	ZINC000091440961	525387224	/nfs/dbraw/zinc/38/72/24/525387224.db2.gz	OJDDIVBOIFLCBH-ZWKOTPCHSA-N	-1	0	369.465	2.867	50	0		FFAARM
O=C([O-])[C@@H]1CCCN1Cc1nc(-c2ccc(Br)s2)no1	ZINC000262625255	526275079	/nfs/dbraw/zinc/27/50/79/526275079.db2.gz	FYEYYLPVJZHLAK-ZETCQYMHSA-N	-1	0	358.217	2.610	50	0		FFAARM
O=C([O-])[C@@H]1CCN(C(=O)CCc2cc(Cl)ccc2Br)C1	ZINC000178264835	526278564	/nfs/dbraw/zinc/27/85/64/526278564.db2.gz	KAEAQLSUBAIYLU-SNVBAGLBSA-N	-1	0	360.635	2.968	50	0		FFAARM
Cc1oc(CN(C)C(=O)[C@H]2CC(=O)Nc3cc(F)ccc32)cc1C(=O)[O-]	ZINC000268940427	526769414	/nfs/dbraw/zinc/76/94/14/526769414.db2.gz	RTWDKDRETOSVPV-AWEZNQCLSA-N	-1	0	360.341	2.510	50	0		FFAARM
O=C([N-]O[C@@H]1CCCCO1)[C@H]1CC(=O)N(c2cccc3ccccc32)C1	ZINC000065513493	526852687	/nfs/dbraw/zinc/85/26/87/526852687.db2.gz	WEFSUUPGKYLXGH-HNAYVOBHSA-N	-1	0	354.406	2.767	50	0		FFAARM
Cc1nc(COc2ccc(F)cc2)sc1C(=O)N1CCC[C@@H]1C(=O)[O-]	ZINC000178276338	526907447	/nfs/dbraw/zinc/90/74/47/526907447.db2.gz	XAROIBRYTIVSRP-CYBMUJFWSA-N	-1	0	364.398	2.859	50	0		FFAARM
O=C([O-])C[C@@H](NC(=O)[C@@H]1CCCOC1)c1ccc(Br)cc1	ZINC000238142817	527626033	/nfs/dbraw/zinc/62/60/33/527626033.db2.gz	OFVZEKGKGQKNJG-DGCLKSJQSA-N	-1	0	356.216	2.508	50	0		FFAARM
O=C([O-])[C@@H](Cc1ccccc1)NC(=O)COc1cccc(C(F)(F)F)c1	ZINC000216619425	527649419	/nfs/dbraw/zinc/64/94/19/527649419.db2.gz	VILLYLRIUBMZMS-OAHLLOKOSA-N	-1	0	367.323	2.896	50	0		FFAARM
Cc1ccc(C(=O)Nc2ccccc2)cc1S(=O)(=O)[N-]c1nncs1	ZINC000085428918	571115481	/nfs/dbraw/zinc/11/54/81/571115481.db2.gz	MTVHPNFAITXRGN-UHFFFAOYSA-N	-1	0	374.447	2.900	50	0		FFAARM
CC(C)(C)OC(=O)N1C[C@@H](Oc2cc(F)c(F)c(F)c2)C[C@H]1C(=O)[O-]	ZINC000203307396	571309425	/nfs/dbraw/zinc/30/94/25/571309425.db2.gz	WARUCKBOLSMBAQ-CABZTGNLSA-N	-1	0	361.316	2.945	50	0		FFAARM
O=C([O-])C1(NC(=O)N2CCC([C@@H](O)CCc3ccccc3)CC2)CCCC1	ZINC000670448731	571351717	/nfs/dbraw/zinc/35/17/17/571351717.db2.gz	KUGJDGMIUKELKI-SFHVURJKSA-N	-1	0	374.481	2.799	50	0		FFAARM
O=C([O-])[C@H]1CN(C(=O)/C=C(\c2ccc(Cl)cc2)C(F)(F)F)CCO1	ZINC000584908408	602352340	/nfs/dbraw/zinc/35/23/40/602352340.db2.gz	NLJJQJZENVJRRS-YTRUQHMWSA-N	-1	0	363.719	2.598	50	0		FFAARM
O=C([O-])C1CCC(CNC(=O)c2cc(-n3cnnc3)ccc2Cl)CC1	ZINC000952963482	740470925	/nfs/dbraw/zinc/47/09/25/740470925.db2.gz	TXRZIUYHCVWRHE-UHFFFAOYSA-N	-1	0	362.817	2.542	50	0		FFAARM
Cc1ccc(C(C)(C)C)cc1S(=O)(=O)[N-]C(=O)/C=C\c1ccncn1	ZINC000588538970	845978014	/nfs/dbraw/zinc/97/80/14/845978014.db2.gz	XFCSPZRGCHUJJA-FPLPWBNLSA-N	-1	0	359.451	2.601	50	0		FFAARM
CC[C@H](NS(=O)(=O)c1ccsc1C(=O)[O-])c1nc(C)c(C)s1	ZINC000822668923	998918847	/nfs/dbraw/zinc/91/88/47/998918847.db2.gz	YGTPZQIMAWJKOI-VIFPVBQESA-N	-1	0	360.482	2.949	50	0		FFAARM
CCOc1ccc(-c2ccnc(N(C)Cc3cnccn3)n2)cc1C(=O)[O-]	ZINC000077506047	1020673090	/nfs/dbraw/zinc/67/30/90/1020673090.db2.gz	PKGVUZATYPPUIP-UHFFFAOYSA-N	-1	0	365.393	2.667	50	0		FFAARM
Cc1cccc(-c2cccc(C(=O)N[C@@H](C)c3n[nH]c(CC(=O)[O-])n3)c2)c1	ZINC001506408815	1059502356	/nfs/dbraw/zinc/50/23/56/1059502356.db2.gz	QHIQTROUWSWUTP-ZDUSSCGKSA-N	-1	0	364.405	2.898	50	0		FFAARM
CN(Cc1ccc(C(=O)[O-])cc1)C(=O)[C@H]1C[C@@H]1c1ccc2c(c1)OCCO2	ZINC000299747616	529984058	/nfs/dbraw/zinc/98/40/58/529984058.db2.gz	DKFLKNCHKFSRKF-SJORKVTESA-N	-1	0	367.401	2.918	50	0		FFAARM
