smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1nc(C=Cc2ccccc2OCC2CC2)[n-]c(=O)c1CC(=O)[O-]	ZINC000349105666	156355159	/nfs/dbraw/zinc/35/51/59/156355159.db2.gz	HANHEGMQHVQPBJ-CMDGGOBGSA-N	-2	3	340.379	3.077	10	0		EGAEHL
CC(C)[C@@H]1CC[C@@H](C)C[C@H]1[N-]S(=O)(=O)c1cc(C(=O)[O-])cs1	ZINC000315569888	456607746	/nfs/dbraw/zinc/60/77/46/456607746.db2.gz	ZMBZQXYXKBSCMR-KGYLQXTDSA-N	-2	3	345.486	3.185	10	0		EGAEHL
O=P([O-])([O-])[C@@H](NCc1ccc(OC(F)F)cc1)c1cccs1	ZINC000013016438	453439990	/nfs/dbraw/zinc/43/99/90/453439990.db2.gz	WVOZRLGYAFMNKE-GFCCVEGCSA-N	-2	3	349.295	3.316	10	0		EGAEHL
O=C([O-])c1ccc([N-]S(=O)(=O)c2ccc(Cl)cc2)c(Cl)c1	ZINC000071392834	454206286	/nfs/dbraw/zinc/20/62/86/454206286.db2.gz	FHHVDZSZYCNWGT-UHFFFAOYSA-N	-2	3	346.191	3.492	10	0		EGAEHL
Cc1cc(F)ccc1-n1cc([O-])c(C(=O)Nc2c([O-])cccc2F)n1	ZINC000675220133	548874988	/nfs/dbraw/zinc/87/49/88/548874988.db2.gz	CXSQWNSIUMLVRO-UHFFFAOYSA-N	-2	3	345.305	3.122	10	0		EGAEHL
Cc1cc2cccnc2c(S(=O)(=O)[N-]c2cc([O-])cc(F)c2)c1	ZINC000678110020	549398524	/nfs/dbraw/zinc/39/85/24/549398524.db2.gz	BTYRBDSRPGSMPF-UHFFFAOYSA-N	-2	3	332.356	3.189	10	0		EGAEHL
CCc1ccc(C(=O)Nc2ccc(-c3nc(C)cc(=O)[n-]3)cc2)c([O-])c1	ZINC000190370789	455304516	/nfs/dbraw/zinc/30/45/16/455304516.db2.gz	MIOZMRKVGDIMRF-UHFFFAOYSA-N	-2	3	349.390	3.266	10	0		EGAEHL
O=S(=O)([N-]c1ccc(F)c(F)c1F)c1cccc(Cl)c1[O-]	ZINC000339204778	456990725	/nfs/dbraw/zinc/99/07/25/456990725.db2.gz	PMSKDXPGIXUEDJ-UHFFFAOYSA-N	-2	3	337.706	3.264	10	0		EGAEHL
Cc1ccc(S(=O)(=O)[N-]c2c(Cl)cccc2C(=O)[O-])c(F)c1	ZINC000404967463	457550836	/nfs/dbraw/zinc/55/08/36/457550836.db2.gz	KKVJGDKECAVKEX-UHFFFAOYSA-N	-2	3	343.763	3.287	10	0		EGAEHL
O=S(=O)(CC1CCCCC1)[N-]c1cc(Br)ccc1[O-]	ZINC000094573794	1292943574	/nfs/dbraw/zinc/94/35/74/1292943574.db2.gz	ZOYYQSBQEPPXOL-UHFFFAOYSA-N	-2	3	348.262	3.477	10	0		EGAEHL
O=C(Nc1cc(Cl)c([O-])c(Cl)c1)c1cc(=O)[n-]c(C2CC2)n1	ZINC001153084089	1380017403	/nfs/dbraw/zinc/01/74/03/1380017403.db2.gz	UYRBPNHXIQCERX-UHFFFAOYSA-N	-2	3	340.166	3.324	10	0		EGAEHL
O=C([O-])c1ccc([N-]S(=O)(=O)c2ccc(F)cc2F)c(Cl)c1	ZINC000316321988	308766343	/nfs/dbraw/zinc/76/63/43/308766343.db2.gz	YHCTZZSFAZRMHI-UHFFFAOYSA-N	-2	3	347.726	3.117	10	0		EGAEHL
Cc1nc(C=Cc2cccc(Cl)c2F)[n-]c(=O)c1CCC(=O)[O-]	ZINC000443455544	309901524	/nfs/dbraw/zinc/90/15/24/309901524.db2.gz	NLSMGWAOOXAFIN-ALCCZGGFSA-N	-2	3	336.750	3.471	10	0		EGAEHL
CCOc1ccc(S(=O)(=O)[N-]c2cc([O-])cc(F)c2)cc1C	ZINC000536611381	314129943	/nfs/dbraw/zinc/12/99/43/314129943.db2.gz	ALGAXAXTKHJILO-UHFFFAOYSA-N	-2	3	325.361	3.039	10	0		EGAEHL
O=C([O-])c1cccc(Cl)c1[N-]S(=O)(=O)c1cccc(Cl)c1	ZINC000013269541	323212339	/nfs/dbraw/zinc/21/23/39/323212339.db2.gz	ZEXLATDLSOLQEQ-UHFFFAOYSA-N	-2	3	346.191	3.492	10	0		EGAEHL
CC(C)[C@H]1CC[C@@H](C)C[C@H]1[N-]S(=O)(=O)c1cc(C(=O)[O-])cs1	ZINC000315569891	456608529	/nfs/dbraw/zinc/60/85/29/456608529.db2.gz	ZMBZQXYXKBSCMR-RAIGVLPGSA-N	-2	3	345.486	3.185	10	0		EGAEHL
Cc1ccc(C(=O)N2C[C@H](C(=O)[O-])C[C@@H](c3ccccc3)C2)c([O-])c1	ZINC000180292192	455155438	/nfs/dbraw/zinc/15/54/38/455155438.db2.gz	OATLHNBNYMFELI-HZPDHXFCSA-N	-2	3	339.391	3.031	10	0		EGAEHL
Cc1oc(S(=O)(=O)[N-][C@@H]2CCCC23CCCCC3)cc1C(=O)[O-]	ZINC000656718754	461856023	/nfs/dbraw/zinc/85/60/23/461856023.db2.gz	QDMPIAAPZSQFMW-CYBMUJFWSA-N	-2	3	341.429	3.068	10	0		EGAEHL
O=c1[n-]c(-c2cccc(Sc3cnccn3)n2)nc2ccc([O-])cc21	ZINC000436827336	547905058	/nfs/dbraw/zinc/90/50/58/547905058.db2.gz	NLMJZLFVSNYXIJ-UHFFFAOYSA-N	-2	3	349.375	3.044	10	0		EGAEHL
O=C([O-])c1cnc(C=Cc2csc(-c3ccccc3)n2)[n-]c1=O	ZINC000670369960	548202042	/nfs/dbraw/zinc/20/20/42/548202042.db2.gz	NOPDOYWPMQFGPS-VOTSOKGWSA-N	-2	3	325.349	3.174	10	0		EGAEHL
O=C([O-])CC[C@@H]1CCCCN1C(=O)c1ccc2c(c1[O-])CCCC2	ZINC000263474056	304059657	/nfs/dbraw/zinc/05/96/57/304059657.db2.gz	YTEVHOCBSQUSNM-AWEZNQCLSA-N	-2	3	331.412	3.131	10	0		EGAEHL
Cc1nc(C=Cc2ccc(OC(C)C)cc2)[n-]c(=O)c1CCC(=O)[O-]	ZINC000193403675	266029776	/nfs/dbraw/zinc/02/97/76/266029776.db2.gz	HEHBOBIAUFVVSZ-UXBLZVDNSA-N	-2	3	342.395	3.053	10	0		EGAEHL
CCOc1ccc([N-]S(=O)(=O)c2cccc(Cl)c2[O-])cc1F	ZINC000550111419	315117373	/nfs/dbraw/zinc/11/73/73/315117373.db2.gz	OWMMBPYZEGZYLD-UHFFFAOYSA-N	-2	3	345.779	3.384	10	0		EGAEHL
O=C([O-])c1cccc(Cl)c1[N-]S(=O)(=O)c1ccc(F)c(F)c1	ZINC000013269532	323212555	/nfs/dbraw/zinc/21/25/55/323212555.db2.gz	SROWBZNNNDWLHB-UHFFFAOYSA-N	-2	3	347.726	3.117	10	0		EGAEHL
CC(C)n1c(CNC(=O)c2cc3c(cc2[O-])CCCC3)n[n-]c1=S	ZINC000066639332	453858679	/nfs/dbraw/zinc/85/86/79/453858679.db2.gz	YSFHVALAIATGCP-UHFFFAOYSA-N	-2	3	346.456	3.036	10	0		EGAEHL
Cc1ccc(C(=O)N2C[C@@H](c3ccccc3)C[C@H](C(=O)[O-])C2)c([O-])c1	ZINC000180292170	455155483	/nfs/dbraw/zinc/15/54/83/455155483.db2.gz	OATLHNBNYMFELI-HOTGVXAUSA-N	-2	3	339.391	3.031	10	0		EGAEHL
COc1ccc2c(c1)C=C(S(=O)(=O)[N-]c1cc(F)ccc1[O-])CC2	ZINC000184498721	1295199426	/nfs/dbraw/zinc/19/94/26/1295199426.db2.gz	LJHXSWFCIUNVON-UHFFFAOYSA-N	-2	3	349.383	3.269	10	0		EGAEHL
O=C([O-])Cc1ccccc1NC(=O)c1ccc2c(c1[O-])CCCC2	ZINC000263579551	304090237	/nfs/dbraw/zinc/09/02/37/304090237.db2.gz	UWBOOCZYGCKPOO-UHFFFAOYSA-N	-2	3	325.364	3.150	10	0		EGAEHL
O=S(=O)([N-]c1ccc(OC(F)F)cc1)c1cccc(Cl)c1[O-]	ZINC000555530856	315388455	/nfs/dbraw/zinc/38/84/55/315388455.db2.gz	VFLOYDRBUXUXCE-UHFFFAOYSA-N	-2	3	349.742	3.448	10	0		EGAEHL
CCc1ccc(-n2c(=O)c3[n-][n-]n(-c4cc(C)ccc4C)c=3c2=O)cc1	ZINC000102808033	454521907	/nfs/dbraw/zinc/52/19/07/454521907.db2.gz	YHPLCEPSQXQMCO-QZTJIDSGSA-N	-2	3	348.406	3.364	10	0		EGAEHL
Cc1ccccc1S(=O)(=O)[N-]c1c(Cl)cccc1C(=O)[O-]	ZINC000230026762	456132871	/nfs/dbraw/zinc/13/28/71/456132871.db2.gz	UWUAFLKAEGJLKK-UHFFFAOYSA-N	-2	3	325.773	3.147	10	0		EGAEHL
O=C(Nc1ccc(OC(F)(F)F)cc1[O-])c1ccc(F)cc1[O-]	ZINC000443559420	457780201	/nfs/dbraw/zinc/78/02/01/457780201.db2.gz	NWEXKTUILWXYHS-UHFFFAOYSA-N	-2	3	331.221	3.388	10	0		EGAEHL
CC1(c2cc(=NC(=O)c3cnc4ccccc4c3[O-])[n-]o2)CCCC1	ZINC000583911876	459617336	/nfs/dbraw/zinc/61/73/36/459617336.db2.gz	LDTAMFOHHMFCOS-UHFFFAOYSA-N	-2	3	337.379	3.022	10	0		EGAEHL
CC1(c2cc(=NC(=O)c3c[n-]c4ccccc4c3=O)[n-]o2)CCCC1	ZINC000583911876	459617341	/nfs/dbraw/zinc/61/73/41/459617341.db2.gz	LDTAMFOHHMFCOS-UHFFFAOYSA-N	-2	3	337.379	3.022	10	0		EGAEHL
Cc1ccc2ncccc2c1S(=O)(=O)[N-]c1cc([O-])cc(F)c1	ZINC000678110308	549398733	/nfs/dbraw/zinc/39/87/33/549398733.db2.gz	RUMYJKYZYOKXHV-UHFFFAOYSA-N	-2	3	332.356	3.189	10	0		EGAEHL
CCc1ccc([O-])c(C(=O)Nc2ccc(-c3nc(C)cc(=O)[n-]3)cc2)c1	ZINC000094056587	307469595	/nfs/dbraw/zinc/46/95/95/307469595.db2.gz	RAOCUGQHACGWFS-UHFFFAOYSA-N	-2	3	349.390	3.266	10	0		EGAEHL
Cc1ccc(S(=O)(=O)[N-]c2c(Cl)cccc2C(=O)[O-])cc1C	ZINC000013269545	323212368	/nfs/dbraw/zinc/21/23/68/323212368.db2.gz	LPKNOZNNILDMAK-UHFFFAOYSA-N	-2	3	339.800	3.456	10	0		EGAEHL
Cc1nc(C=Cc2ccc(OC(C)C)cc2)[n-]c(=O)c1CCC(=O)[O-]	ZINC000347389163	323953123	/nfs/dbraw/zinc/95/31/23/323953123.db2.gz	HEHBOBIAUFVVSZ-POHAHGRESA-N	-2	3	342.395	3.465	10	0		EGAEHL
CC(C)c1ccc([O-])c(C(=O)NCc2n[n-]c(=S)n2C2CC2)c1	ZINC000066638536	453858703	/nfs/dbraw/zinc/85/87/03/453858703.db2.gz	PJGGSLMOWOQDSM-UHFFFAOYSA-N	-2	3	332.429	3.035	10	0		EGAEHL
Cc1ccc(F)cc1S(=O)(=O)[N-]c1c(Cl)cccc1C(=O)[O-]	ZINC000319024413	456621628	/nfs/dbraw/zinc/62/16/28/456621628.db2.gz	FEHFQOKXZQJSHF-UHFFFAOYSA-N	-2	3	343.763	3.287	10	0		EGAEHL
Cc1ccc(-n2c(=O)c3[n-][n-]n(-c4ccccc4)c=3c2=O)cc1Cl	ZINC000102818192	204052140	/nfs/dbraw/zinc/05/21/40/204052140.db2.gz	LMIOPBIKOBTMOU-GJZGRUSLSA-N	-2	3	340.770	3.146	10	0		EGAEHL
Cc1cc(S(=O)(=O)[N-]c2cccc([O-])c2F)c(Cl)cc1F	ZINC000131543474	307645054	/nfs/dbraw/zinc/64/50/54/307645054.db2.gz	QEWVCAVREMCSRD-UHFFFAOYSA-N	-2	3	333.743	3.433	10	0		EGAEHL
CCc1ccc(S(=O)(=O)[N-]c2cc(F)cc(C(=O)[O-])c2F)cc1	ZINC000547609359	314917460	/nfs/dbraw/zinc/91/74/60/314917460.db2.gz	VINFBPYZGXMRSE-UHFFFAOYSA-N	-2	3	341.335	3.026	10	0		EGAEHL
O=C([O-])c1cccc(Cl)c1[N-]S(=O)(=O)c1ccccc1Cl	ZINC000013269566	323212387	/nfs/dbraw/zinc/21/23/87/323212387.db2.gz	LBPCFQNJIGLZQJ-UHFFFAOYSA-N	-2	3	346.191	3.492	10	0		EGAEHL
O=C([O-])c1cc(Cl)ccc1[N-]S(=O)(=O)Cc1ccccc1F	ZINC000396453691	324293719	/nfs/dbraw/zinc/29/37/19/324293719.db2.gz	FQHQYSPBOCIEQG-UHFFFAOYSA-N	-2	3	343.763	3.119	10	0		EGAEHL