Cc1ccc(S(=O)(=O)N2CCC(C(=O)[O-])(c3ccccc3)CC2)cc1	ZINC000000640078	219307390	/nfs/dbraw/zinc/30/73/90/219307390.db2.gz	RUPQNAVADOVYKW-UHFFFAOYSA-N	-1	0	359.447	2.802	50	0	in-vitro	FFAARM
O=c1c2c3ccc(Br)c([O-])c3sc2nc2n1CCOC2	ZINC000000754391	219317755	/nfs/dbraw/zinc/31/77/55/219317755.db2.gz	NFLWRXSQWMWBJH-UHFFFAOYSA-N	-1	0	353.197	2.610	50	0		FFAARM
O=C(Nc1ccc(S(=O)(=O)[N-]c2ccccn2)cc1)c1ccncc1	ZINC000000790878	219321984	/nfs/dbraw/zinc/32/19/84/219321984.db2.gz	YDHPJYFSYSNTMZ-UHFFFAOYSA-N	-1	0	354.391	2.530	50	0		FFAARM
COc1ccccc1NC(=O)c1nc[n-]c1C(=O)Nc1ccccc1OC	ZINC000000831474	219327588	/nfs/dbraw/zinc/32/75/88/219327588.db2.gz	VCUKLUJYKUXHKQ-UHFFFAOYSA-N	-1	0	366.377	2.932	50	0		FFAARM
Cc1cccc(OCC(=O)N[C@H](Cc2c[nH]c3ccccc23)C(=O)[O-])c1C	ZINC000000956374	219346405	/nfs/dbraw/zinc/34/64/05/219346405.db2.gz	RWUOGTGHMBJQEI-GOSISDBHSA-N	-1	0	366.417	2.976	50	0		FFAARM
COc1cc(OC)cc(C(=O)NC(=S)Nc2cccc(C(=O)[O-])c2)c1	ZINC000001156843	219382570	/nfs/dbraw/zinc/38/25/70/219382570.db2.gz	MUWUMJQISSGPGN-UHFFFAOYSA-N	-1	0	360.391	2.529	50	0		FFAARM
CCCCc1nnc(NC(=O)CC(=O)Nc2ccccc2C(=O)[O-])s1	ZINC000002275024	219435256	/nfs/dbraw/zinc/43/52/56/219435256.db2.gz	OTJCHHBFCSVAHW-UHFFFAOYSA-N	-1	0	362.411	2.546	50	0		FFAARM
O=C([O-])c1c(NC(=O)C(=O)NCCc2ccccc2)sc2c1CCCC2	ZINC000006760831	219767169	/nfs/dbraw/zinc/76/71/69/219767169.db2.gz	XZEMILLMCSZOME-UHFFFAOYSA-N	-1	0	372.446	2.623	50	0		FFAARM
O=C([O-])c1ccc(-c2nnc(SCC(=O)NC3CCCCC3)o2)cc1	ZINC000009319572	219877746	/nfs/dbraw/zinc/87/77/46/219877746.db2.gz	QPBHGHSDPMXBRK-UHFFFAOYSA-N	-1	0	361.423	2.976	50	0		FFAARM
COc1cc(C(=O)N(C)Cc2nc(=O)c3sccc3[n-]2)cc(OC)c1C	ZINC000012872303	220038108	/nfs/dbraw/zinc/03/81/08/220038108.db2.gz	LEHBZWOAZKLZCQ-UHFFFAOYSA-N	-1	0	373.434	2.582	50	0		FFAARM
COc1cc(NS(=O)(=O)c2cccc(Cl)c2)c(C(=O)[O-])cc1OC	ZINC000013263143	220062215	/nfs/dbraw/zinc/06/22/15/220062215.db2.gz	XPPHITYMNMWAOM-UHFFFAOYSA-N	-1	0	371.798	2.856	50	0		FFAARM
COc1ccc(CCC(=O)N[C@@H](CC(=O)[O-])c2ccccc2)cc1OC	ZINC000013224562	220061370	/nfs/dbraw/zinc/06/13/70/220061370.db2.gz	LXZNZKFVHGGHFW-INIZCTEOSA-N	-1	0	357.406	2.969	50	0		FFAARM
CCCn1nc(-n2cnnc2)c([N-]S(=O)(=O)c2ccc(CC)cc2)c1C	ZINC000013365439	220065485	/nfs/dbraw/zinc/06/54/85/220065485.db2.gz	JCJLWBCKCUDYSE-UHFFFAOYSA-N	-1	0	374.470	2.545	50	0		FFAARM
COc1ccc(OC)c([C@H](C)NC(=O)COc2ccc(CC(=O)[O-])cc2)c1	ZINC000013421427	220066900	/nfs/dbraw/zinc/06/69/00/220066900.db2.gz	GCULTVKZKGWTKY-ZDUSSCGKSA-N	-1	0	373.405	2.587	50	0		FFAARM
O=C([O-])[C@@H]1C[C@H](O)CCN1C(=O)OCC1c2ccccc2-c2ccccc21	ZINC000014632650	220128837	/nfs/dbraw/zinc/12/88/37/220128837.db2.gz	CJGSLUBWMLBOFZ-YJYMSZOUSA-N	-1	0	367.401	2.845	50	0		FFAARM
CN(C)c1ccc(N2C(=O)C[C@@H](Sc3ccccc3C(=O)[O-])C2=O)cc1	ZINC000019902685	220303530	/nfs/dbraw/zinc/30/35/30/220303530.db2.gz	HFWIBNGPTDQELD-MRXNPFEDSA-N	-1	0	370.430	2.875	50	0		FFAARM
COc1cc([C@@H](CC(=O)[O-])N2Cc3ccccc3C2=O)cc(OC)c1OC	ZINC000020213850	220318917	/nfs/dbraw/zinc/31/89/17/220318917.db2.gz	OJRNNKQXPNPTSI-OAHLLOKOSA-N	-1	0	371.389	2.884	50	0		FFAARM
O=C(Nc1ccccc1SCc1cc(=O)n2nc[n-]c2n1)c1ccco1	ZINC000021147894	220354042	/nfs/dbraw/zinc/35/40/42/220354042.db2.gz	KWBFOHSJIGQEHS-UHFFFAOYSA-N	-1	0	367.390	2.968	50	0		FFAARM