CC1(CS(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2F)CCCCC1	ZINC000547870706	458808891	/nfs/dbraw/zinc/80/88/91/458808891.db2.gz	IGTGUQXFXOBJOX-UHFFFAOYSA-N	-2	3	329.393	3.236	10	0		EGAEHL
Cc1cc(C(=O)[O-])ccc1[N-]S(=O)(=O)c1cccc(Cl)c1C	ZINC000042122867	453996296	/nfs/dbraw/zinc/99/62/96/453996296.db2.gz	CAIGCFZIQIXVHT-UHFFFAOYSA-N	-2	3	339.800	3.456	10	0		EGAEHL
O=S(=O)([N-]c1cc([O-])cc(F)c1)c1ccc(F)c2ncccc12	ZINC000095430806	454210662	/nfs/dbraw/zinc/21/06/62/454210662.db2.gz	DZBIFWFFKXYTGQ-UHFFFAOYSA-N	-2	3	336.319	3.019	10	0		EGAEHL
Cc1ccc(C(=O)Nc2ccc(-c3nc(C)cc(=O)[n-]3)cc2)c([O-])c1	ZINC000102836656	454522300	/nfs/dbraw/zinc/52/23/00/454522300.db2.gz	IIDXSYMBVCGQBB-UHFFFAOYSA-N	-2	3	335.363	3.012	10	0		EGAEHL
Cc1ccc(C(=O)N2C[C@H](C(=O)[O-])C[C@H](c3ccccc3)C2)c([O-])c1	ZINC000180292209	455155398	/nfs/dbraw/zinc/15/53/98/455155398.db2.gz	OATLHNBNYMFELI-JKSUJKDBSA-N	-2	3	339.391	3.031	10	0		EGAEHL
CCO[C@@H](CS(=O)(=O)[N-]c1cc(C(C)(C)C)ccc1[O-])C1CC1	ZINC000629285083	460714508	/nfs/dbraw/zinc/71/45/08/460714508.db2.gz	OHDWXRBOIDCCJX-INIZCTEOSA-N	-2	3	341.473	3.247	10	0		EGAEHL
CC(C)CCc1nnc([N-]C(=O)c2c(F)ccc([O-])c2F)s1	ZINC000617094709	460742068	/nfs/dbraw/zinc/74/20/68/460742068.db2.gz	RNCAGUXMTIOCMX-UHFFFAOYSA-N	-2	3	327.356	3.363	10	0		EGAEHL
CO[C@H](CS(=O)(=O)[N-]c1ccc(C(C)(C)C)cc1[O-])C(C)C	ZINC000647132341	461514995	/nfs/dbraw/zinc/51/49/95/461514995.db2.gz	MDMZLYDPRSFNOZ-OAHLLOKOSA-N	-2	3	329.462	3.102	10	0		EGAEHL
Cc1cc(F)cc2c(=O)c(C(=O)Nc3c([O-])cccc3F)c[n-]c12	ZINC000676151355	549045937	/nfs/dbraw/zinc/04/59/37/549045937.db2.gz	LLRKBVOZSDCDDB-UHFFFAOYSA-N	-2	3	330.290	3.073	10	0		EGAEHL
O=C(NCc1ccc([O-])c(F)c1)c1ccc(C(F)(F)F)c([O-])c1	ZINC000684877757	550380066	/nfs/dbraw/zinc/38/00/66/550380066.db2.gz	XNXTXQUAOOVPAB-UHFFFAOYSA-N	-2	3	329.249	3.186	10	0		EGAEHL
Cc1nc(C=Cc2ccccc2OCC2CC2)[n-]c(=O)c1CC(=O)[O-]	ZINC000349105667	156355562	/nfs/dbraw/zinc/35/55/62/156355562.db2.gz	HANHEGMQHVQPBJ-HJWRWDBZSA-N	-2	3	340.379	3.077	10	0		EGAEHL
COc1ccc(S(=O)(=O)[N-]c2cc(C(=O)[O-])c(C)cc2C)c(C)c1	ZINC000547878146	314950410	/nfs/dbraw/zinc/95/04/10/314950410.db2.gz	XPGXOQAWFPENDD-UHFFFAOYSA-N	-2	3	349.408	3.119	10	0		EGAEHL
Cc1cc(=O)[n-]c(-c2ccc(NC(=O)c3cccc(C)c3[O-])cc2)n1	ZINC000102836639	454522204	/nfs/dbraw/zinc/52/22/04/454522204.db2.gz	VGHDLTMZPHODTJ-UHFFFAOYSA-N	-2	3	335.363	3.012	10	0		EGAEHL
O=C([O-])CCc1ccc(-c2nc3cc(Cl)ccc3c(=O)[n-]2)cc1	ZINC000518887778	458897818	/nfs/dbraw/zinc/89/78/18/458897818.db2.gz	YORVHXLAJHVPRM-UHFFFAOYSA-N	-2	3	328.755	3.261	10	0		EGAEHL
O=C([O-])CC[C@H]1CCCCN1C(=O)c1ccc2c(c1[O-])CCCC2	ZINC000263474057	304062712	/nfs/dbraw/zinc/06/27/12/304062712.db2.gz	YTEVHOCBSQUSNM-CQSZACIVSA-N	-2	3	331.412	3.131	10	0		EGAEHL
O=C(Nc1ccc(F)c(Cl)c1)c1c([O-])[n-]c2ccccc2c1=O	ZINC000000429947	452591294	/nfs/dbraw/zinc/59/12/94/452591294.db2.gz	DHWURYYTOINGAE-UHFFFAOYSA-N	-2	3	332.718	3.279	10	0		EGAEHL
CSc1ccccc1[N-]S(=O)(=O)Cc1ccc(C(=O)[O-])cc1	ZINC000314576608	456602903	/nfs/dbraw/zinc/60/29/03/456602903.db2.gz	YLMMHINPKAADFT-UHFFFAOYSA-N	-2	3	337.422	3.049	10	0		EGAEHL
O=C(Nc1ccc(Br)cc1[O-])c1cccc(F)c1[O-]	ZINC001290876833	1382113108	/nfs/dbraw/zinc/11/31/08/1382113108.db2.gz	YILDMPFITMBANC-UHFFFAOYSA-N	-2	3	326.121	3.252	10	0		EGAEHL
CCOC(=O)c1oc2c([n-]c3sc(C(=O)OCC)c(C)c32)c1[O-]	ZINC000100318124	219097143	/nfs/dbraw/zinc/09/71/43/219097143.db2.gz	VRFVOFFTOXGEKR-UHFFFAOYSA-N	-2	3	337.353	3.343	10	0		EGAEHL
Cc1cc(C)nc([N-]c2nc([O-])c(Cc3ccc(C)c(C)c3)s2)n1	ZINC000012274178	211331297	/nfs/dbraw/zinc/33/12/97/211331297.db2.gz	GEMPKVMMFKURFG-HNNXBMFYSA-N	-2	3	340.452	3.363	10	0		EGAEHL
Cc1nc(C=Cc2cc(Cl)ccc2F)[n-]c(=O)c1CCC(=O)[O-]	ZINC000195503523	266185103	/nfs/dbraw/zinc/18/51/03/266185103.db2.gz	PFXWDEHRRWBZPW-QHHAFSJGSA-N	-2	3	336.750	3.058	10	0		EGAEHL
O=C(Nc1ccc(OC(F)(F)F)cc1[O-])c1ccc([O-])cc1F	ZINC000443567234	309903661	/nfs/dbraw/zinc/90/36/61/309903661.db2.gz	OPKSBUJOQXMULG-UHFFFAOYSA-N	-2	3	331.221	3.388	10	0		EGAEHL
O=S(=O)([N-]c1cccc(-n2cccn2)c1)c1cccc(Cl)c1[O-]	ZINC000339199891	456988632	/nfs/dbraw/zinc/98/86/32/456988632.db2.gz	DZSUEWISBUOVQQ-UHFFFAOYSA-N	-2	3	349.799	3.032	10	0		EGAEHL
O=C(Nc1c([O-])cccc1F)c1cc(Br)ccc1[O-]	ZINC000092550260	546676008	/nfs/dbraw/zinc/67/60/08/546676008.db2.gz	QGAULUAWKQCXGR-UHFFFAOYSA-N	-2	3	326.121	3.252	10	0		EGAEHL
O=S(=O)([N-]c1ccc(Br)c([O-])c1)c1ccc(F)cc1	ZINC001326242613	1388132994	/nfs/dbraw/zinc/13/29/94/1388132994.db2.gz	UANIKPJWIIEBDS-UHFFFAOYSA-N	-2	3	346.177	3.095	10	0		EGAEHL
CC(C)n1ncc2cc(S(=O)(=O)[N-]c3cc([O-])cc(F)c3)ccc21	ZINC000348885332	156276174	/nfs/dbraw/zinc/27/61/74/156276174.db2.gz	SSHRTAWICWGVIJ-UHFFFAOYSA-N	-2	3	349.387	3.263	10	0		EGAEHL
CCCOc1cccc(C=Cc2nc(C)c(CCC(=O)[O-])c(=O)[n-]2)c1	ZINC000195503456	266185120	/nfs/dbraw/zinc/18/51/20/266185120.db2.gz	ANIMBGMMVSSTJS-VQHVLOKHSA-N	-2	3	342.395	3.055	10	0		EGAEHL
Cc1nc(C=Cc2ccc(CC(C)C)cc2)[n-]c(=O)c1CCC(=O)[O-]	ZINC000195503314	266185551	/nfs/dbraw/zinc/18/55/51/266185551.db2.gz	VSCHZLWNQHNTKQ-CSKARUKUSA-N	-2	3	340.423	3.464	10	0		EGAEHL
Cc1nc(C=Cc2ccc(Cl)c(F)c2)[n-]c(=O)c1CCC(=O)[O-]	ZINC000443446862	309901337	/nfs/dbraw/zinc/90/13/37/309901337.db2.gz	VBXYLRSDWYYWHR-UTCJRWHESA-N	-2	3	336.750	3.471	10	0		EGAEHL
Cc1cc(S(=O)(=O)[N-]c2c(Cl)cccc2C(=O)[O-])ccc1F	ZINC000547870820	314950225	/nfs/dbraw/zinc/95/02/25/314950225.db2.gz	RCJOINKBWVVURA-UHFFFAOYSA-N	-2	3	343.763	3.287	10	0		EGAEHL
O=P([O-])([O-])[C@H](NCCc1cccc(F)c1)c1cccc(Cl)c1	ZINC000012997449	453436865	/nfs/dbraw/zinc/43/68/65/453436865.db2.gz	VFMLBPCHPCEBIO-HNNXBMFYSA-N	-2	3	343.722	3.488	10	0		EGAEHL
Cc1ccc([O-])c(C(=O)c2c[n-]n3c(=N)nc(-c4ccccc4)c-3c2)c1	ZINC000103943517	454570943	/nfs/dbraw/zinc/57/09/43/454570943.db2.gz	LOBABXBNCLJRCB-UHFFFAOYSA-N	-2	3	344.374	3.030	10	0		EGAEHL
CCO[C@@H](CS(=O)(=O)[N-]c1ccc(C(C)(C)C)cc1[O-])C1CC1	ZINC000629299260	460717132	/nfs/dbraw/zinc/71/71/32/460717132.db2.gz	PDNCMQHGEANKEZ-INIZCTEOSA-N	-2	3	341.473	3.247	10	0		EGAEHL
CCOc1ccc(C=Cc2nc(C)c(CCC(=O)[O-])c(=O)[n-]2)cc1	ZINC000347391886	457397821	/nfs/dbraw/zinc/39/78/21/457397821.db2.gz	PMVCZRODJYWNRR-POHAHGRESA-N	-2	3	328.368	3.077	10	0		EGAEHL
CC[C@H](CCC(=O)[O-])[N-]S(=O)(=O)c1cc2cccc(C)c2s1	ZINC000650421142	461758375	/nfs/dbraw/zinc/75/83/75/461758375.db2.gz	JSVJLWPGGJNBIS-GFCCVEGCSA-N	-2	3	341.454	3.131	10	0		EGAEHL
CO[C@H]1Oc2ccccc2-c2c(=O)c3c([O-])c(C)c([O-])cc3oc21	ZINC000013378576	560215768	/nfs/dbraw/zinc/21/57/68/560215768.db2.gz	TXTGITRXQUOAJM-SFHVURJKSA-N	-2	3	326.304	3.217	10	0	biogenic,in-vitro	EGAEHL
CCCc1nc(=NC(=O)N=c2[nH][n-]c(-c3ccc(C)o3)c2C)s[n-]1	ZINC000459539081	310559415	/nfs/dbraw/zinc/55/94/15/310559415.db2.gz	PDKJCEGWAJKYKE-UHFFFAOYSA-N	-2	3	346.416	3.156	10	0		EGAEHL
CCCCCS(=O)(=O)[N-]c1cc(C(=O)[O-])ccc1OCCC	ZINC000548592516	315024244	/nfs/dbraw/zinc/02/42/44/315024244.db2.gz	NWXASXKFLDXBQT-UHFFFAOYSA-N	-2	3	329.418	3.106	10	0		EGAEHL
O=C([O-])c1cccc(Cl)c1[N-]S(=O)(=O)c1ccc(Cl)cc1	ZINC000013269518	323212355	/nfs/dbraw/zinc/21/23/55/323212355.db2.gz	AUNLNBVICPQKIU-UHFFFAOYSA-N	-2	3	346.191	3.492	10	0		EGAEHL
Cc1nc(-c2ccc(S(=O)(=O)[N-]c3cc([O-])cc(F)c3)cc2)co1	ZINC000131396208	454250049	/nfs/dbraw/zinc/25/00/49/454250049.db2.gz	YXMABXZTFZFCBJ-UHFFFAOYSA-N	-2	3	348.355	3.296	10	0		EGAEHL
O=C(N=c1cc(-c2ccncc2)[n-][nH]1)c1cc2ccccc2cc1[O-]	ZINC000436673707	458358328	/nfs/dbraw/zinc/35/83/28/458358328.db2.gz	GDOWZTVJUIFYBQ-UHFFFAOYSA-N	-2	3	330.347	3.005	10	0		EGAEHL
CC(C)(C)c1ccc([N-]S(=O)(=O)c2ccc(N)cc2)c(C(=O)[O-])c1	ZINC000548238683	458855405	/nfs/dbraw/zinc/85/54/05/458855405.db2.gz	MQJKINUIJHITSX-UHFFFAOYSA-N	-2	3	348.424	3.065	10	0		EGAEHL
O=c1[n-]c(-c2ccnc(OCC(F)(F)F)c2)nc2ccc([O-])cc12	ZINC000436929391	547904994	/nfs/dbraw/zinc/90/49/94/547904994.db2.gz	VIUWXXKAMFCNQY-UHFFFAOYSA-N	-2	3	337.257	3.044	10	0		EGAEHL
O=C(Nc1c([O-])cccc1F)c1nn(-c2ccc(Cl)cc2)cc1[O-]	ZINC000684056688	550286707	/nfs/dbraw/zinc/28/67/07/550286707.db2.gz	BZSHQYARMBULHW-UHFFFAOYSA-N	-2	3	347.733	3.328	10	0		EGAEHL
Cc1ccc(-n2c(=O)c3[n-][n-]n(-c4ccccc4)c=3c2=O)cc1Cl	ZINC000102818194	219233281	/nfs/dbraw/zinc/23/32/81/219233281.db2.gz	LMIOPBIKOBTMOU-CABCVRRESA-N	-2	3	340.770	3.146	10	0		EGAEHL