CCc1ccc(NC(=O)CCC2=Nc3ccccc3S(=O)(=O)[N-]2)cc1	ZINC000021661314	220362304	/nfs/dbraw/zinc/36/23/04/220362304.db2.gz	VDXWPKJAYHQPIS-UHFFFAOYSA-N	-1	0	357.435	2.990	50	0		FFAARM
CCc1ccc([C@@H](O)COc2ccc(C[C@@H]3SC(=O)[N-]C3=O)cc2)nc1	ZINC000021981311	220372143	/nfs/dbraw/zinc/37/21/43/220372143.db2.gz	RMTFRGFLVHAYCI-IRXDYDNUSA-N	-1	0	372.446	2.651	50	0	in-vitro	FFAARM
O=C([O-])CNc1ncc(CN(Cc2ccsc2)Cc2ccco2)cn1	ZINC000055211711	221061922	/nfs/dbraw/zinc/06/19/22/221061922.db2.gz	MLWHSMHPEWTJQA-UHFFFAOYSA-N	-1	0	358.423	2.830	50	0		FFAARM
O=S(=O)([N-]c1ccccc1Cn1cncn1)c1ccc(Cl)cc1F	ZINC000055686706	221074031	/nfs/dbraw/zinc/07/40/31/221074031.db2.gz	YPNRMOURMJIUNJ-UHFFFAOYSA-N	-1	0	366.805	2.920	50	0		FFAARM
COc1cccc(NC(=O)C[C@H]2Sc3cc(C(=O)[O-])ccc3NC2=O)c1	ZINC000061718375	221134197	/nfs/dbraw/zinc/13/41/97/221134197.db2.gz	WFCFENIRKJBXPO-OAHLLOKOSA-N	-1	0	372.402	2.835	50	0		FFAARM
COc1ccccc1NC(=O)C[C@H]1Sc2cc(C(=O)[O-])ccc2NC1=O	ZINC000061718086	221134220	/nfs/dbraw/zinc/13/42/20/221134220.db2.gz	PFVPJLCCQPWLGI-OAHLLOKOSA-N	-1	0	372.402	2.835	50	0		FFAARM
O=C([O-])c1ccccc1CC(=O)Nc1ccn(Cc2ccc(F)cc2)n1	ZINC000071280317	221336955	/nfs/dbraw/zinc/33/69/55/221336955.db2.gz	MCRYYLIAVJBLCT-UHFFFAOYSA-N	-1	0	353.353	2.950	50	0		FFAARM
Cc1cc2c[nH]nc2cc1[N-]S(=O)(=O)c1cnn(-c2ccccc2)c1	ZINC000069508926	221326060	/nfs/dbraw/zinc/32/60/60/221326060.db2.gz	ZJNNIMYSICSGIS-UHFFFAOYSA-N	-1	0	353.407	2.858	50	0		FFAARM
O=C(CCCNC(=O)c1ccccc1)Nc1ccc(-c2nc(=O)o[n-]2)cc1	ZINC000070012775	221330759	/nfs/dbraw/zinc/33/07/59/221330759.db2.gz	WINDAWIWXMBVAO-UHFFFAOYSA-N	-1	0	366.377	2.591	50	0		FFAARM
CN(C)C(=O)c1ccc(NC(=O)Cc2ccccc2C(=O)[O-])cc1Cl	ZINC000071287585	221340170	/nfs/dbraw/zinc/34/01/70/221340170.db2.gz	XQWAEIWITMQOQG-UHFFFAOYSA-N	-1	0	360.797	2.921	50	0		FFAARM
Cc1c(C(=O)N2CCCC[C@@H]2c2n[nH]c(=O)[n-]2)cnn1-c1ccccc1F	ZINC000329186401	258131923	/nfs/dbraw/zinc/13/19/23/258131923.db2.gz	PVPXYLOSMIVZRR-OAHLLOKOSA-N	-1	0	370.388	2.511	50	0		FFAARM
COc1ccc2oc(C)c(C(=O)N(CCC(=O)[O-])C[C@@H]3CCCO3)c2c1	ZINC000299753603	533354106	/nfs/dbraw/zinc/35/41/06/533354106.db2.gz	YTUWUOXANJAKCO-AWEZNQCLSA-N	-1	0	361.394	2.846	50	0		FFAARM
CC(=O)N1CC2(C[C@H]1C(=O)[O-])CCN(c1ccc3ccccc3n1)CC2	ZINC000082096521	132194166	/nfs/dbraw/zinc/19/41/66/132194166.db2.gz	FKUMDCIJOZLPHD-KRWDZBQOSA-N	-1	0	353.422	2.527	50	0		FFAARM
Cc1cc(N2CCN(c3nccs3)CC2)nc(-c2ccccc2[O-])n1	ZINC000091713867	132203407	/nfs/dbraw/zinc/20/34/07/132203407.db2.gz	VNKZNGLTVJJGBJ-UHFFFAOYSA-N	-1	0	353.451	2.941	50	0		FFAARM
Cc1nc(C2CCN(c3cc(C)nc(-c4ccccc4[O-])n3)CC2)n[nH]1	ZINC000092028492	132205688	/nfs/dbraw/zinc/20/56/88/132205688.db2.gz	VMILIVYDATUHAT-UHFFFAOYSA-N	-1	0	350.426	2.968	50	0		FFAARM
Cc1ccc(S(=O)(=O)N2c3ccc(F)cc3OC[C@H]2CC(=O)[O-])cc1	ZINC000299803896	132300839	/nfs/dbraw/zinc/30/08/39/132300839.db2.gz	JXVKRTGSRKXUSN-CYBMUJFWSA-N	-1	0	365.382	2.565	50	0		FFAARM
CC(C)c1ccc(S(=O)(=O)N2C[C@@H](C(=O)[O-])Oc3ccccc32)cc1	ZINC000014114467	132306558	/nfs/dbraw/zinc/30/65/58/132306558.db2.gz	SKCZPGVHAOQPIB-KRWDZBQOSA-N	-1	0	361.419	2.851	50	0		FFAARM