CC1(CS(=O)(=O)[N-]c2cc(F)cc(C(=O)[O-])c2F)CCCCC1	ZINC000548553504	315023212	/nfs/dbraw/zinc/02/32/12/315023212.db2.gz	DRXZIVIVASJREV-UHFFFAOYSA-N	-2	3	347.383	3.375	10	0		EGAEHL
CC(C)c1ccc([O-])c(C(=O)NCCc2n[n-]c(=S)n2C2CC2)c1	ZINC000067119255	453904441	/nfs/dbraw/zinc/90/44/41/453904441.db2.gz	MLGHWYQTVLDZTC-UHFFFAOYSA-N	-2	3	346.456	3.077	10	0		EGAEHL
Cc1cccc(-n2[n-][n-]c3c(=O)n(-c4cccc(Cl)c4)c(=O)c2=3)c1	ZINC000096500376	454372010	/nfs/dbraw/zinc/37/20/10/454372010.db2.gz	YAUHXDHBZCCXSG-LSDHHAIUSA-N	-2	3	340.770	3.146	10	0		EGAEHL
Cc1ccc([O-])c(C(=O)Nc2ccc(-c3nc(C)cc(=O)[n-]3)cc2)c1	ZINC000102836649	454522427	/nfs/dbraw/zinc/52/24/27/454522427.db2.gz	MQBUWRZABJIRIQ-UHFFFAOYSA-N	-2	3	335.363	3.012	10	0		EGAEHL
CC1(C)CCC[C@](NC(=O)c2cc([O-])ccc2Cl)(C(=O)[O-])C1	ZINC000910218072	939754336	/nfs/dbraw/zinc/75/43/36/939754336.db2.gz	GWNGNHMTHRKZDR-MRXNPFEDSA-N	-2	3	325.792	3.199	10	0		EGAEHL
CC1(CS(=O)(=O)[N-]c2cc(C(=O)[O-])ccc2F)CCCCC1	ZINC000548195991	314985897	/nfs/dbraw/zinc/98/58/97/314985897.db2.gz	KNUCNLVIEOMHIB-UHFFFAOYSA-N	-2	3	329.393	3.236	10	0		EGAEHL
CC(C)C(=O)c1ccc(S(=O)(=O)[N-]c2cc([O-])cc(F)c2)cc1	ZINC000131387817	454250299	/nfs/dbraw/zinc/25/02/99/454250299.db2.gz	KJKYWHGLSHIOEJ-UHFFFAOYSA-N	-2	3	337.372	3.171	10	0		EGAEHL
Cc1cc(C)c([N-]S(=O)(=O)c2ccc(F)cc2C)c(C(=O)[O-])c1	ZINC000060360601	454281836	/nfs/dbraw/zinc/28/18/36/454281836.db2.gz	JSQXONXSWMRLAN-UHFFFAOYSA-N	-2	3	337.372	3.250	10	0		EGAEHL
CC(C)(C)c1cc(Br)cc([N-]S(=O)(=O)C2CC2)c1[O-]	ZINC000655589392	461322922	/nfs/dbraw/zinc/32/29/22/461322922.db2.gz	QCRPCIORUFNNIB-UHFFFAOYSA-N	-2	3	348.262	3.356	10	0		EGAEHL
Cc1oc(S(=O)(=O)[N-][C@H]2CCCC23CCCCC3)cc1C(=O)[O-]	ZINC000656718757	461856891	/nfs/dbraw/zinc/85/68/91/461856891.db2.gz	QDMPIAAPZSQFMW-ZDUSSCGKSA-N	-2	3	341.429	3.068	10	0		EGAEHL
O=S(=O)(CCc1cccc(Cl)c1)[N-]c1cc([O-])cc(F)c1	ZINC000350897226	165078903	/nfs/dbraw/zinc/07/89/03/165078903.db2.gz	OSMNYOQDKVHFND-UHFFFAOYSA-N	-2	3	329.780	3.169	10	0		EGAEHL
Cc1cc(C=Cc2nc(C)c(CCC(=O)[O-])c(=O)[n-]2)ccc1Cl	ZINC000195503212	266184290	/nfs/dbraw/zinc/18/42/90/266184290.db2.gz	WLNVETHNJBSFOJ-QPJJXVBHSA-N	-2	3	332.787	3.228	10	0		EGAEHL
CC[C@@H]([N-]S(=O)(=O)c1cccc(Cl)c1[O-])c1nc(C)cs1	ZINC000631906725	460594390	/nfs/dbraw/zinc/59/43/90/460594390.db2.gz	UKUXNPXMUFOUNZ-SNVBAGLBSA-N	-2	3	346.861	3.240	10	0		EGAEHL
O=C([O-])c1ccc([N-]S(=O)(=O)c2cccc(Cl)c2)c(Cl)c1	ZINC000071392869	454206107	/nfs/dbraw/zinc/20/61/07/454206107.db2.gz	XGQLJYFSUYOYGS-UHFFFAOYSA-N	-2	3	346.191	3.492	10	0		EGAEHL
CCN(CC)c1ccc([N-]S(=O)(=O)c2ccccc2)cc1C(=O)[O-]	ZINC000033253635	212910807	/nfs/dbraw/zinc/91/08/07/212910807.db2.gz	YSQQJOMYTLRMEL-UHFFFAOYSA-N	-2	3	348.424	3.032	10	0		EGAEHL
Cc1nc(C=Cc2ccc3ccccc3c2)[n-]c(=O)c1CCC(=O)[O-]	ZINC000193404603	266029904	/nfs/dbraw/zinc/02/99/04/266029904.db2.gz	SGCKJQRXTYVGIG-JXMROGBWSA-N	-2	3	334.375	3.419	10	0		EGAEHL
CCSc1cccc(C=Cc2nc(C)c(CCC(=O)[O-])c(=O)[n-]2)c1	ZINC000195503222	266184409	/nfs/dbraw/zinc/18/44/09/266184409.db2.gz	WSHCOUNAPBALSJ-VQHVLOKHSA-N	-2	3	344.436	3.378	10	0		EGAEHL
COc1cccc(C(=O)Nc2ccc(Br)cc2[O-])c1[O-]	ZINC000080002428	307430581	/nfs/dbraw/zinc/43/05/81/307430581.db2.gz	FXOACYJMAURXIW-UHFFFAOYSA-N	-2	3	338.157	3.121	10	0		EGAEHL
Cc1ccc(F)c([N-]S(=O)(=O)c2ccc(F)cc2C)c1C(=O)[O-]	ZINC000531768544	313711143	/nfs/dbraw/zinc/71/11/43/313711143.db2.gz	WAPWYGWPMABXNP-UHFFFAOYSA-N	-2	3	341.335	3.081	10	0		EGAEHL
COc1c(C)cc(S(=O)(=O)[N-]c2cc(C(=O)[O-])ccc2C)cc1C	ZINC000547559651	314916599	/nfs/dbraw/zinc/91/65/99/314916599.db2.gz	HCMVQJGINOLASJ-UHFFFAOYSA-N	-2	3	349.408	3.119	10	0		EGAEHL
COc1cc(Br)c2cc(C(=O)[O-])cc([O-])c2c1OC	ZINC000095937710	454233363	/nfs/dbraw/zinc/23/33/63/454233363.db2.gz	LJFLFXIJRPLPDZ-UHFFFAOYSA-N	-2	3	327.130	3.023	10	0		EGAEHL
O=S(=O)([N-]c1cc([O-])cc(F)c1)c1cccc(Br)c1	ZINC000161300376	455557707	/nfs/dbraw/zinc/55/77/07/455557707.db2.gz	RCIHVIRXXZMHJX-UHFFFAOYSA-N	-2	3	346.177	3.095	10	0		EGAEHL
Cc1ccc2cccnc2c1S(=O)(=O)[N-]c1cc([O-])cc(F)c1	ZINC000349985680	457133241	/nfs/dbraw/zinc/13/32/41/457133241.db2.gz	GWYILBTXUPQCGR-UHFFFAOYSA-N	-2	3	332.356	3.189	10	0		EGAEHL
Cc1cccc2cc(S(=O)(=O)[N-][C@@H](C)CCCC(=O)[O-])sc21	ZINC000650413067	461755611	/nfs/dbraw/zinc/75/56/11/461755611.db2.gz	DGZMNKMKWJVPOB-NSHDSACASA-N	-2	3	341.454	3.131	10	0		EGAEHL
O=C(Nc1c([O-])cccc1F)c1ccc(Br)cc1[O-]	ZINC000092551492	546675409	/nfs/dbraw/zinc/67/54/09/546675409.db2.gz	SYUCXVRULLGNSG-UHFFFAOYSA-N	-2	3	326.121	3.252	10	0		EGAEHL
O=C([O-])CC[C@H](Cc1ccccc1)NCc1c(F)ccc([O-])c1F	ZINC000263474855	141051318	/nfs/dbraw/zinc/05/13/18/141051318.db2.gz	FCWSKWUQEJSITO-CYBMUJFWSA-N	-2	3	335.350	3.236	10	0		EGAEHL
O=C([O-])c1c(F)cccc1[N-]S(=O)(=O)Cc1ccccc1Cl	ZINC000547541534	314915490	/nfs/dbraw/zinc/91/54/90/314915490.db2.gz	HYGKMBKBECYPIQ-UHFFFAOYSA-N	-2	3	343.763	3.119	10	0		EGAEHL
CC(C)(C)CCS(=O)(=O)[N-]c1ccc(OC(F)(F)F)cc1[O-]	ZINC000562228246	315806539	/nfs/dbraw/zinc/80/65/39/315806539.db2.gz	QGBFTRQWQZIJMF-UHFFFAOYSA-N	-2	3	341.351	3.469	10	0		EGAEHL
Cc1cc(C)cc(-n2c(=O)c3[n-][n-]n(-c4cccc(C)c4C)c=3c2=O)c1	ZINC000033114708	453906785	/nfs/dbraw/zinc/90/67/85/453906785.db2.gz	VNQHIUTWJSFHMP-MSOLQXFVSA-N	-2	3	348.406	3.418	10	0		EGAEHL
Cc1cc(F)cc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2Cl)c1	ZINC000547892666	458809588	/nfs/dbraw/zinc/80/95/88/458809588.db2.gz	HFKOSEQKKHXCLI-UHFFFAOYSA-N	-2	3	343.763	3.287	10	0		EGAEHL
C[C@@H]1CC[C@H](C(=O)[O-])N1C(=O)c1cc(Cc2ccccc2)ccc1[O-]	ZINC000653318715	461627722	/nfs/dbraw/zinc/62/77/22/461627722.db2.gz	WFEVYUATGIBTSW-CXAGYDPISA-N	-2	3	339.391	3.061	10	0		EGAEHL
COc1ccc(C(=O)[O-])cc1[N-]S(=O)(=O)/C=C/c1ccc(C)cc1	ZINC000078900082	1292532704	/nfs/dbraw/zinc/53/27/04/1292532704.db2.gz	FWAGLVVGZWUXJU-MDZDMXLPSA-N	-2	3	347.392	3.114	10	0		EGAEHL
O=C([O-])c1ccc([N-]S(=O)(=O)c2ccc(F)c(F)c2)c(Cl)c1	ZINC000316057609	308766129	/nfs/dbraw/zinc/76/61/29/308766129.db2.gz	XFQVFGARTDXYHC-UHFFFAOYSA-N	-2	3	347.726	3.117	10	0		EGAEHL
CSc1cc(C(=O)[O-])ccc1[N-]S(=O)(=O)CC1CCCC1	ZINC000548198724	314985626	/nfs/dbraw/zinc/98/56/26/314985626.db2.gz	GWWNCPPQRSNACE-UHFFFAOYSA-N	-2	3	329.443	3.039	10	0		EGAEHL
CCCOc1ccc(C(=O)[O-])cc1[N-]S(=O)(=O)C(CC)CC	ZINC000548588238	315024259	/nfs/dbraw/zinc/02/42/59/315024259.db2.gz	LHHCAYCRVQXXTE-UHFFFAOYSA-N	-2	3	329.418	3.104	10	0		EGAEHL
Cc1ccc(S(=O)(=O)[N-]c2cc(C(=O)[O-])c(Cl)cc2C)cc1	ZINC000565037871	316253554	/nfs/dbraw/zinc/25/35/54/316253554.db2.gz	IHCRNENAKCKAGO-UHFFFAOYSA-N	-2	3	339.800	3.456	10	0		EGAEHL
Cc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2Cl)cc1F	ZINC000315434013	456608278	/nfs/dbraw/zinc/60/82/78/456608278.db2.gz	DVRFSHPAWBMXRU-UHFFFAOYSA-N	-2	3	343.763	3.287	10	0		EGAEHL
COc1c(C)cc(C=Cc2nc(C)c(CCC(=O)[O-])c(=O)[n-]2)cc1C	ZINC000443438907	457765749	/nfs/dbraw/zinc/76/57/49/457765749.db2.gz	GIPVEXDBAGOFKS-ALCCZGGFSA-N	-2	3	342.395	3.304	10	0		EGAEHL
COc1ccc([O-])c(S(=O)(=O)[N-]c2cccc(C(C)(F)F)c2)c1	ZINC000436170125	458264354	/nfs/dbraw/zinc/26/43/54/458264354.db2.gz	ATAJSMOPZBDBBS-UHFFFAOYSA-N	-2	3	343.351	3.313	10	0		EGAEHL
Cc1nc(C=Cc2ccc([O-])c(Cl)c2)[n-]c(=O)c1CCC(=O)[O-]	ZINC000436859376	458395525	/nfs/dbraw/zinc/39/55/25/458395525.db2.gz	KGELNRUBCFFAHL-UTCJRWHESA-N	-3	3	334.759	3.037	10	0		EGAEHL
O=C(NCCc1c(F)cc([O-])cc1F)c1ccc(Cl)c([O-])c1	ZINC001178784685	1386303212	/nfs/dbraw/zinc/30/32/12/1386303212.db2.gz	BNGQJWCEPBIDBE-UHFFFAOYSA-N	-2	3	327.714	3.002	10	0		EGAEHL
Cc1nc(C=Cc2ccc(F)cc2Cl)[n-]c(=O)c1CCC(=O)[O-]	ZINC000195503514	266184635	/nfs/dbraw/zinc/18/46/35/266184635.db2.gz	SDTZNZJZBFZCJJ-ZZXKWVIFSA-N	-2	3	336.750	3.058	10	0		EGAEHL
O=C([O-])c1ccc(CS(=O)(=O)[N-]c2cccc(Cl)c2F)cc1	ZINC000386224195	457429883	/nfs/dbraw/zinc/42/98/83/457429883.db2.gz	PBHFJWWVIKOFFY-UHFFFAOYSA-N	-2	3	343.763	3.119	10	0		EGAEHL
Cc1ccc(S(=O)(=O)[N-]c2ccc([C@@H]3C[C@H]3C(=O)[O-])cc2)cc1C	ZINC000630423745	461111035	/nfs/dbraw/zinc/11/10/35/461111035.db2.gz	NASDFOIDGBEOQE-DLBZAZTESA-N	-2	3	345.420	3.292	10	0		EGAEHL
CC1(C)CCC[C@@](NC(=O)c2cc([O-])ccc2Cl)(C(=O)[O-])C1	ZINC000910218070	939754134	/nfs/dbraw/zinc/75/41/34/939754134.db2.gz	GWNGNHMTHRKZDR-INIZCTEOSA-N	-2	3	325.792	3.199	10	0		EGAEHL