CN1c2ccccc2C([O-])=C(C(=O)Nc2cccc(Cl)c2)S1(=O)=O	ZINC000006002650	132831153	/nfs/dbraw/zinc/83/11/53/132831153.db2.gz	IGQZSUJPKKHKLG-UHFFFAOYSA-N	-1	0	364.810	2.985	50	0		FFAARM
COc1cccc([C@@H]2CN(C(=O)Cc3ccc(F)cc3)C[C@H]2C(=O)[O-])c1	ZINC000092098514	221839954	/nfs/dbraw/zinc/83/99/54/221839954.db2.gz	ZGYCIYJZSSJKKF-ZWKOTPCHSA-N	-1	0	357.381	2.704	50	0		FFAARM
CC(=O)Nc1cc(C(=O)N[C@@H](C(=O)[O-])c2ccccc2Cl)ccc1F	ZINC000095989730	221986169	/nfs/dbraw/zinc/98/61/69/221986169.db2.gz	BYAQIWFZILBDPS-OAHLLOKOSA-N	-1	0	364.760	2.993	50	0		FFAARM
COC(=O)[C@H]1Oc2c(c(=O)oc3ccccc23)[C@H]1c1ccc(C(=O)[O-])cc1	ZINC000096335818	222115951	/nfs/dbraw/zinc/11/59/51/222115951.db2.gz	DLNHLZWTNXWJPT-PBHICJAKSA-N	-1	0	366.325	2.557	50	0		FFAARM
COc1cc(/C=C\C(=O)N2CCC(C(=O)[O-])CC2)cc(Cl)c1OC	ZINC000096794566	222130361	/nfs/dbraw/zinc/13/03/61/222130361.db2.gz	GTIVFSBZSQCFKC-ARJAWSKDSA-N	-1	0	353.802	2.694	50	0		FFAARM
CC(=O)Nc1ccc(NS(=O)(=O)c2ccc(/C=C\C(=O)[O-])cc2)cc1C	ZINC000096996695	222149387	/nfs/dbraw/zinc/14/93/87/222149387.db2.gz	SRARTTIXXKAEIC-YHYXMXQVSA-N	-1	0	374.418	2.852	50	0		FFAARM
CCn1c2ccccc2c([O-])c(C(=O)Nc2nnc(C(C)C)s2)c1=O	ZINC000100512682	222246392	/nfs/dbraw/zinc/24/63/92/222246392.db2.gz	HUHCOPDGQXCCLU-UHFFFAOYSA-N	-1	0	358.423	2.954	50	0		FFAARM
COc1cccc(-n2c(=O)c3[n-][nH]n(-c4cccc(Cl)c4)c=3c2=O)c1	ZINC000102818222	222309257	/nfs/dbraw/zinc/30/92/57/222309257.db2.gz	WSKUWHKKNDAKHO-LSDHHAIUSA-N	-1	0	356.769	2.846	50	0		FFAARM
C[C@@H](Oc1ccccc1Br)C(=O)N1CCC[C@H](C(=O)[O-])C1	ZINC000136165339	222544170	/nfs/dbraw/zinc/54/41/70/222544170.db2.gz	OWPOGKFKAKTOGA-MNOVXSKESA-N	-1	0	356.216	2.540	50	0		FFAARM
O=C([O-])[C@@H]1CCCN(C(=O)c2ccc(CNC(=O)c3cccs3)cc2)C1	ZINC000136144963	222544638	/nfs/dbraw/zinc/54/46/38/222544638.db2.gz	ANECDUYFYRRPJP-OAHLLOKOSA-N	-1	0	372.446	2.615	50	0		FFAARM
O=C([O-])[C@H]1CC=CC[C@@H]1C(=O)Nc1ccc(I)cc1	ZINC000004610423	263335244	/nfs/dbraw/zinc/33/52/44/263335244.db2.gz	CNBCFMDYNFYBIT-RYUDHWBXSA-N	-1	0	371.174	2.897	50	0		FFAARM
CCCS(=O)(=O)[N-]c1c2c(ccc1OC)n(C)c(C)c2C(=O)OCC	ZINC000002235700	506273781	/nfs/dbraw/zinc/27/37/81/506273781.db2.gz	NDSYXMXEXSFZEW-UHFFFAOYSA-N	-1	0	368.455	2.824	50	0		FFAARM
Cc1c(O)ccc2c(C)c(CCC(=O)N3CCCC[C@H]3C(=O)[O-])c(=O)oc12	ZINC000002431984	506280396	/nfs/dbraw/zinc/28/03/96/506280396.db2.gz	FPKOXWRVOIQMKK-HNNXBMFYSA-N	-1	0	373.405	2.514	50	0		FFAARM
Cc1cc2nc3s/c(=C\c4ccc(C(=O)[O-])cc4)c(=O)n3c2cc1C	ZINC000002817521	506296846	/nfs/dbraw/zinc/29/68/46/506296846.db2.gz	GPMDBZKVNFACPS-SXGWCWSVSA-N	-1	0	350.399	2.772	50	0		FFAARM
CC(C)(C)c1csc(NC(=O)[C@@H](CC(=O)[O-])NCc2ccco2)n1	ZINC000002857246	506298820	/nfs/dbraw/zinc/29/88/20/506298820.db2.gz	DEQDDVZZYFDHPD-LLVKDONJSA-N	-1	0	351.428	2.605	50	0		FFAARM
COC(=O)c1ccccc1NC(=O)Cc1c2ccccc2[nH]c1C(=O)[O-]	ZINC000003906694	506351712	/nfs/dbraw/zinc/35/17/12/506351712.db2.gz	YMNNHDCHPZPKOB-UHFFFAOYSA-N	-1	0	352.346	2.834	50	0		FFAARM
O=C(CCc1nnc(-c2cccs2)[n-]c1=O)NCc1ccc(F)cc1	ZINC000034768094	506369846	/nfs/dbraw/zinc/36/98/46/506369846.db2.gz	NRZMHQDXEKPGGA-UHFFFAOYSA-N	-1	0	358.398	2.694	50	0		FFAARM
O=C([O-])c1ccccc1C(=O)NCCNc1ccc(C(F)(F)F)cn1	ZINC000004299548	506369994	/nfs/dbraw/zinc/36/99/94/506369994.db2.gz	JJADPGJGJWGZCW-UHFFFAOYSA-N	-1	0	353.300	2.641	50	0		FFAARM
COc1cc(S(=O)(=O)[N-]c2cccc(C)n2)ccc1Br	ZINC000004809385	506395856	/nfs/dbraw/zinc/39/58/56/506395856.db2.gz	JPCNTXNHDSWDRC-UHFFFAOYSA-N	-1	0	357.229	2.962	50	0		FFAARM
COc1ccc(S(=O)(=O)N(CC(=O)[O-])c2cccc(Cl)c2)cc1	ZINC000004978376	506410914	/nfs/dbraw/zinc/41/09/14/506410914.db2.gz	RCMSSALTPNVXMQ-UHFFFAOYSA-N	-1	0	355.799	2.629	50	0		FFAARM
CCc1ccccc1NC(=O)[C@H](Cc1ccc(OC)cc1)c1nnn[n-]1	ZINC000005445037	506442891	/nfs/dbraw/zinc/44/28/91/506442891.db2.gz	SUBSPKNIVZERNA-MRXNPFEDSA-N	-1	0	351.410	2.736	50	0		FFAARM
COc1cccc(C[C@@H](C(=O)Nc2ccccc2Cl)c2nnn[n-]2)c1	ZINC000005671091	506452392	/nfs/dbraw/zinc/45/23/92/506452392.db2.gz	KWZXYKYFGSMHII-CYBMUJFWSA-N	-1	0	357.801	2.827	50	0		FFAARM
COc1ccc(-c2nc(C)c(C(=O)NCCCC(=O)[O-])s2)cc1OC	ZINC000040287896	506479839	/nfs/dbraw/zinc/47/98/39/506479839.db2.gz	FYELMFMBBZIEDQ-UHFFFAOYSA-N	-1	0	364.423	2.730	50	0		FFAARM
Cc1cc(I)ccc1NC(=O)N=C([O-])C(F)(F)F	ZINC000006700971	506498700	/nfs/dbraw/zinc/49/87/00/506498700.db2.gz	YKUCNFMTCTYWRA-UHFFFAOYSA-N	-1	0	372.084	2.810	50	0		FFAARM
Cc1ccccc1CN1CCN(C(=O)[C@@H]2C3CCC(CC3)[C@H]2C(=O)[O-])CC1	ZINC000006742236	506502595	/nfs/dbraw/zinc/50/25/95/506502595.db2.gz	PMDQKGUKRVSLDM-OTGCGEFBSA-N	-1	0	370.493	2.776	50	0		FFAARM
CCc1cccc(C)c1[N-]S(=O)(=O)c1ccc(-c2ccc(=O)[nH]n2)o1	ZINC000006887552	506513287	/nfs/dbraw/zinc/51/32/87/506513287.db2.gz	DNUISSZUIPKYQU-UHFFFAOYSA-N	-1	0	359.407	2.702	50	0		FFAARM
COc1cc(C=Cc2nc3ccccc3c(=O)[nH]2)ccc1OCC(=O)[O-]	ZINC000006908292	506515796	/nfs/dbraw/zinc/51/57/96/506515796.db2.gz	UIMKNGPVABPJAZ-VQHVLOKHSA-N	-1	0	352.346	2.566	50	0		FFAARM
O=C1CCCN1c1ccc([N-]S(=O)(=O)c2c(F)cccc2F)cc1	ZINC000007612599	506573654	/nfs/dbraw/zinc/57/36/54/506573654.db2.gz	MAMOODCTMDFJRQ-UHFFFAOYSA-N	-1	0	352.362	2.892	50	0		FFAARM
CN1CCOc2ccc([N-]S(=O)(=O)c3ccc(Cl)s3)cc2C1=O	ZINC000008961554	506675941	/nfs/dbraw/zinc/67/59/41/506675941.db2.gz	IZUOZTVZOGZISE-UHFFFAOYSA-N	-1	0	372.855	2.667	50	0		FFAARM
CC[C@H](C)n1c(=O)[nH]c([O-])c([C@H]2c3[nH]c4ccccc4c3CCN2C)c1=O	ZINC000009011855	506677700	/nfs/dbraw/zinc/67/77/00/506677700.db2.gz	MYWOOYZAOLXOOB-GTNSWQLSSA-N	-1	0	368.437	2.684	50	0	biogenic	FFAARM
COc1ccc(-n2[n-]c3cc(=O)n(Cc4ccccc4)c(C)c3c2=O)cc1	ZINC000009482396	506699244	/nfs/dbraw/zinc/69/92/44/506699244.db2.gz	ANKFMCUMWMEHBE-UHFFFAOYSA-N	-1	0	361.401	2.846	50	0		FFAARM
COc1ccc(OC)c(S(=O)(=O)[N-]c2nnc(CC(C)C)s2)c1	ZINC000011615617	506783127	/nfs/dbraw/zinc/78/31/27/506783127.db2.gz	YJCVUKVCSBMCNE-UHFFFAOYSA-N	-1	0	357.457	2.555	50	0		FFAARM
O=C([O-])[C@H](Cc1ccccc1)NC(=O)N1CCc2c3ccccc3[nH]c2C1	ZINC000011692316	506788998	/nfs/dbraw/zinc/78/89/98/506788998.db2.gz	XMPSHBGQQYRLFX-SFHVURJKSA-N	-1	0	363.417	2.932	50	0	biogenic	FFAARM
O=C1CCCN1c1cccc([N-]S(=O)(=O)c2cc(F)cc(F)c2)c1	ZINC000012552425	506878596	/nfs/dbraw/zinc/87/85/96/506878596.db2.gz	LIMPCNDOCLXTLY-UHFFFAOYSA-N	-1	0	352.362	2.892	50	0		FFAARM
O=C([O-])[C@H]1c2ccccc2C(=O)N(C2CC2)[C@H]1c1ccc2c(c1)OCO2	ZINC000045923009	507045742	/nfs/dbraw/zinc/04/57/42/507045742.db2.gz	JHRFIVIKSLXTHD-ROUUACIJSA-N	-1	0	351.358	2.943	50	0		FFAARM
CCc1nc2sc([C@@H](c3cccc(C)c3)N3CCOCC3)c([O-])n2n1	ZINC000022854232	507316052	/nfs/dbraw/zinc/31/60/52/507316052.db2.gz	AQAJEQIPKXXNLO-OAHLLOKOSA-N	-1	0	358.467	2.789	50	0		FFAARM