COc1ccc(C(=O)[O-])cc1[N-]S(=O)(=O)/C=C\c1ccc(C)cc1	ZINC000098056039	219075420	/nfs/dbraw/zinc/07/54/20/219075420.db2.gz	FWAGLVVGZWUXJU-KTKRTIGZSA-N	-2	3	347.392	3.114	10	0		EGAEHL
Cc1nc(C=Cc2ccc(Cl)cc2F)[n-]c(=O)c1CCC(=O)[O-]	ZINC000195503676	266185258	/nfs/dbraw/zinc/18/52/58/266185258.db2.gz	YAYOIWTWJLMQQM-ZZXKWVIFSA-N	-2	3	336.750	3.058	10	0		EGAEHL
O=P([O-])([O-])[C@H](NCc1ccc(OC(F)F)cc1)c1cccs1	ZINC000013016441	453439650	/nfs/dbraw/zinc/43/96/50/453439650.db2.gz	WVOZRLGYAFMNKE-LBPRGKRZSA-N	-2	3	349.295	3.316	10	0		EGAEHL
CCc1ccc(-n2c(=O)c3[n-][n-]n(-c4cccc(C)c4C)c=3c2=O)cc1	ZINC000033114643	453905650	/nfs/dbraw/zinc/90/56/50/453905650.db2.gz	CTMAQJSHTUDBKC-QZTJIDSGSA-N	-2	3	348.406	3.364	10	0		EGAEHL
Cc1ccc(-n2c(=O)c3[n-][n-]n(-c4ccc(Cl)cc4)c=3c2=O)cc1	ZINC000033114636	453905671	/nfs/dbraw/zinc/90/56/71/453905671.db2.gz	MCJTZABAWZRXBX-HUUCEWRRSA-N	-2	3	340.770	3.146	10	0		EGAEHL
Cc1ccc(C(=O)N2C[C@@H](C(=O)[O-])C[C@@H](c3ccccc3)C2)c([O-])c1	ZINC000180292151	455155476	/nfs/dbraw/zinc/15/54/76/455155476.db2.gz	OATLHNBNYMFELI-CVEARBPZSA-N	-2	3	339.391	3.031	10	0		EGAEHL
CC(C)c1cc(C(=O)NC2(C(=O)[O-])CCOCC2)c([O-])c(C(C)C)c1	ZINC000663143638	461470115	/nfs/dbraw/zinc/47/01/15/461470115.db2.gz	HPNHPFHJUCTMJW-UHFFFAOYSA-N	-2	3	349.427	3.003	10	0		EGAEHL
CCOc1ccc([N-]S(=O)(=O)c2cccc(Cl)c2[O-])cc1	ZINC000339209003	456992978	/nfs/dbraw/zinc/99/29/78/456992978.db2.gz	UCSAAJJKEXRVKR-UHFFFAOYSA-N	-2	3	327.789	3.245	10	0		EGAEHL
O=S(=O)([N-]c1ccc(-n2cccn2)cc1)c1cccc(Cl)c1[O-]	ZINC000339207955	456993125	/nfs/dbraw/zinc/99/31/25/456993125.db2.gz	MYPNUGDSLNPNKE-UHFFFAOYSA-N	-2	3	349.799	3.032	10	0		EGAEHL
O=C(N=c1[n-]nc(C(F)F)s1)c1cc2cc(Cl)sc2[n-]1	ZINC000362620083	457008989	/nfs/dbraw/zinc/00/89/89/457008989.db2.gz	WMHKLOVHVKNYNE-UHFFFAOYSA-N	-2	3	334.760	3.346	10	0		EGAEHL
Cc1ccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2Cl)c(F)c1	ZINC000404934654	457550487	/nfs/dbraw/zinc/55/04/87/457550487.db2.gz	CAOJCFZDWBIOHE-UHFFFAOYSA-N	-2	3	343.763	3.287	10	0		EGAEHL
Cc1cc(C=Cc2nc(C)c(CCC(=O)[O-])c(=O)[n-]2)cc(C)c1O	ZINC000436859374	458394934	/nfs/dbraw/zinc/39/49/34/458394934.db2.gz	KFLGFFKJMNUJNB-XQRVVYSFSA-N	-2	3	328.368	3.001	10	0		EGAEHL
COc1ccc([O-])c(S(=O)(=O)[N-]c2csc3ccccc23)c1	ZINC000351748252	144300951	/nfs/dbraw/zinc/30/09/51/144300951.db2.gz	NMDJZIATTRRISL-UHFFFAOYSA-N	-2	3	335.406	3.416	10	0		EGAEHL
O=S(=O)([N-]c1cc([O-])cc(F)c1)c1ccc(CC(F)(F)F)cc1	ZINC000189315698	153064017	/nfs/dbraw/zinc/06/40/17/153064017.db2.gz	VFHNOBCALYJXRD-UHFFFAOYSA-N	-2	3	349.305	3.437	10	0		EGAEHL
Cc1ccc(-c2nc([N-]C(=O)c3coc(C4CCCC4)n3)n[n-]2)o1	ZINC000338822427	163357192	/nfs/dbraw/zinc/35/71/92/163357192.db2.gz	PJTZJGAVOLDMCW-UHFFFAOYSA-N	-2	3	327.344	3.271	10	0		EGAEHL
Cc1cccc(-n2[n-][n-]c3c(=O)n(-c4cccc(Cl)c4)c(=O)c2=3)c1	ZINC000033114679	453906480	/nfs/dbraw/zinc/90/64/80/453906480.db2.gz	YAUHXDHBZCCXSG-HUUCEWRRSA-N	-2	3	340.770	3.146	10	0		EGAEHL
CCCc1cccc(C=Cc2nc(C)c(CCC(=O)[O-])c(=O)[n-]2)c1	ZINC000195503732	455970712	/nfs/dbraw/zinc/97/07/12/455970712.db2.gz	OFMYKFGRBIOOSR-CSKARUKUSA-N	-2	3	326.396	3.218	10	0		EGAEHL
CC(=O)c1cccc([N-]S(=O)(=O)c2cccc(Cl)c2[O-])c1	ZINC000339202687	456990165	/nfs/dbraw/zinc/99/01/65/456990165.db2.gz	JVYBKIJRKDVCSF-UHFFFAOYSA-N	-2	3	325.773	3.049	10	0		EGAEHL
Cc1nc(C=Cc2csc3ccccc23)[n-]c(=O)c1CCC(=O)[O-]	ZINC000193404843	266030954	/nfs/dbraw/zinc/03/09/54/266030954.db2.gz	XLPAFKTUKXPZEQ-SOFGYWHQSA-N	-2	3	340.404	3.481	10	0		EGAEHL
O=C(N=c1cc(-c2ccccc2F)o[n-]1)c1cc(-c2ccco2)n[n-]1	ZINC000448493044	310004760	/nfs/dbraw/zinc/00/47/60/310004760.db2.gz	RUGBOCURTIWDFF-UHFFFAOYSA-N	-2	3	338.298	3.138	10	0		EGAEHL
Cc1ccc2cccc(S(=O)(=O)[N-]c3cc([O-])cc(F)c3)c2n1	ZINC000536611255	314129801	/nfs/dbraw/zinc/12/98/01/314129801.db2.gz	AHHXWCCPCMWNCP-UHFFFAOYSA-N	-2	3	332.356	3.189	10	0		EGAEHL
Cc1[n-][nH]c(=NC(=O)c2c([O-])cc(F)cc2F)c1-c1ccccc1	ZINC000623489360	460578352	/nfs/dbraw/zinc/57/83/52/460578352.db2.gz	JCTTWZWRNDWDJK-UHFFFAOYSA-N	-2	3	329.306	3.043	10	0		EGAEHL
Cc1ccccc1-n1[n-][n-]c2c(=O)n(-c3cccc(Cl)c3)c(=O)c1=2	ZINC000096500382	454371680	/nfs/dbraw/zinc/37/16/80/454371680.db2.gz	KWCWRVWFEKPYIH-LSDHHAIUSA-N	-2	3	340.770	3.146	10	0		EGAEHL
O=C([O-])c1ccc(CS(=O)(=O)[N-]c2ccc(Cl)cc2F)cc1	ZINC000314355769	456602113	/nfs/dbraw/zinc/60/21/13/456602113.db2.gz	VPDXAPFBDMFOFA-UHFFFAOYSA-N	-2	3	343.763	3.119	10	0		EGAEHL
Cc1cc(C)cc(-c2cc(=NC(=O)c3cc(F)c([O-])c(F)c3)[nH][n-]2)c1	ZINC000436923419	458406355	/nfs/dbraw/zinc/40/63/55/458406355.db2.gz	CEFIEVYAFDMDJI-UHFFFAOYSA-N	-2	3	343.333	3.352	10	0		EGAEHL
Cc1nc2ccc(S(=O)(=O)[N-]c3cccc([O-])c3F)cc2s1	ZINC000561444701	459453602	/nfs/dbraw/zinc/45/36/02/459453602.db2.gz	JQDBQEXQSZPCRB-UHFFFAOYSA-N	-2	3	338.385	3.250	10	0		EGAEHL
COc1ccc(Cc2coc3c(C)c([O-])c(C)c([O-])c3c2=O)cc1	ZINC000013327523	560214407	/nfs/dbraw/zinc/21/44/07/560214407.db2.gz	BUTFXZVBLOLETI-UHFFFAOYSA-N	-2	3	326.348	3.420	10	0	in-vitro	EGAEHL
CC(C)NC(=O)Nc1cccc(-c2nc3ccc([O-])cc3c(=O)[n-]2)c1	ZINC000351848166	547679472	/nfs/dbraw/zinc/67/94/72/547679472.db2.gz	CIRSYETUGNIFAA-UHFFFAOYSA-N	-2	3	338.367	3.238	10	0		EGAEHL
CCc1ccc(CC)c([N-]S(=O)(=O)c2cc(OC)ccc2[O-])c1	ZINC000537197201	314167134	/nfs/dbraw/zinc/16/71/34/314167134.db2.gz	PXFWWJGFQFZHCJ-UHFFFAOYSA-N	-2	3	335.425	3.326	10	0		EGAEHL
COc1cc(C)c(S(=O)(=O)[N-]c2cc([O-])cc(F)c2)cc1Cl	ZINC000432774172	458783189	/nfs/dbraw/zinc/78/31/89/458783189.db2.gz	AGJWJRZZGBHLNI-UHFFFAOYSA-N	-2	3	345.779	3.303	10	0		EGAEHL
CC(C)(C[N-]S(=O)(=O)c1cc(C(=O)[O-])cs1)C1=CCCCC1	ZINC000478261241	459082948	/nfs/dbraw/zinc/08/29/48/459082948.db2.gz	OUASWWLZFALFFH-UHFFFAOYSA-N	-2	3	343.470	3.251	10	0		EGAEHL
O=C(Nc1c([O-])cc(Br)cc1Cl)c1ccc([O-])cn1	ZINC001157127485	1380782524	/nfs/dbraw/zinc/78/25/24/1380782524.db2.gz	LCYZQAQFCASWGK-UHFFFAOYSA-N	-2	3	343.564	3.161	10	0		EGAEHL
CCc1ccc(-n2c(=O)c3[n-][n-]n(-c4cccc(C)c4C)c=3c2=O)cc1	ZINC000102808034	219231773	/nfs/dbraw/zinc/23/17/73/219231773.db2.gz	CTMAQJSHTUDBKC-ROUUACIJSA-N	-2	3	348.406	3.364	10	0		EGAEHL
Cc1ccc(-n2c(=O)c3[n-][n-]n(-c4ccccc4)c=3c2=O)cc1Cl	ZINC000102818196	219232596	/nfs/dbraw/zinc/23/25/96/219232596.db2.gz	LMIOPBIKOBTMOU-LSDHHAIUSA-N	-2	3	340.770	3.146	10	0		EGAEHL
CCc1ccc(CS(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2F)cc1	ZINC000548524621	315022247	/nfs/dbraw/zinc/02/22/47/315022247.db2.gz	PGJQEBUROIFUNZ-UHFFFAOYSA-N	-2	3	337.372	3.028	10	0		EGAEHL
CCc1ccccc1S(=O)(=O)[N-]c1c(C)cc(OC)cc1C(=O)[O-]	ZINC000555374305	315381738	/nfs/dbraw/zinc/38/17/38/315381738.db2.gz	AWWLGBGLRHZNOG-UHFFFAOYSA-N	-2	3	349.408	3.065	10	0		EGAEHL
CCc1cccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2Cl)c1	ZINC000547902034	458810079	/nfs/dbraw/zinc/81/00/79/458810079.db2.gz	XSMFTDCDUYKWLZ-UHFFFAOYSA-N	-2	3	339.800	3.401	10	0		EGAEHL
CCc1ccc(S(=O)(=O)[N-]c2c(C)cc(OC)cc2C(=O)[O-])cc1	ZINC000547908646	458810637	/nfs/dbraw/zinc/81/06/37/458810637.db2.gz	RPCDUXAUNHXMMR-UHFFFAOYSA-N	-2	3	349.408	3.065	10	0		EGAEHL
CCc1ccccc1S(=O)(=O)[N-]c1c(Cl)cccc1C(=O)[O-]	ZINC000584028454	459635774	/nfs/dbraw/zinc/63/57/74/459635774.db2.gz	WWWBKHVJSJJWQV-UHFFFAOYSA-N	-2	3	339.800	3.401	10	0		EGAEHL
CC(C)(C)c1ccc(NC(=O)C[C@]2(C(=O)[O-])CCSC2)c([O-])c1	ZINC000669774927	461793183	/nfs/dbraw/zinc/79/31/83/461793183.db2.gz	SKEDMPALGYSEJZ-QGZVFWFLSA-N	-2	3	337.441	3.226	10	0		EGAEHL
O=C(Nc1cccc(-c2n[nH]c(=O)[n-]2)c1)c1cc([O-])c2ccccc2c1	ZINC000356008775	547722535	/nfs/dbraw/zinc/72/25/35/547722535.db2.gz	QWNKTXZYMBVMME-UHFFFAOYSA-N	-2	3	346.346	3.288	10	0		EGAEHL
O=C([O-])c1ccc(/C=C2\SC(=O)N(c3ccc([O-])cc3)C2=O)cc1	ZINC000039860450	213244097	/nfs/dbraw/zinc/24/40/97/213244097.db2.gz	YDBZLCUEXJKGMK-ZROIWOOFSA-N	-2	3	341.344	3.331	10	0		EGAEHL
O=C(N=c1cc(-c2cc(Cl)cc(Cl)c2)[n-][nH]1)c1cncc([O-])c1	ZINC000339911915	155028572	/nfs/dbraw/zinc/02/85/72/155028572.db2.gz	GVBUFODQOZOQOA-UHFFFAOYSA-N	-2	3	349.177	3.158	10	0		EGAEHL
CCC[C@H](C)CS(=O)(=O)[N-]c1ccc(C(=O)[O-])cc1SC	ZINC000547546737	314915857	/nfs/dbraw/zinc/91/58/57/314915857.db2.gz	RXCBILNMTOVCPE-JTQLQIEISA-N	-2	3	331.459	3.285	10	0		EGAEHL
COc1ccc(S(=O)(=O)[N-]c2cc(C(=O)[O-])c(C)cc2C)cc1C	ZINC000548537715	315022546	/nfs/dbraw/zinc/02/25/46/315022546.db2.gz	JIWUUBOFRXHFGZ-UHFFFAOYSA-N	-2	3	349.408	3.119	10	0		EGAEHL
CC[C@H]([N-]S(=O)(=O)c1cccc(Cl)c1[O-])c1nc(C)cs1	ZINC000631906724	460594677	/nfs/dbraw/zinc/59/46/77/460594677.db2.gz	UKUXNPXMUFOUNZ-JTQLQIEISA-N	-2	3	346.861	3.240	10	0		EGAEHL
O=C([O-])c1ccc([N-]S(=O)(=O)c2ccccc2Cl)c(Cl)c1	ZINC000071392840	454206587	/nfs/dbraw/zinc/20/65/87/454206587.db2.gz	NLODXMINAIXXCU-UHFFFAOYSA-N	-2	3	346.191	3.492	10	0		EGAEHL
Cc1c(Cl)cccc1S(=O)(=O)[N-]c1cc(C(=O)[O-])ccc1F	ZINC000047318000	454355692	/nfs/dbraw/zinc/35/56/92/454355692.db2.gz	OKGZAXOHOIGOOG-UHFFFAOYSA-N	-2	3	343.763	3.287	10	0		EGAEHL
CCCOc1ccc(C(=O)[O-])cc1[N-]S(=O)(=O)C1(C(C)C)CC1	ZINC000629295709	460716609	/nfs/dbraw/zinc/71/66/09/460716609.db2.gz	ROCGBWKAQZKSQA-UHFFFAOYSA-N	-2	3	341.429	3.104	10	0		EGAEHL
CSc1nc([N-]C(=O)c2cc(-c3cccc(Cl)c3)no2)n[n-]1	ZINC000340267470	456349606	/nfs/dbraw/zinc/34/96/06/456349606.db2.gz	JEVXIAPZBUQUOP-UHFFFAOYSA-N	-2	3	335.776	3.087	10	0		EGAEHL
O=C(N=c1cc(-c2ccccc2)[n-][nH]1)c1cc(F)c([O-])c(Cl)c1	ZINC000436899739	458402867	/nfs/dbraw/zinc/40/28/67/458402867.db2.gz	FPRXYYCHAHVGJC-UHFFFAOYSA-N	-2	3	331.734	3.249	10	0		EGAEHL
O=C([O-])CCC1(NC(=O)c2cc([O-])ccc2Cl)CCCCC1	ZINC000923216314	1322712804	/nfs/dbraw/zinc/71/28/04/1322712804.db2.gz	XATAGXDJMIJTEV-UHFFFAOYSA-N	-2	3	325.792	3.343	10	0		EGAEHL
Cc1ccc(S(=O)(=O)[N-]c2ccc(Br)c([O-])c2)cc1	ZINC001321013482	1386783628	/nfs/dbraw/zinc/78/36/28/1386783628.db2.gz	DUJBYDFAHGVALE-UHFFFAOYSA-N	-2	3	342.214	3.264	10	0		EGAEHL
O=C([O-])CC[C@@H](Cc1ccccc1)NCc1c(F)ccc([O-])c1F	ZINC000263474857	141051709	/nfs/dbraw/zinc/05/17/09/141051709.db2.gz	FCWSKWUQEJSITO-ZDUSSCGKSA-N	-2	3	335.350	3.236	10	0		EGAEHL
O=C([O-])c1cccc(Cl)c1[N-]S(=O)(=O)c1cc(F)cc(F)c1	ZINC000013269623	323212572	/nfs/dbraw/zinc/21/25/72/323212572.db2.gz	KTKUNPZJSPIUIA-UHFFFAOYSA-N	-2	3	347.726	3.117	10	0		EGAEHL
O=C(Nc1ccc(Br)c([O-])c1)c1cc(F)ccc1[O-]	ZINC001321107092	1386810781	/nfs/dbraw/zinc/81/07/81/1386810781.db2.gz	OXJVPUBQOMQOAA-UHFFFAOYSA-N	-2	3	326.121	3.252	10	0		EGAEHL
Cc1ccc(C=Cc2nc(C)c(CCC(=O)[O-])c(=O)[n-]2)cc1Cl	ZINC000195503235	266184614	/nfs/dbraw/zinc/18/46/14/266184614.db2.gz	RERYOFIAZALVKT-FNORWQNLSA-N	-2	3	332.787	3.228	10	0		EGAEHL
CCCc1ccc(S(=O)(=O)[N-]c2cc(C(=O)[O-])ccc2C)cc1	ZINC000007057373	453026985	/nfs/dbraw/zinc/02/69/85/453026985.db2.gz	KILZURLUQMIGFC-UHFFFAOYSA-N	-2	3	333.409	3.447	10	0		EGAEHL
CCC(=O)[N-]C([N-]c1ccc(Cl)cn1)(C(F)(F)F)C(F)(F)F	ZINC000019944604	453660965	/nfs/dbraw/zinc/66/09/65/453660965.db2.gz	UNOUMWCSWMASNC-UHFFFAOYSA-N	-2	3	349.662	3.494	10	0		EGAEHL
Cc1cccc(-n2[n-][n-]c3c(=O)n(-c4cccc(Cl)c4)c(=O)c2=3)c1	ZINC000096500378	454371761	/nfs/dbraw/zinc/37/17/61/454371761.db2.gz	YAUHXDHBZCCXSG-GJZGRUSLSA-N	-2	3	340.770	3.146	10	0		EGAEHL
CCc1ccc(-n2c(=O)c3[n-][n-]n(-c4cc(C)ccc4C)c=3c2=O)cc1	ZINC000102808031	454521858	/nfs/dbraw/zinc/52/18/58/454521858.db2.gz	YHPLCEPSQXQMCO-ROUUACIJSA-N	-2	3	348.406	3.364	10	0		EGAEHL
CCc1cc([N-]S(=O)(=O)c2ccc([O-])c(NC(C)=O)c2)ccc1C	ZINC000182434964	455513742	/nfs/dbraw/zinc/51/37/42/455513742.db2.gz	GYZADSFRVFTDFQ-UHFFFAOYSA-N	-2	3	348.424	3.022	10	0		EGAEHL
O=S(=O)([N-]c1cc([O-])cc(F)c1)c1ccc(Br)cc1	ZINC000161294341	455556599	/nfs/dbraw/zinc/55/65/99/455556599.db2.gz	FTWVXMHBGXPTEW-UHFFFAOYSA-N	-2	3	346.177	3.095	10	0		EGAEHL
Cc1nc(C=Cc2ccc(F)cc2Cl)[n-]c(=O)c1CCC(=O)[O-]	ZINC000443457262	457767491	/nfs/dbraw/zinc/76/74/91/457767491.db2.gz	SDTZNZJZBFZCJJ-UTCJRWHESA-N	-2	3	336.750	3.471	10	0		EGAEHL
Cc1ccc(S(=O)(=O)[N-]c2cc(F)cc(C(=O)[O-])c2F)cc1C	ZINC000547933226	458810841	/nfs/dbraw/zinc/81/08/41/458810841.db2.gz	JFWRTDHNERIQEZ-UHFFFAOYSA-N	-2	3	341.335	3.081	10	0		EGAEHL
Cc1ccc(S(=O)(=O)[N-]c2ccc([C@@H]3C[C@H]3C(=O)[O-])cc2)c(C)c1	ZINC000630423355	461109288	/nfs/dbraw/zinc/10/92/88/461109288.db2.gz	KFRULCMDOFQHCW-JKSUJKDBSA-N	-2	3	345.420	3.292	10	0		EGAEHL
O=S(=O)(CCc1cccc(Cl)c1)[N-]c1c([O-])cccc1F	ZINC000671660153	548327049	/nfs/dbraw/zinc/32/70/49/548327049.db2.gz	YSTBYOMDLDSWID-UHFFFAOYSA-N	-2	3	329.780	3.169	10	0		EGAEHL
CCc1cc([N-]S(=O)(=O)c2ccc(C(=O)[O-])c(C)c2)ccc1C	ZINC000391914651	308901672	/nfs/dbraw/zinc/90/16/72/308901672.db2.gz	NDUFLAVMYDVWSK-UHFFFAOYSA-N	-2	3	333.409	3.365	10	0		EGAEHL
O=C(N=c1cc(-c2ccncc2)[n-][nH]1)c1ccc2ccccc2c1[O-]	ZINC000436663276	309767219	/nfs/dbraw/zinc/76/72/19/309767219.db2.gz	FFSSYFSYSJLVHD-UHFFFAOYSA-N	-2	3	330.347	3.005	10	0		EGAEHL
CCC[C@@H](C)CS(=O)(=O)[N-]c1ccc(C(=O)[O-])cc1SC	ZINC000547546738	314915853	/nfs/dbraw/zinc/91/58/53/314915853.db2.gz	RXCBILNMTOVCPE-SNVBAGLBSA-N	-2	3	331.459	3.285	10	0		EGAEHL
Cc1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2C(=O)[O-])c(C)c1	ZINC000013263457	453456393	/nfs/dbraw/zinc/45/63/93/453456393.db2.gz	IUKUUHOYWUYGQW-UHFFFAOYSA-N	-2	3	339.800	3.456	10	0		EGAEHL
Cc1cccc(S(=O)(=O)[N-]c2cc(C(=O)[O-])ccc2Cl)c1	ZINC000013340904	453459462	/nfs/dbraw/zinc/45/94/62/453459462.db2.gz	CFTFJVZNIICRNU-UHFFFAOYSA-N	-2	3	325.773	3.147	10	0		EGAEHL
CCOc1cccc(C=Cc2nc(C)c(CCC(=O)[O-])c(=O)[n-]2)c1	ZINC000347391885	457398139	/nfs/dbraw/zinc/39/81/39/457398139.db2.gz	PMRALAORMHESTR-CLFYSBASSA-N	-2	3	328.368	3.077	10	0		EGAEHL
Cc1nc(C=Cc2cc(Cl)ccc2F)[n-]c(=O)c1CCC(=O)[O-]	ZINC000443455994	457768037	/nfs/dbraw/zinc/76/80/37/457768037.db2.gz	PFXWDEHRRWBZPW-KXFIGUGUSA-N	-2	3	336.750	3.471	10	0		EGAEHL
O=S(=O)(CCC1Cc2ccccc2C1)[N-]c1c([O-])cccc1F	ZINC000650182076	461627704	/nfs/dbraw/zinc/62/77/04/461627704.db2.gz	OFHXNCPPGUGSCN-UHFFFAOYSA-N	-2	3	335.400	3.078	10	0		EGAEHL
CC(C)(C)c1ccc(NC(=O)C[C@@]2(C(=O)[O-])CCSC2)c([O-])c1	ZINC000669774926	461792959	/nfs/dbraw/zinc/79/29/59/461792959.db2.gz	SKEDMPALGYSEJZ-KRWDZBQOSA-N	-2	3	337.441	3.226	10	0		EGAEHL
O=C(Nc1ccc(-c2nc(=O)o[n-]2)cc1)c1cc([O-])c2ccccc2c1	ZINC000354284670	547704316	/nfs/dbraw/zinc/70/43/16/547704316.db2.gz	SPMLVELHODNPPL-UHFFFAOYSA-N	-2	3	347.330	3.141	10	0		EGAEHL
O=S(=O)(CCC(F)(F)F)[N-]c1cc(C(F)(F)F)ccc1[O-]	ZINC000174731372	1294520468	/nfs/dbraw/zinc/52/04/68/1294520468.db2.gz	DHKVMVMORYDRNY-UHFFFAOYSA-N	-2	3	337.241	3.105	10	0		EGAEHL
Cc1nc(C=Cc2ccc(C(C)C)cc2)[n-]c(=O)c1CCC(=O)[O-]	ZINC000193404880	266029883	/nfs/dbraw/zinc/02/98/83/266029883.db2.gz	ZSPMXCGGDZJIFC-UXBLZVDNSA-N	-2	3	326.396	3.389	10	0		EGAEHL
Cc1cc(C)cc(-n2[n-][n-]c3c(=O)n(-c4cc(C)cc(C)c4)c(=O)c2=3)c1	ZINC000096236015	301226043	/nfs/dbraw/zinc/22/60/43/301226043.db2.gz	RFPFXJQFWNTLPO-ROUUACIJSA-N	-2	3	348.406	3.418	10	0		EGAEHL
COc1c(C)ccc([N-]S(=O)(=O)c2cccc(Cl)c2[O-])c1C	ZINC000550105999	315116516	/nfs/dbraw/zinc/11/65/16/315116516.db2.gz	GJRDKZIYVPXDHZ-UHFFFAOYSA-N	-2	3	341.816	3.472	10	0		EGAEHL
Cc1cccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2Cl)c1	ZINC000071392805	454206671	/nfs/dbraw/zinc/20/66/71/454206671.db2.gz	JFEQFBXXUSBYDE-UHFFFAOYSA-N	-2	3	325.773	3.147	10	0		EGAEHL
O=C([O-])c1ccc(CS(=O)(=O)[N-]c2cc(F)ccc2Cl)cc1	ZINC000318370741	456619226	/nfs/dbraw/zinc/61/92/26/456619226.db2.gz	YCLZGZCAVXKWRD-UHFFFAOYSA-N	-2	3	343.763	3.119	10	0		EGAEHL
Cc1nc(C=Cc2ccc(F)c(Cl)c2)[n-]c(=O)c1CCC(=O)[O-]	ZINC000443447543	457766810	/nfs/dbraw/zinc/76/68/10/457766810.db2.gz	WKFAQAWUKKIKNK-UTCJRWHESA-N	-2	3	336.750	3.471	10	0		EGAEHL
O=c1cc(C2CC2)nc(SCc2noc(-c3ccccc3[O-])n2)[n-]1	ZINC000373047458	458385344	/nfs/dbraw/zinc/38/53/44/458385344.db2.gz	DEJSGDJIVJHINO-UHFFFAOYSA-N	-2	3	342.380	3.108	10	0		EGAEHL
O=C(NCc1ncccc1[O-])c1cc(Cc2ccccc2)ccc1[O-]	ZINC000436996074	458419236	/nfs/dbraw/zinc/41/92/36/458419236.db2.gz	AZIIKTWODVZNEZ-UHFFFAOYSA-N	-2	3	334.375	3.014	10	0		EGAEHL
Cc1c(F)cccc1S(=O)(=O)[N-]c1c(Cl)cccc1C(=O)[O-]	ZINC000547547302	458760647	/nfs/dbraw/zinc/76/06/47/458760647.db2.gz	RZNBXPDAVQYSJY-UHFFFAOYSA-N	-2	3	343.763	3.287	10	0		EGAEHL
CCc1ccc(-n2c(=O)c3[n-][n-]n(-c4cccc(C)c4)c=3c2=O)cc1	ZINC000102808249	219231827	/nfs/dbraw/zinc/23/18/27/219231827.db2.gz	YGXAUUVWWLZQNV-SJORKVTESA-N	-2	3	334.379	3.055	10	0		EGAEHL
CCc1ccc(-n2c(=O)c3[n-][n-]n(-c4ccccc4CC)c=3c2=O)cc1	ZINC000102818089	219232883	/nfs/dbraw/zinc/23/28/83/219232883.db2.gz	FASYBRXSAPMCNN-MSOLQXFVSA-N	-2	3	348.406	3.309	10	0		EGAEHL