COc1ccc(N2C(=O)C[C@@H](Nc3ccc(C(=O)[O-])cc3)C2=O)cc1Cl	ZINC000025480248	507505180	/nfs/dbraw/zinc/50/51/80/507505180.db2.gz	PXJGEZBUFMDKHO-CQSZACIVSA-N	-1	0	374.780	2.791	50	0		FFAARM
CN(Cc1nc(=O)c2sccc2[n-]1)C(=O)Cc1c[nH]c2ccccc12	ZINC000028970230	507753189	/nfs/dbraw/zinc/75/31/89/507753189.db2.gz	PEFRFHOCJZLWEU-UHFFFAOYSA-N	-1	0	352.419	2.667	50	0		FFAARM
O=C([O-])c1ccc(C[C@@H]2CCCN(C(=O)CCCc3cn[nH]c3)C2)cc1	ZINC000072158814	507764550	/nfs/dbraw/zinc/76/45/50/507764550.db2.gz	KDFIFFCDWCNLEC-INIZCTEOSA-N	-1	0	355.438	2.912	50	0		FFAARM
COc1cc(F)c(CN2CCCn3nc(CCC(=O)[O-])cc3C2)c(F)c1	ZINC000072475155	507795654	/nfs/dbraw/zinc/79/56/54/507795654.db2.gz	ZZLUFBCVEVOWGI-UHFFFAOYSA-N	-1	0	365.380	2.593	50	0		FFAARM
COc1cccc([C@@H]2CN(C(=O)c3n[nH]c4ccccc43)C[C@H]2C(=O)[O-])c1	ZINC000091574382	507993252	/nfs/dbraw/zinc/99/32/52/507993252.db2.gz	XYLOPKHRTRSQPF-JKSUJKDBSA-N	-1	0	365.389	2.512	50	0		FFAARM
COc1c(C)cc([C@H](C(=O)[O-])N2CCN(Cc3ccccn3)CC2)cc1C	ZINC000095367960	508177414	/nfs/dbraw/zinc/17/74/14/508177414.db2.gz	PENWARMDMVZSEO-LJQANCHMSA-N	-1	0	369.465	2.651	50	0		FFAARM
Cc1cccc(C(=O)NC2(C(=O)[O-])CCCC2)c1I	ZINC000095367875	508177861	/nfs/dbraw/zinc/17/78/61/508177861.db2.gz	WXQPHOQPGCEQIE-UHFFFAOYSA-N	-1	0	373.190	2.727	50	0		FFAARM
CN(Cc1ccon1)[C@H](C(=O)[O-])c1ccc(NC(=O)N2CCCC2)cc1	ZINC000095385508	508182238	/nfs/dbraw/zinc/18/22/38/508182238.db2.gz	BYEMBPZYYNAPEQ-INIZCTEOSA-N	-1	0	358.398	2.560	50	0		FFAARM
COc1cc(C)c(S(=O)(=O)[N-]c2cc(-c3ccncc3)[nH]n2)cc1OC	ZINC000084077449	508265038	/nfs/dbraw/zinc/26/50/38/508265038.db2.gz	JDEQSHHROFPXQT-UHFFFAOYSA-N	-1	0	374.422	2.598	50	0		FFAARM
CC(C)(C)C(=O)N1CCc2ccc(S(=O)(=O)[N-]c3cccnc3)cc2C1	ZINC000077469980	508320143	/nfs/dbraw/zinc/32/01/43/508320143.db2.gz	FOJOAKILUQDRQZ-UHFFFAOYSA-N	-1	0	373.478	2.813	50	0		FFAARM
O=C([O-])c1ccnc(-c2ccnc(NCCC(=O)Nc3ccccc3)n2)c1	ZINC000077538469	508330242	/nfs/dbraw/zinc/33/02/42/508330242.db2.gz	SYWYSEGOJSQSFZ-UHFFFAOYSA-N	-1	0	363.377	2.678	50	0		FFAARM
CC(=O)N(c1nc(/C=C2/NC(=S)NC2=O)cs1)c1ccc(C)c(C)c1	ZINC000105417123	508373155	/nfs/dbraw/zinc/37/31/55/508373155.db2.gz	QINWJIMWWOXHNE-VGOFMYFVSA-N	-1	0	372.475	2.790	50	0		FFAARM
Cc1ccccc1C1(C(=O)N2CCC[C@H](n3cc(C(=O)[O-])cn3)C2)CC1	ZINC000153162926	508554251	/nfs/dbraw/zinc/55/42/51/508554251.db2.gz	XGPCPNAHMXSYJA-INIZCTEOSA-N	-1	0	353.422	2.785	50	0		FFAARM
C[C@@H](Cc1cccc(F)c1)C(=O)N1CCC[C@@H](n2cc(C(=O)[O-])cn2)C1	ZINC000153230678	508561266	/nfs/dbraw/zinc/56/12/66/508561266.db2.gz	ACNZSOQUDRAGFD-SUMWQHHRSA-N	-1	0	359.401	2.763	50	0		FFAARM
O=C(c1ccc2[n-]c(=S)oc2c1)N1CCOC[C@H]1C[C@@H](O)c1ccco1	ZINC000159014748	508780845	/nfs/dbraw/zinc/78/08/45/508780845.db2.gz	BQPDQORTTGIUFX-TZMCWYRMSA-N	-1	0	374.418	2.674	50	0		FFAARM
CC(=O)Nc1ncc(S(=O)(=O)[N-]c2ccccc2OC(F)F)s1	ZINC000225796988	509388285	/nfs/dbraw/zinc/38/82/85/509388285.db2.gz	XXZHJFIYHQOXBF-UHFFFAOYSA-N	-1	0	363.367	2.504	50	0		FFAARM
COc1cccc([C@@H]2C[C@@H]2C(=O)N2Cc3ccccc3C[C@H]2C(=O)[O-])c1	ZINC000299752525	533740112	/nfs/dbraw/zinc/74/01/12/533740112.db2.gz	ULZMIHVMFPFTQD-FHWLQOOXSA-N	-1	0	351.402	2.837	50	0		FFAARM
CC(C)(C(=O)N1CCO[C@@H](CC(=O)[O-])C1)c1cccc(C(F)(F)F)c1	ZINC000236692358	509481586	/nfs/dbraw/zinc/48/15/86/509481586.db2.gz	AXLZYHYFKQVQKQ-ZDUSSCGKSA-N	-1	0	359.344	2.685	50	0		FFAARM
C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)N1CCO[C@@H](CC(=O)[O-])C1	ZINC000237340578	509626521	/nfs/dbraw/zinc/62/65/21/509626521.db2.gz	VVLWDJPRKOTYLH-FZMZJTMJSA-N	-1	0	359.344	2.586	50	0		FFAARM
Cn1c(=O)c2ccc(C(=O)N3CC4C[C@@H]5CC3C[C@H](C4)C5)cc2[n-]c1=S	ZINC000170597189	509675943	/nfs/dbraw/zinc/67/59/43/509675943.db2.gz	INEOFVBPQITCHE-DOOHLRMFSA-N	-1	0	369.490	2.873	50	0		FFAARM
Cc1nc(C2CCCC2)sc1C(=O)N(CC(=O)[O-])C1CCOCC1	ZINC000237612568	509690957	/nfs/dbraw/zinc/69/09/57/509690957.db2.gz	XTBWKVZOCPDTAZ-UHFFFAOYSA-N	-1	0	352.456	2.815	50	0		FFAARM
O=C([O-])CC[C@@H]1CCCN(C(=O)COc2ccc(Br)cc2)C1	ZINC000237949884	509783277	/nfs/dbraw/zinc/78/32/77/509783277.db2.gz	GAPBGPVVOFAQKP-LBPRGKRZSA-N	-1	0	370.243	2.931	50	0		FFAARM
O=C([O-])c1cc(C(=O)N2CCc3sccc3C2)n(-c2ccccc2)n1	ZINC000237982313	509791602	/nfs/dbraw/zinc/79/16/02/509791602.db2.gz	LPZDAZKCAKBMGB-UHFFFAOYSA-N	-1	0	353.403	2.831	50	0		FFAARM
O=C([O-])CCN(C[C@@H]1CCCO1)C(=O)[C@H]1C[C@@H]1c1ccc(F)cc1F	ZINC000238089938	509817959	/nfs/dbraw/zinc/81/79/59/509817959.db2.gz	XZGWVBRMUXGQIH-CFVMTHIKSA-N	-1	0	353.365	2.551	50	0		FFAARM
O=C([O-])CCN(C[C@@H]1CCCO1)C(=O)c1ccc(Br)c(F)c1	ZINC000238093233	509820009	/nfs/dbraw/zinc/82/00/09/509820009.db2.gz	DWNMXPSJWGPGNW-NSHDSACASA-N	-1	0	374.206	2.684	50	0		FFAARM
O=C(c1ccccn1)[C@@H]1CCCN(Cc2nc(=O)c3sccc3[n-]2)C1	ZINC000253536787	509888061	/nfs/dbraw/zinc/88/80/61/509888061.db2.gz	OSHWLVGBYPRPMC-GFCCVEGCSA-N	-1	0	354.435	2.887	50	0		FFAARM
O=C([O-])CN(Cc1ccccc1)C(=O)c1ccc(N2CCCC2=O)cc1	ZINC000268893005	510123470	/nfs/dbraw/zinc/12/34/70/510123470.db2.gz	LMDZUCFYWHXEPY-UHFFFAOYSA-N	-1	0	352.390	2.540	50	0		FFAARM
O=C([O-])C1(CNC(=O)c2ccccc2C(=O)c2ccccc2)CCOCC1	ZINC000262862220	510447264	/nfs/dbraw/zinc/44/72/64/510447264.db2.gz	VNIVGTPJHNRCKX-UHFFFAOYSA-N	-1	0	367.401	2.529	50	0		FFAARM
CC(C)n1cnc(S(=O)(=O)[N-]c2ccc3nnc(C4CCC4)n3c2)c1	ZINC000188232983	510661366	/nfs/dbraw/zinc/66/13/66/510661366.db2.gz	LZVKNOZVVDIFKU-UHFFFAOYSA-N	-1	0	360.443	2.575	50	0		FFAARM
O=C([O-])c1ccnc(C(=O)N(Cc2ccccc2)CC2CCOCC2)c1	ZINC000263415978	510695624	/nfs/dbraw/zinc/69/56/24/510695624.db2.gz	NXHMPMNEOLFBSQ-UHFFFAOYSA-N	-1	0	354.406	2.849	50	0		FFAARM
O=C([O-])c1ccc(CNC(=O)c2ccc3c(c2)NC(=O)CCS3)cc1	ZINC000361925410	511104330	/nfs/dbraw/zinc/10/43/30/511104330.db2.gz	SESYSXDHJZHPNY-UHFFFAOYSA-N	-1	0	356.403	2.749	50	0		FFAARM
O=C(NC[C@H]1CCN(c2ccccc2F)C1)c1s[n-]c(=O)c1Cl	ZINC000292396003	511581898	/nfs/dbraw/zinc/58/18/98/511581898.db2.gz	IVVWCYMOVCARIL-SECBINFHSA-N	-1	0	355.822	2.898	50	0		FFAARM
CCOc1cccc2c1OC[C@@H](C(=O)NCc1cc(C(=O)[O-])c(C)o1)C2	ZINC000372022864	512683046	/nfs/dbraw/zinc/68/30/46/512683046.db2.gz	AGIMOUQRDZNOEB-ZDUSSCGKSA-N	-1	0	359.378	2.552	50	0		FFAARM
COc1ccccc1OCc1ccc(C(=O)N2CC[C@](C)(C(=O)[O-])C2)o1	ZINC000408513498	513083324	/nfs/dbraw/zinc/08/33/24/513083324.db2.gz	HATLOCVMNPPCGD-IBGZPJMESA-N	-1	0	359.378	2.804	50	0		FFAARM
Cc1cc(OCC(=O)N(CCC(=O)[O-])C2CCOCC2)ccc1Cl	ZINC000408513353	513083644	/nfs/dbraw/zinc/08/36/44/513083644.db2.gz	WYCRUAFKDASZTD-UHFFFAOYSA-N	-1	0	355.818	2.510	50	0		FFAARM