O=S(=O)([N-]c1cc(F)c(F)cc1F)c1cccc(Cl)c1[O-]	ZINC000436476074	309756600	/nfs/dbraw/zinc/75/66/00/309756600.db2.gz	HPOYFFGHNKTGBN-UHFFFAOYSA-N	-2	3	337.706	3.264	10	0		EGAEHL
CCCN(CCC)S(=O)(=O)[N-]c1cc(C(F)(F)F)ccc1[O-]	ZINC000530629054	313564914	/nfs/dbraw/zinc/56/49/14/313564914.db2.gz	ZZRWHRQHDVAFLI-UHFFFAOYSA-N	-2	3	340.367	3.190	10	0		EGAEHL
CSc1cc(C(=O)[O-])ccc1[N-]S(=O)(=O)CC1CCCCC1	ZINC000548199231	314985842	/nfs/dbraw/zinc/98/58/42/314985842.db2.gz	MAQWDNSZLCQAHW-UHFFFAOYSA-N	-2	3	343.470	3.429	10	0		EGAEHL
Cc1cc(C)c(C(=O)[O-])cc1[N-]S(=O)(=O)c1ccc(Cl)cc1	ZINC000548527741	315022596	/nfs/dbraw/zinc/02/25/96/315022596.db2.gz	ASBZTIMNYSSLRC-UHFFFAOYSA-N	-2	3	339.800	3.456	10	0		EGAEHL
Cc1ccc(NC(=O)c2c([O-])[n-]c3ccccc3c2=O)cc1Cl	ZINC000064965654	454520690	/nfs/dbraw/zinc/52/06/90/454520690.db2.gz	ZMEVMDQIFRQKOO-UHFFFAOYSA-N	-2	3	328.755	3.448	10	0		EGAEHL
CC(C)(C)c1ccc([N-]S(=O)(=O)C[C@@H]2CCCCO2)c([O-])c1	ZINC000443525848	457776746	/nfs/dbraw/zinc/77/67/46/457776746.db2.gz	BEUKYHWOHGMQFB-ZDUSSCGKSA-N	-2	3	327.446	3.001	10	0		EGAEHL
COc1cc(=NC(=O)c2cc(C(C)C)cc(C(C)C)c2[O-])[n-]n1C	ZINC000547816741	458799587	/nfs/dbraw/zinc/79/95/87/458799587.db2.gz	UMFAJXZZEQJXOK-UHFFFAOYSA-N	-2	3	331.416	3.055	10	0		EGAEHL
O=C([N-]c1c([O-])cccc1F)c1cc(-c2ccc3c(c2)CCO3)no1	ZINC000676394461	549081658	/nfs/dbraw/zinc/08/16/58/549081658.db2.gz	YFZACXGBILNADP-UHFFFAOYSA-N	-2	3	340.310	3.374	10	0		EGAEHL
O=C(Nc1ccc(Br)c([O-])c1)c1c([O-])cccc1F	ZINC001321275525	1386863657	/nfs/dbraw/zinc/86/36/57/1386863657.db2.gz	BDDLEIMVOWNHOA-UHFFFAOYSA-N	-2	3	326.121	3.252	10	0		EGAEHL
Cc1ccc(-n2c(=O)c3[n-][n-]n(-c4ccc(Cl)cc4)c=3c2=O)cc1	ZINC000102807261	204051071	/nfs/dbraw/zinc/05/10/71/204051071.db2.gz	MCJTZABAWZRXBX-GJZGRUSLSA-N	-2	3	340.770	3.146	10	0		EGAEHL
O=C([N-]c1n[n-]c(C(F)(F)F)n1)c1coc(C2CCCCC2)n1	ZINC000338339334	456775988	/nfs/dbraw/zinc/77/59/88/456775988.db2.gz	OLIREOOMDHYVLQ-UHFFFAOYSA-N	-2	3	329.282	3.112	10	0		EGAEHL
COc1ccc([O-])c(S(=O)(=O)[N-]c2ccc(F)c(C3CC3)c2)c1	ZINC000685002614	550392722	/nfs/dbraw/zinc/39/27/22/550392722.db2.gz	CKPZUXFOSYQJOH-UHFFFAOYSA-N	-2	3	337.372	3.218	10	0		EGAEHL
Cc1nc(C=Cc2ccc(F)c(Cl)c2)[n-]c(=O)c1CCC(=O)[O-]	ZINC000195503714	266185493	/nfs/dbraw/zinc/18/54/93/266185493.db2.gz	WKFAQAWUKKIKNK-ZZXKWVIFSA-N	-2	3	336.750	3.058	10	0		EGAEHL
CCc1cccc(C(=O)Nc2ccc(-c3nc(C)cc(=O)[n-]3)cc2)c1[O-]	ZINC000094056580	454184110	/nfs/dbraw/zinc/18/41/10/454184110.db2.gz	GROJABHRUOVINO-UHFFFAOYSA-N	-2	3	349.390	3.266	10	0		EGAEHL
Cc1nc(SCc2cc(=O)[n-]c(C3CC3)n2)[n-]c(=O)c1C1CC1	ZINC000631023738	461478370	/nfs/dbraw/zinc/47/83/70/461478370.db2.gz	VPKBZZPDMLVCSP-UHFFFAOYSA-N	-2	3	330.413	3.033	10	0		EGAEHL
Cc1cc(C)cc(-n2[n-][n-]c3c(=O)n(-c4cc(C)cc(C)c4)c(=O)c2=3)c1	ZINC000096236014	301226011	/nfs/dbraw/zinc/22/60/11/301226011.db2.gz	RFPFXJQFWNTLPO-ZWKOTPCHSA-N	-2	3	348.406	3.418	10	0		EGAEHL
Cc1cccc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2Cl)c1F	ZINC000313232162	308764935	/nfs/dbraw/zinc/76/49/35/308764935.db2.gz	YJQJWEZZVCCKJT-UHFFFAOYSA-N	-2	3	343.763	3.287	10	0		EGAEHL
Cc1ccc(F)c(S(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2Cl)c1	ZINC000316204101	308766357	/nfs/dbraw/zinc/76/63/57/308766357.db2.gz	MUUPGXJIMVSVMF-UHFFFAOYSA-N	-2	3	343.763	3.287	10	0		EGAEHL
CCOc1ccc([C@@H](NCc2ccccc2C)P(=O)([O-])[O-])cc1	ZINC000012997507	453436600	/nfs/dbraw/zinc/43/66/00/453436600.db2.gz	GIJAOAHCAKVYGK-KRWDZBQOSA-N	-2	3	335.340	3.360	10	0		EGAEHL
CC(C)c1cc(C(=O)N2Cc3ccc(C(=O)[O-])cc3C2)c([O-])cc1O	ZINC000113704300	454933160	/nfs/dbraw/zinc/93/31/60/454933160.db2.gz	SHSWHTFIEDMUJH-UHFFFAOYSA-N	-2	3	341.363	3.075	10	0		EGAEHL
Cc1nc2ccc(S(=O)(=O)[N-]c3cc([O-])cc(F)c3)cc2s1	ZINC000427252995	457967431	/nfs/dbraw/zinc/96/74/31/457967431.db2.gz	KAXMGRZHAZNYMJ-UHFFFAOYSA-N	-2	3	338.385	3.250	10	0		EGAEHL
CCCCCS(=O)(=O)[N-]c1cc(C(=O)[O-])ccc1OC(C)C	ZINC000547609975	458761168	/nfs/dbraw/zinc/76/11/68/458761168.db2.gz	UFFSCJYUMWDLBQ-UHFFFAOYSA-N	-2	3	329.418	3.104	10	0		EGAEHL
CO[C@@H](CS(=O)(=O)[N-]c1ccc(C(C)(C)C)cc1[O-])C(C)C	ZINC000647132340	461515593	/nfs/dbraw/zinc/51/55/93/461515593.db2.gz	MDMZLYDPRSFNOZ-HNNXBMFYSA-N	-2	3	329.462	3.102	10	0		EGAEHL
O=C(Nc1ccc([O-])c(F)c1F)c1ccc(Br)cc1[O-]	ZINC001140657701	1378107060	/nfs/dbraw/zinc/10/70/60/1378107060.db2.gz	WBEZMBXOHFJBLW-UHFFFAOYSA-N	-2	3	344.111	3.391	10	0		EGAEHL
Cc1ccc(-n2c(=O)c3[n-][n-]n(-c4ccc(Cl)cc4)c=3c2=O)cc1	ZINC000102807263	204050460	/nfs/dbraw/zinc/05/04/60/204050460.db2.gz	MCJTZABAWZRXBX-CABCVRRESA-N	-2	3	340.770	3.146	10	0		EGAEHL
O=C(Nc1ccc(OC(F)(F)F)cc1[O-])c1c([O-])cccc1F	ZINC000442919677	309891455	/nfs/dbraw/zinc/89/14/55/309891455.db2.gz	FZEOYLJNQIRICC-UHFFFAOYSA-N	-2	3	331.221	3.388	10	0		EGAEHL
Cc1cccc(S(=O)(=O)[N-]c2c(Cl)cccc2C(=O)[O-])c1	ZINC000013269536	323212335	/nfs/dbraw/zinc/21/23/35/323212335.db2.gz	HUVRIKYCHRQJGZ-UHFFFAOYSA-N	-2	3	325.773	3.147	10	0		EGAEHL
COc1cc([O-])c(C(=O)c2c(C)cc([O-])cc2OC)c([O-])c1Cl	ZINC000014647535	453540761	/nfs/dbraw/zinc/54/07/61/453540761.db2.gz	DSJPUSRRLBBBAS-UHFFFAOYSA-N	-3	3	338.743	3.013	10	0	in-vitro	EGAEHL
O=C(NN=Cc1cc(Cl)cc(Cl)c1[O-])c1ccccc1[O-]	ZINC000254924559	455856854	/nfs/dbraw/zinc/85/68/54/455856854.db2.gz	PMJGWWMIDKKJOA-UHFFFAOYSA-N	-2	3	325.151	3.169	10	0		EGAEHL
CCC(CC)CS(=O)(=O)[N-]c1ccc(C(=O)[O-])cc1SC	ZINC000547547238	458760026	/nfs/dbraw/zinc/76/00/26/458760026.db2.gz	XZROWAWKNKVUSU-UHFFFAOYSA-N	-2	3	331.459	3.285	10	0		EGAEHL
O=C(Nc1cc(Br)ccc1[O-])c1c([O-])cc(F)cc1F	ZINC000674744413	548790065	/nfs/dbraw/zinc/79/00/65/548790065.db2.gz	LEEKFMYSBYWMMV-UHFFFAOYSA-N	-2	3	344.111	3.391	10	0		EGAEHL
CCC(=O)c1ccc([O-])c([N-]C(=O)c2ocnc2C(F)(F)F)c1	ZINC001141416721	1378321627	/nfs/dbraw/zinc/32/16/27/1378321627.db2.gz	SOUKEBWBVSQWAF-UHFFFAOYSA-N	-2	3	328.246	3.244	10	0		EGAEHL
Cc1ccc(-n2c(=O)c3[n-][n-]n(-c4ccccc4)c=3c2=O)cc1Cl	ZINC000033114647	202250795	/nfs/dbraw/zinc/25/07/95/202250795.db2.gz	LMIOPBIKOBTMOU-HUUCEWRRSA-N	-2	3	340.770	3.146	10	0		EGAEHL
Cc1csc(S(=O)(=O)[N-]CCC2(CC(=O)[O-])CCCCC2)c1	ZINC000572482750	317345832	/nfs/dbraw/zinc/34/58/32/317345832.db2.gz	YVWRUYRGUDZGJW-UHFFFAOYSA-N	-2	3	345.486	3.150	10	0		EGAEHL
O=C([O-])c1cc(F)cc([N-]S(=O)(=O)CCC2CCCCC2)c1F	ZINC000577157208	324753054	/nfs/dbraw/zinc/75/30/54/324753054.db2.gz	PCQGUKRIPXHLOB-UHFFFAOYSA-N	-2	3	347.383	3.375	10	0		EGAEHL
CCc1ccc(-n2c(=O)c3[n-][n-]n(-c4ccccc4CC)c=3c2=O)cc1	ZINC000102818090	204052048	/nfs/dbraw/zinc/05/20/48/204052048.db2.gz	FASYBRXSAPMCNN-ZWKOTPCHSA-N	-2	3	348.406	3.309	10	0		EGAEHL
O=C([O-])c1ccc(S(=O)(=O)[N-]c2ccc(F)c(C3CC3)c2)cc1	ZINC000337161647	163149235	/nfs/dbraw/zinc/14/92/35/163149235.db2.gz	UVMXSJRWZPZSQC-UHFFFAOYSA-N	-2	3	335.356	3.202	10	0		EGAEHL
C[C@H]1CCN(C(=O)c2cc(=O)c3ccccc3[n-]2)c2c([O-])cccc21	ZINC000345133829	278361709	/nfs/dbraw/zinc/36/17/09/278361709.db2.gz	MNGQSHVEWGHCHQ-LBPRGKRZSA-N	-2	3	334.375	3.388	10	0		EGAEHL
CCc1cccc(S(=O)(=O)[N-]c2c(Cl)cccc2C(=O)[O-])c1	ZINC000548527690	315022381	/nfs/dbraw/zinc/02/23/81/315022381.db2.gz	XADUICQZJIZDGK-UHFFFAOYSA-N	-2	3	339.800	3.401	10	0		EGAEHL
Cc1ccc(N2[N-]C(=O)/C(=C\c3cc(Cl)ccc3[O-])C2=O)cc1C	ZINC000000184080	452531799	/nfs/dbraw/zinc/53/17/99/452531799.db2.gz	CCYNQATWMVMIPY-OQLLNIDSSA-N	-2	3	342.782	3.124	10	0		EGAEHL
O=C(N=c1nc(-c2ccsc2)[n-]s1)c1cc([O-])ccc1Cl	ZINC000377959156	458582842	/nfs/dbraw/zinc/58/28/42/458582842.db2.gz	ZLMFFMVVHCGDOC-UHFFFAOYSA-N	-2	3	337.813	3.300	10	0		EGAEHL
CC(C)(C)c1nc(=NC(=O)c2cc([O-])c3ccccc3c2)s[n-]1	ZINC000527159577	548029276	/nfs/dbraw/zinc/02/92/76/548029276.db2.gz	GMHLJBCPNSENSV-UHFFFAOYSA-N	-2	3	327.409	3.369	10	0		EGAEHL
Cc1nc(C=Cc2cccc(OC(C)C)c2)[n-]c(=O)c1CCC(=O)[O-]	ZINC000193404496	240151161	/nfs/dbraw/zinc/15/11/61/240151161.db2.gz	ZLTMCXSWPHBACW-VQHVLOKHSA-N	-2	3	342.395	3.053	10	0		EGAEHL
Cc1ccc(S(=O)(=O)[N-]c2cc(C(=O)[O-])c(F)cc2F)c(C)c1	ZINC000047383470	204337783	/nfs/dbraw/zinc/33/77/83/204337783.db2.gz	UQPODQJKGFCYQU-UHFFFAOYSA-N	-2	3	341.335	3.081	10	0		EGAEHL
COC(=O)c1cc(C(=O)Nc2cc(Cl)c([O-])c(Cl)c2)c[n-]1	ZINC000344563069	164189427	/nfs/dbraw/zinc/18/94/27/164189427.db2.gz	JCWRQWZHYMOYMS-UHFFFAOYSA-N	-2	3	329.139	3.066	10	0		EGAEHL
CCOc1ccc(S(=O)(=O)[N-]c2cc([O-])cc(F)c2)c(C)c1	ZINC000179329954	265372891	/nfs/dbraw/zinc/37/28/91/265372891.db2.gz	RNBXXSGGCMCKNC-UHFFFAOYSA-N	-2	3	325.361	3.039	10	0		EGAEHL
Cc1ccccc1-n1[n-][n-]c2c(=O)n(-c3cccc(Cl)c3)c(=O)c1=2	ZINC000096500385	454371575	/nfs/dbraw/zinc/37/15/75/454371575.db2.gz	KWCWRVWFEKPYIH-GJZGRUSLSA-N	-2	3	340.770	3.146	10	0		EGAEHL
O=C([O-])CCC1CCN(Cc2cccc([O-])c2Br)CC1	ZINC000665343866	462408815	/nfs/dbraw/zinc/40/88/15/462408815.db2.gz	YCMDPWLRSNJOFW-UHFFFAOYSA-N	-2	3	342.233	3.232	10	0		EGAEHL
O=S(=O)(Cc1ccccc1)[N-]c1cc(Br)ccc1[O-]	ZINC000094573805	1292943128	/nfs/dbraw/zinc/94/31/28/1292943128.db2.gz	PPMQMAOTXSVNBU-UHFFFAOYSA-N	-2	3	342.214	3.097	10	0		EGAEHL
CCc1ccccc1S(=O)(=O)[N-]c1cc(C(=O)[O-])c(C)cc1C	ZINC000517210470	312368022	/nfs/dbraw/zinc/36/80/22/312368022.db2.gz	AYNPXOHXOUZYPP-UHFFFAOYSA-N	-2	3	333.409	3.365	10	0		EGAEHL
O=C([O-])c1c(Cl)cccc1[N-]S(=O)(=O)Cc1ccccc1F	ZINC000396477475	324293967	/nfs/dbraw/zinc/29/39/67/324293967.db2.gz	TVRFLBJTUUWAQM-UHFFFAOYSA-N	-2	3	343.763	3.119	10	0		EGAEHL
Cc1cc(C)cc(-n2c(=O)c3[n-][n-]n(-c4cccc(C)c4C)c=3c2=O)c1	ZINC000096236017	454310324	/nfs/dbraw/zinc/31/03/24/454310324.db2.gz	VNQHIUTWJSFHMP-ZWKOTPCHSA-N	-2	3	348.406	3.418	10	0		EGAEHL
Cc1cc(S(=O)(=O)[N-]c2c(Cl)cccc2C(=O)[O-])c(C)o1	ZINC000547547023	458759875	/nfs/dbraw/zinc/75/98/75/458759875.db2.gz	JSCKAGNEQVTBRI-UHFFFAOYSA-N	-2	3	329.761	3.049	10	0		EGAEHL
O=C(Nc1ccc(OC(F)(F)F)cc1[O-])c1cc(F)ccc1[O-]	ZINC000442920631	459061280	/nfs/dbraw/zinc/06/12/80/459061280.db2.gz	HVOFVUSZRCODCM-UHFFFAOYSA-N	-2	3	331.221	3.388	10	0		EGAEHL
COc1cccc(C(=O)N=c2cc(-c3cccc(Cl)c3)[n-][nH]2)c1[O-]	ZINC000622892466	460345707	/nfs/dbraw/zinc/34/57/07/460345707.db2.gz	QYYQUTOSXRIUSA-UHFFFAOYSA-N	-2	3	343.770	3.119	10	0		EGAEHL
O=C([O-])c1ccc(Cl)c([N-]S(=O)(=O)c2cccc(Cl)c2)c1	ZINC000013340912	323212382	/nfs/dbraw/zinc/21/23/82/323212382.db2.gz	KFXGAWYJMQTFCC-UHFFFAOYSA-N	-2	3	346.191	3.492	10	0		EGAEHL
O=S(=O)([N-]c1ccc(Br)c([O-])c1)c1ccsc1	ZINC001323533403	1387383292	/nfs/dbraw/zinc/38/32/92/1387383292.db2.gz	PKVAWPKJMZXLJY-UHFFFAOYSA-N	-2	3	334.216	3.017	10	0		EGAEHL
O=C(Nc1ccc([O-])c(Cl)c1)c1nc[n-]c1C(=O)c1ccccc1	ZINC001295292102	1382594892	/nfs/dbraw/zinc/59/48/92/1382594892.db2.gz	KRROPCLHESDUHW-UHFFFAOYSA-N	-2	3	341.754	3.252	10	0		EGAEHL
O=C(Nc1ccc([O-])c(Cl)c1)c1[n-]cnc1C(=O)c1ccccc1	ZINC001295292102	1382594894	/nfs/dbraw/zinc/59/48/94/1382594894.db2.gz	KRROPCLHESDUHW-UHFFFAOYSA-N	-2	3	341.754	3.252	10	0		EGAEHL
COc1ccc2c(c1)[n-]cc(C(=O)Nc1cccc(Cl)c1[O-])c2=O	ZINC001306574687	1383897039	/nfs/dbraw/zinc/89/70/39/1383897039.db2.gz	XUPSOCWELNFTGS-UHFFFAOYSA-N	-2	3	344.754	3.148	10	0		EGAEHL
O=C([O-])c1ccc(NC(=O)c2sccc2Br)c([O-])c1	ZINC000104301195	219373291	/nfs/dbraw/zinc/37/32/91/219373291.db2.gz	UAAXMVGEIZRCAU-UHFFFAOYSA-N	-2	3	342.170	3.167	10	0		EGAEHL
CC1(C)Cc2cc(S(=O)(=O)[N-]c3cc([O-])cc(F)c3)ccc2O1	ZINC000348889943	156277599	/nfs/dbraw/zinc/27/75/99/156277599.db2.gz	TVBZYABXNSACFJ-UHFFFAOYSA-N	-2	3	337.372	3.046	10	0		EGAEHL
O=S(=O)([N-]c1ccc(-c2cc[nH]n2)cc1)c1cccc(Cl)c1[O-]	ZINC000436479575	309756564	/nfs/dbraw/zinc/75/65/64/309756564.db2.gz	WJGIJSDEYKCWJJ-UHFFFAOYSA-N	-2	3	349.799	3.237	10	0		EGAEHL
O=C(Nc1cccc([O-])c1F)c1nn(-c2ccc(Cl)cc2)cc1[O-]	ZINC000562590689	315856629	/nfs/dbraw/zinc/85/66/29/315856629.db2.gz	FWDCPQKUMFXWJB-UHFFFAOYSA-N	-2	3	347.733	3.328	10	0		EGAEHL
Cc1ccccc1-n1[n-][n-]c2c(=O)n(-c3cccc(Cl)c3)c(=O)c1=2	ZINC000033114680	453906301	/nfs/dbraw/zinc/90/63/01/453906301.db2.gz	KWCWRVWFEKPYIH-HUUCEWRRSA-N	-2	3	340.770	3.146	10	0		EGAEHL
Cc1ccc([O-])c(S(=O)(=O)[N-]c2ccccc2N2CCCCC2)c1	ZINC000071945481	454260379	/nfs/dbraw/zinc/26/03/79/454260379.db2.gz	VVNONNVIAVZQGF-UHFFFAOYSA-N	-2	3	346.452	3.492	10	0		EGAEHL
O=S(=O)([N-]c1cc([O-])cc(F)c1)c1ccccc1C(F)(F)F	ZINC000161303956	455557479	/nfs/dbraw/zinc/55/74/79/455557479.db2.gz	AHLOPUVXTCEMJS-UHFFFAOYSA-N	-2	3	335.278	3.351	10	0		EGAEHL
CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1[N-]S(=O)(=O)c1cc(C(=O)[O-])cs1	ZINC000315569895	456608739	/nfs/dbraw/zinc/60/87/39/456608739.db2.gz	ZMBZQXYXKBSCMR-WXHSDQCUSA-N	-2	3	345.486	3.185	10	0		EGAEHL
O=S(=O)([N-]c1ccc(Br)c([O-])c1)c1cccc(F)c1	ZINC001320805251	1386723761	/nfs/dbraw/zinc/72/37/61/1386723761.db2.gz	CCYPTGLWPQUCKX-UHFFFAOYSA-N	-2	3	346.177	3.095	10	0		EGAEHL
CCc1ccc(-n2c(=O)c3[n-][n-]n(-c4cccc(C)c4)c=3c2=O)cc1	ZINC000102808252	219232313	/nfs/dbraw/zinc/23/23/13/219232313.db2.gz	YGXAUUVWWLZQNV-DLBZAZTESA-N	-2	3	334.379	3.055	10	0		EGAEHL
Cc1c(F)cccc1S(=O)(=O)[N-]c1ccc(C(=O)[O-])cc1Cl	ZINC000547888801	314950896	/nfs/dbraw/zinc/95/08/96/314950896.db2.gz	BJHCWPSXULMRSJ-UHFFFAOYSA-N	-2	3	343.763	3.287	10	0		EGAEHL
CCC(=O)Nc1ccc([N-]S(=O)(=O)c2cc(C)ccc2[O-])cc1C	ZINC000057118497	454103640	/nfs/dbraw/zinc/10/36/40/454103640.db2.gz	HLLXXUGFFGURIL-UHFFFAOYSA-N	-2	3	348.424	3.158	10	0		EGAEHL
O=S(=O)([N-]c1cc([O-])cc(F)c1)c1c(Cl)ccc(F)c1F	ZINC000340742012	456661391	/nfs/dbraw/zinc/66/13/91/456661391.db2.gz	RDXHSMGTGHKPKO-UHFFFAOYSA-N	-2	3	337.706	3.264	10	0		EGAEHL
O=C(Nc1c([O-])cccc1Cl)c1nn(-c2cccc(F)c2)cc1[O-]	ZINC001159658662	1381861755	/nfs/dbraw/zinc/86/17/55/1381861755.db2.gz	WCEFWTYRIFNUPE-UHFFFAOYSA-N	-2	3	347.733	3.328	10	0		EGAEHL
CCCN(Cc1nc(=O)c2sccc2[n-]1)Cc1nc(C)ccc1[O-]	ZINC001319799124	1386301353	/nfs/dbraw/zinc/30/13/53/1386301353.db2.gz	RVILLBFUBWKNAY-UHFFFAOYSA-N	-2	3	344.440	3.218	10	0		EGAEHL
O=C(Nc1ccc(Br)c([O-])c1)c1ccc([O-])c(F)c1	ZINC001322513969	1387198898	/nfs/dbraw/zinc/19/88/98/1387198898.db2.gz	NVMWMTCITDQDKO-UHFFFAOYSA-N	-2	3	326.121	3.252	10	0		EGAEHL
O=C(NCc1ncccc1[O-])c1cc(Cl)c2ccccc2c1[O-]	ZINC000437005570	309785410	/nfs/dbraw/zinc/78/54/10/309785410.db2.gz	VZCBIZLBKNRDDO-UHFFFAOYSA-N	-2	3	328.755	3.229	10	0		EGAEHL
CSc1ccc([C@H](NCc2cccs2)P(=O)([O-])[O-])cc1	ZINC000012997496	453436569	/nfs/dbraw/zinc/43/65/69/453436569.db2.gz	XKWWFXBJGKMMSH-CYBMUJFWSA-N	-2	3	329.383	3.436	10	0		EGAEHL
Cc1cc(C)cc(-n2c(=O)c3[n-][n-]n(-c4cccc(C)c4C)c=3c2=O)c1	ZINC000096236018	454310718	/nfs/dbraw/zinc/31/07/18/454310718.db2.gz	VNQHIUTWJSFHMP-ROUUACIJSA-N	-2	3	348.406	3.418	10	0		EGAEHL
Cc1cc(C)cc(-n2c(=O)c3[n-][n-]n(-c4cccc(C)c4C)c=3c2=O)c1	ZINC000102818761	454521899	/nfs/dbraw/zinc/52/18/99/454521899.db2.gz	VNQHIUTWJSFHMP-QZTJIDSGSA-N	-2	3	348.406	3.418	10	0		EGAEHL
CC(C)[C@H]1CC[C@@H](C)C[C@@H]1[N-]S(=O)(=O)c1cc(C(=O)[O-])cs1	ZINC000315569893	456609024	/nfs/dbraw/zinc/60/90/24/456609024.db2.gz	ZMBZQXYXKBSCMR-RTXFEEFZSA-N	-2	3	345.486	3.185	10	0		EGAEHL
CCc1cc([N-]S(=O)(=O)c2ccc(OC)c(C(=O)[O-])c2)ccc1C	ZINC000326200936	456690455	/nfs/dbraw/zinc/69/04/55/456690455.db2.gz	CMBBZFBVDIBIQP-UHFFFAOYSA-N	-2	3	349.408	3.065	10	0		EGAEHL
CCOc1ccc(S(=O)(=O)[N-]c2cc(C(=O)[O-])c(C)cc2C)cc1	ZINC000547548709	458760191	/nfs/dbraw/zinc/76/01/91/458760191.db2.gz	OLQSAZZCQDFPFI-UHFFFAOYSA-N	-2	3	349.408	3.201	10	0		EGAEHL
O=C([O-])c1cnc(C=Cc2csc(-c3ccccc3)n2)[n-]c1=O	ZINC000670369959	548202309	/nfs/dbraw/zinc/20/23/09/548202309.db2.gz	NOPDOYWPMQFGPS-SREVYHEPSA-N	-2	3	325.349	3.174	10	0		EGAEHL
CCc1ccc(-n2c(=O)c3[n-][n-]n(-c4cccc(C)c4C)c=3c2=O)cc1	ZINC000102808036	219231789	/nfs/dbraw/zinc/23/17/89/219231789.db2.gz	CTMAQJSHTUDBKC-MSOLQXFVSA-N	-2	3	348.406	3.364	10	0		EGAEHL
CC(C)COc1ccc(S(=O)(=O)[N-]c2cc([O-])cc(F)c2)cc1	ZINC000348888425	156277041	/nfs/dbraw/zinc/27/70/41/156277041.db2.gz	QHPSPNZFLDDWEU-UHFFFAOYSA-N	-2	3	339.388	3.367	10	0		EGAEHL
O=C([O-])c1ccc(Cl)c([N-]S(=O)(=O)c2ccccc2Cl)c1	ZINC000013262839	453456415	/nfs/dbraw/zinc/45/64/15/453456415.db2.gz	SHNCAOKGZIWQMX-UHFFFAOYSA-N	-2	3	346.191	3.492	10	0		EGAEHL
CC(C)c1csc(C[N-]S(=O)(=O)c2cccc(Cl)c2[O-])n1	ZINC000632110291	460648424	/nfs/dbraw/zinc/64/84/24/460648424.db2.gz	SCVKKBSZSFIWJI-UHFFFAOYSA-N	-2	3	346.861	3.104	10	0		EGAEHL
O=S(=O)(Cc1cc(-c2ccc(F)cc2)no1)[N-]c1ccccc1[O-]	ZINC000342429652	457300099	/nfs/dbraw/zinc/30/00/99/457300099.db2.gz	BUWJUAXJMVKLGZ-UHFFFAOYSA-N	-2	3	348.355	3.128	10	0		EGAEHL
CCCc1cc(=O)[n-]c(SCc2noc(-c3ccccc3[O-])n2)n1	ZINC000373006865	458374561	/nfs/dbraw/zinc/37/45/61/458374561.db2.gz	SEDGMLZCWBTDGE-UHFFFAOYSA-N	-2	3	344.396	3.183	10	0		EGAEHL