O=C([O-])[C@@H]1CN(C(=O)c2ccc(Oc3ccc(F)cc3F)cc2)CCO1	ZINC000408513465	513083671	/nfs/dbraw/zinc/08/36/71/513083671.db2.gz	SAQVZGVFKOVJPQ-INIZCTEOSA-N	-1	0	363.316	2.683	50	0		FFAARM
Cc1ccc(C(=O)N2CCC[C@H](c3ccnn3CC(=O)[O-])C2)cc1Cl	ZINC000426442891	513942804	/nfs/dbraw/zinc/94/28/04/513942804.db2.gz	JSCXWBHMDPZDOU-AWEZNQCLSA-N	-1	0	361.829	2.949	50	0		FFAARM
Cc1nccn1CC(=O)N1C[C@@H]2C[C@@H](c3ccccc3)CC[C@]2(C(=O)[O-])C1	ZINC000426477367	513952090	/nfs/dbraw/zinc/95/20/90/513952090.db2.gz	JOMUJQHAQCQOEG-WFXMLNOXSA-N	-1	0	367.449	2.689	50	0		FFAARM
Cc1cc(C(=O)N2CCC[C@@H](c3ccn(CC(=O)[O-])n3)C2)ccc1Cl	ZINC000426677878	514014197	/nfs/dbraw/zinc/01/41/97/514014197.db2.gz	WSAHQWLLACRHBN-CQSZACIVSA-N	-1	0	361.829	2.949	50	0		FFAARM
COc1cc(C)cc(OC)c1-c1ccc(C[C@@H](NC(C)=O)C(=O)[O-])cc1	ZINC000534636286	517974085	/nfs/dbraw/zinc/97/40/85/517974085.db2.gz	LJEUNRIWMHWMQA-MRXNPFEDSA-N	-1	0	357.406	2.811	50	0		FFAARM
CC[C@@H](C(=O)N1CCC(NC(=O)C2(C(=O)[O-])CCC2)CC1)c1ccccc1	ZINC000573614135	518752066	/nfs/dbraw/zinc/75/20/66/518752066.db2.gz	VQFAFOUJMDYUCA-QGZVFWFLSA-N	-1	0	372.465	2.542	50	0		FFAARM
O=C([O-])CCN(C(=O)[C@H]1SCCc2sccc21)C1CCOCC1	ZINC000574495326	519181313	/nfs/dbraw/zinc/18/13/13/519181313.db2.gz	INGRRMUXWWZVJN-HNNXBMFYSA-N	-1	0	355.481	2.561	50	0		FFAARM
CC(=O)N[C@@H](CC(=O)N1CCCC[C@@H]1CCC(=O)[O-])c1ccc(C)cc1	ZINC000236684835	519682346	/nfs/dbraw/zinc/68/23/46/519682346.db2.gz	OLKCOEHOGZWTKF-MSOLQXFVSA-N	-1	0	360.454	2.808	50	0		FFAARM
O=C([O-])CN(C(=O)COc1ccccc1-c1ccccc1)C1CCOCC1	ZINC000299748677	534498372	/nfs/dbraw/zinc/49/83/72/534498372.db2.gz	HVIMZJDCZLPUPT-UHFFFAOYSA-N	-1	0	369.417	2.825	50	0		FFAARM
CCOc1ccc(-c2ccnc(N[C@H]3CC[C@H](O)CC3)n2)cc1C(=O)[O-]	ZINC000244734931	520810775	/nfs/dbraw/zinc/81/07/75/520810775.db2.gz	NOCOQJRWEALMRY-HDJSIYSDSA-N	-1	0	357.410	2.956	50	0		FFAARM
COc1cc2c(cc1OC)[C@H](CC(=O)[O-])N(C(=O)/C=C\c1ccco1)CC2	ZINC000606441148	521068534	/nfs/dbraw/zinc/06/85/34/521068534.db2.gz	JFHMTWQEBIFUCV-KJPDOMRESA-N	-1	0	371.389	2.911	50	0		FFAARM
CCCc1cc(-c2nc(CC(=O)N[C@@H](C(=O)[O-])C(C)C)cs2)ccn1	ZINC000218140977	521341205	/nfs/dbraw/zinc/34/12/05/521341205.db2.gz	UVHMFJKPOXBUSL-MRXNPFEDSA-N	-1	0	361.467	2.926	50	0		FFAARM
CCCn1cc(C(=O)N2C[C@@H](c3ccccc3C)[C@H](C(=O)[O-])C2)c(C)n1	ZINC000091304569	521644831	/nfs/dbraw/zinc/64/48/31/521644831.db2.gz	BSPWLYCFUGREKJ-ZWKOTPCHSA-N	-1	0	355.438	2.850	50	0		FFAARM
CC(C)(C)c1cc(C(=O)N2CCC(c3ncc(C(=O)[O-])s3)CC2)[nH]n1	ZINC000630246398	522736801	/nfs/dbraw/zinc/73/68/01/522736801.db2.gz	XLSBKDPCVAMZJG-UHFFFAOYSA-N	-1	0	362.455	2.882	50	0		FFAARM
O=C([O-])[C@@H]1CCCC[C@@H]1C(=O)N1CCN(c2cccc(Cl)c2)CC1	ZINC000000178894	526270403	/nfs/dbraw/zinc/27/04/03/526270403.db2.gz	NNVAEGDGLIJWFI-JKSUJKDBSA-N	-1	0	350.846	2.880	50	0		FFAARM
Cc1oc(CN(C)C(=O)[C@@H]2C[C@H]2c2ccc3c(c2)OCCO3)cc1C(=O)[O-]	ZINC000268944416	526768626	/nfs/dbraw/zinc/76/86/26/526768626.db2.gz	VHWZGMNFQCZURJ-JKSUJKDBSA-N	-1	0	371.389	2.820	50	0		FFAARM
O=C(Nc1ccc(Br)cc1)C([O-])=C1C(=O)Nc2ccccc21	ZINC000102134333	570827219	/nfs/dbraw/zinc/82/72/19/570827219.db2.gz	QTGZPYFSHFTQMA-ZDUSSCGKSA-N	-1	0	359.179	2.693	50	0		FFAARM