Cc1ccc(-c2nnc(NC(=O)c3cc(F)c([O-])c(Cl)c3)[n-]2)o1	ZINC000436957601	458413859	/nfs/dbraw/zinc/41/38/59/458413859.db2.gz	YVQJUZHYHQVRHW-UHFFFAOYSA-N	-2	3	336.710	3.124	10	0		EGAEHL
Cc1ccc(-c2n[n-]c(NC(=O)c3cc(F)c([O-])c(Cl)c3)n2)o1	ZINC000436957601	458413864	/nfs/dbraw/zinc/41/38/64/458413864.db2.gz	YVQJUZHYHQVRHW-UHFFFAOYSA-N	-2	3	336.710	3.124	10	0		EGAEHL
Cc1ccc(-c2nc(NC(=O)c3cc(F)c([O-])c(Cl)c3)n[n-]2)o1	ZINC000436957601	458413867	/nfs/dbraw/zinc/41/38/67/458413867.db2.gz	YVQJUZHYHQVRHW-UHFFFAOYSA-N	-2	3	336.710	3.124	10	0		EGAEHL
COc1cc(/C=C/c2nc3ccc(C(=O)[O-])cc3o2)cc(OC)c1[O-]	ZINC000439276710	458683338	/nfs/dbraw/zinc/68/33/38/458683338.db2.gz	NJJOBYNTJHCGPI-ZZXKWVIFSA-N	-2	3	341.319	3.419	10	0		EGAEHL
Cc1cc(S(=O)(=O)[N-]c2cc([O-])cc(F)c2)ccc1OC(C)C	ZINC000131410757	307642820	/nfs/dbraw/zinc/64/28/20/307642820.db2.gz	QIMAFOPGHQQEFV-UHFFFAOYSA-N	-2	3	339.388	3.428	10	0		EGAEHL
CCC(CC)S(=O)(=O)[N-]c1cc(C(=O)[O-])ccc1OC(C)C	ZINC000547932014	314951658	/nfs/dbraw/zinc/95/16/58/314951658.db2.gz	SNYAEULAHKGPBX-UHFFFAOYSA-N	-2	3	329.418	3.102	10	0		EGAEHL
CCc1ccc(S(=O)(=O)[N-]c2c(Cl)cccc2C(=O)[O-])cc1	ZINC000013269591	323212534	/nfs/dbraw/zinc/21/25/34/323212534.db2.gz	VYFGITXYMZEBPC-UHFFFAOYSA-N	-2	3	339.800	3.401	10	0		EGAEHL
O=S(=O)([N-]c1cc([O-])cc(F)c1)c1ccc(C(F)(F)F)cc1	ZINC000161304108	455557634	/nfs/dbraw/zinc/55/76/34/455557634.db2.gz	RPMLTAKTYNJHDL-UHFFFAOYSA-N	-2	3	335.278	3.351	10	0		EGAEHL
CC(C)(C)c1nc(=NC(=O)c2cc([O-])cc(C(F)(F)F)c2)s[n-]1	ZINC000621852942	460084158	/nfs/dbraw/zinc/08/41/58/460084158.db2.gz	NGFVCXXZFYOFRK-UHFFFAOYSA-N	-2	3	345.346	3.234	10	0		EGAEHL
O=C(Cc1ccc(Br)cc1[O-])Nc1c([O-])cccc1F	ZINC000682030747	550063755	/nfs/dbraw/zinc/06/37/55/550063755.db2.gz	WYMDWCKPIULOSC-UHFFFAOYSA-N	-2	3	340.148	3.181	10	0		EGAEHL
O=C(NCCc1c(F)cc([O-])cc1F)c1c([O-])cccc1Cl	ZINC001156716786	1380615891	/nfs/dbraw/zinc/61/58/91/1380615891.db2.gz	XWAOTIOAANDIDG-UHFFFAOYSA-N	-2	3	327.714	3.002	10	0		EGAEHL
CCc1ccc(-n2c(=O)c3[n-][n-]n(-c4ccccc4CC)c=3c2=O)cc1	ZINC000033114645	453906625	/nfs/dbraw/zinc/90/66/25/453906625.db2.gz	FASYBRXSAPMCNN-QZTJIDSGSA-N	-2	3	348.406	3.309	10	0		EGAEHL
Cc1ccc(-c2nc([N-]C(=O)c3csc(C(F)(F)F)n3)n[n-]2)o1	ZINC000354910897	457327542	/nfs/dbraw/zinc/32/75/42/457327542.db2.gz	PGLZYAHAOMJTIC-UHFFFAOYSA-N	-2	3	343.290	3.101	10	0		EGAEHL
COc1cc(C)c([N-]S(=O)(=O)c2ccc(C)c(C)c2)c(C(=O)[O-])c1	ZINC000548262522	458856144	/nfs/dbraw/zinc/85/61/44/458856144.db2.gz	NIHFQRIEAYAQJO-UHFFFAOYSA-N	-2	3	349.408	3.119	10	0		EGAEHL
O=C(Nc1c([O-])cccc1F)c1ccc(Br)c([O-])c1	ZINC000676839674	549165450	/nfs/dbraw/zinc/16/54/50/549165450.db2.gz	PAZZMMHFTZDGAB-UHFFFAOYSA-N	-2	3	326.121	3.252	10	0		EGAEHL
O=C(Nc1cc(Br)ccc1[O-])c1cc(F)cc(F)c1[O-]	ZINC001153472568	1380082342	/nfs/dbraw/zinc/08/23/42/1380082342.db2.gz	IAXAXLAXWKGHER-UHFFFAOYSA-N	-2	3	344.111	3.391	10	0		EGAEHL
O=C([O-])c1cc(Br)ccc1NC(=O)c1cccc([O-])c1	ZINC000050200679	214049976	/nfs/dbraw/zinc/04/99/76/214049976.db2.gz	NTURBAOVFJKLGD-UHFFFAOYSA-N	-2	3	336.141	3.105	10	0		EGAEHL
COc1ccc(C=Cc2nc(C)c(CCC(=O)[O-])c(=O)[n-]2)cc1Cl	ZINC000443458750	309901560	/nfs/dbraw/zinc/90/15/60/309901560.db2.gz	ZFPUMCGRVTVLNA-DAXSKMNVSA-N	-2	3	348.786	3.340	10	0		EGAEHL
Cc1ccc(C)c(S(=O)(=O)[N-]c2c(Cl)cccc2C(=O)[O-])c1	ZINC000013269544	323212524	/nfs/dbraw/zinc/21/25/24/323212524.db2.gz	ANUCDJMDRIZYSU-UHFFFAOYSA-N	-2	3	339.800	3.456	10	0		EGAEHL
CCc1ccc(-n2c(=O)c3[n-][n-]n(-c4cccc(C)c4)c=3c2=O)cc1	ZINC000033114644	453906332	/nfs/dbraw/zinc/90/63/32/453906332.db2.gz	YGXAUUVWWLZQNV-IAGOWNOFSA-N	-2	3	334.379	3.055	10	0		EGAEHL
COCc1cc(Cl)cc(S(=O)(=O)[N-]c2cc([O-])cc(F)c2)c1	ZINC000357150004	457346528	/nfs/dbraw/zinc/34/65/28/457346528.db2.gz	PPBFFWYTVJRLAV-UHFFFAOYSA-N	-2	3	345.779	3.132	10	0		EGAEHL
Cc1nc(C=Cc2cc(F)c(F)c(F)c2)[n-]c(=O)c1CCC(=O)[O-]	ZINC000443437109	457765485	/nfs/dbraw/zinc/76/54/85/457765485.db2.gz	ATRXWCCLJBWQSG-RQOWECAXSA-N	-2	3	338.285	3.096	10	0		EGAEHL
COC(=O)c1cc(C(=O)Nc2cc(Cl)cc(Cl)c2[O-])c[n-]1	ZINC000344704776	144211863	/nfs/dbraw/zinc/21/18/63/144211863.db2.gz	OSIIVWVCLSZDSD-UHFFFAOYSA-N	-2	3	329.139	3.066	10	0		EGAEHL
Cc1ccccc1S(=O)(=O)[N-]c1cc(C(=O)[O-])ccc1Cl	ZINC000088715197	307447245	/nfs/dbraw/zinc/44/72/45/307447245.db2.gz	FWVSHHMOESZHDF-UHFFFAOYSA-N	-2	3	325.773	3.147	10	0		EGAEHL
Cc1cccc(-n2[n-][n-]c3c(=O)n(-c4cccc(Cl)c4)c(=O)c2=3)c1	ZINC000096500380	454372063	/nfs/dbraw/zinc/37/20/63/454372063.db2.gz	YAUHXDHBZCCXSG-CABCVRRESA-N	-2	3	340.770	3.146	10	0		EGAEHL
Cc1nc(C=Cc2cccc(OC(C)C)c2)[n-]c(=O)c1CCC(=O)[O-]	ZINC000347426726	457421157	/nfs/dbraw/zinc/42/11/57/457421157.db2.gz	ZLTMCXSWPHBACW-CLFYSBASSA-N	-2	3	342.395	3.465	10	0		EGAEHL
O=C(Nc1ccc(Br)cc1[O-])c1c([O-])cc(F)cc1F	ZINC000620969159	460844308	/nfs/dbraw/zinc/84/43/08/460844308.db2.gz	PFNLINSUZNWPKI-UHFFFAOYSA-N	-2	3	344.111	3.391	10	0		EGAEHL
Cc1ccc(-n2c(=O)c3[n-][n-]n(-c4ccc(Cl)cc4)c=3c2=O)cc1	ZINC000102807265	219232016	/nfs/dbraw/zinc/23/20/16/219232016.db2.gz	MCJTZABAWZRXBX-LSDHHAIUSA-N	-2	3	340.770	3.146	10	0		EGAEHL
CCc1ccc(-n2c(=O)c3[n-][n-]n(-c4cccc(C)c4)c=3c2=O)cc1	ZINC000102808245	219231691	/nfs/dbraw/zinc/23/16/91/219231691.db2.gz	YGXAUUVWWLZQNV-IRXDYDNUSA-N	-2	3	334.379	3.055	10	0		EGAEHL
Cc1cc(C)cc(-n2[n-][n-]c3c(=O)n(-c4cc(C)cc(C)c4)c(=O)c2=3)c1	ZINC000096236016	301225885	/nfs/dbraw/zinc/22/58/85/301225885.db2.gz	RFPFXJQFWNTLPO-QZTJIDSGSA-N	-2	3	348.406	3.418	10	0		EGAEHL
COc1cc(C(=O)N2CCCc3cccc([O-])c32)cc(Cl)c1[O-]	ZINC000135222843	307699688	/nfs/dbraw/zinc/69/96/88/307699688.db2.gz	RDHCBZWSGCPNMU-UHFFFAOYSA-N	-2	3	333.771	3.353	10	0		EGAEHL
Cc1nc(C=Cc2cc(F)c(F)cc2F)[n-]c(=O)c1CCC(=O)[O-]	ZINC000443453565	309901388	/nfs/dbraw/zinc/90/13/88/309901388.db2.gz	KXGONTGSMOQMBW-RQOWECAXSA-N	-2	3	338.285	3.096	10	0		EGAEHL
CCc1ccc(CS(=O)(=O)[N-]c2cc(C(=O)[O-])ccc2F)cc1	ZINC000548527705	315022606	/nfs/dbraw/zinc/02/26/06/315022606.db2.gz	XWFWAPNXBDXWBO-UHFFFAOYSA-N	-2	3	337.372	3.028	10	0		EGAEHL
CC(C)(C)CCCS(=O)(=O)[N-]c1cc(F)cc(C(=O)[O-])c1F	ZINC000568400898	316770623	/nfs/dbraw/zinc/77/06/23/316770623.db2.gz	SWHIBCVGIJSUAE-UHFFFAOYSA-N	-2	3	335.372	3.231	10	0		EGAEHL
CSc1ccc([C@@H](NCc2cccs2)P(=O)([O-])[O-])cc1	ZINC000012997494	453436824	/nfs/dbraw/zinc/43/68/24/453436824.db2.gz	XKWWFXBJGKMMSH-ZDUSSCGKSA-N	-2	3	329.383	3.436	10	0		EGAEHL
Cc1cc(Cl)cc(NC(=O)c2cc(=O)c3ccccc3[n-]2)c1[O-]	ZINC000340326467	456388170	/nfs/dbraw/zinc/38/81/70/456388170.db2.gz	JOIIAVDPCNMXPA-UHFFFAOYSA-N	-2	3	328.755	3.448	10	0		EGAEHL
CC(=O)Nc1ccc([O-])c(C(=O)Nc2cc(F)cc(Cl)c2[O-])c1	ZINC000353886287	456950769	/nfs/dbraw/zinc/95/07/69/456950769.db2.gz	FKRZVHGVEKTYLO-UHFFFAOYSA-N	-2	3	338.722	3.101	10	0		EGAEHL
CC[C@@H](CCC(=O)[O-])[N-]S(=O)(=O)c1cc2cccc(C)c2s1	ZINC000650421143	461758187	/nfs/dbraw/zinc/75/81/87/461758187.db2.gz	JSVJLWPGGJNBIS-LBPRGKRZSA-N	-2	3	341.454	3.131	10	0		EGAEHL
CC(C)(C)c1n[n-]c(CN=c2[n-]nc(-c3ccccc3Cl)s2)n1	ZINC000516913698	312350034	/nfs/dbraw/zinc/35/00/34/312350034.db2.gz	BPPNAKSYEGUDHP-UHFFFAOYSA-N	-2	3	348.863	3.308	10	0		EGAEHL
CC(C)Oc1ccc(S(=O)(=O)[N-]c2cc([O-])cc(F)c2)cc1	ZINC000091019136	454362741	/nfs/dbraw/zinc/36/27/41/454362741.db2.gz	BAYGDPNWTHFERW-UHFFFAOYSA-N	-2	3	325.361	3.119	10	0		EGAEHL
O=C([O-])c1cc([N-]S(=O)(=O)c2ccccc2Cl)c(F)cc1F	ZINC000047383480	454366129	/nfs/dbraw/zinc/36/61/29/454366129.db2.gz	VIKLMGAWRMTLAG-UHFFFAOYSA-N	-2	3	347.726	3.117	10	0		EGAEHL
CC(=O)c1ccc([O-])c(NC(=O)c2ccc3c(c2[O-])OC(C)(C)C3)c1	ZINC000436682354	458359870	/nfs/dbraw/zinc/35/98/70/458359870.db2.gz	VGCHSADXWOOYCP-UHFFFAOYSA-N	-2	3	341.363	3.266	10	0		EGAEHL
CCc1ccc(CS(=O)(=O)[N-]c2cccc(F)c2C(=O)[O-])cc1	ZINC000548193463	458854420	/nfs/dbraw/zinc/85/44/20/458854420.db2.gz	BNBOJKBLTBBTAH-UHFFFAOYSA-N	-2	3	337.372	3.028	10	0		EGAEHL
Cc1c(S(=O)(=O)[N-]c2cccc([O-])c2F)c2ccccc2n1C	ZINC000556346462	458952683	/nfs/dbraw/zinc/95/26/83/458952683.db2.gz	LDDUTLRWVPMARC-UHFFFAOYSA-N	-2	3	334.372	3.132	10	0		EGAEHL
CC(C)(C)CN(CC(=O)[O-])Cc1nc2c3ccccc3oc2c(=O)[n-]1	ZINC000662224940	461126970	/nfs/dbraw/zinc/12/69/70/461126970.db2.gz	FWIZHKLQUUYPAD-UHFFFAOYSA-N	-2	3	343.383	3.014	10	0		EGAEHL
CCc1ccc(-n2c(=O)c3[n-][n-]n(-c4ccccc4CC)c=3c2=O)cc1	ZINC000102818086	219232626	/nfs/dbraw/zinc/23/26/26/219232626.db2.gz	FASYBRXSAPMCNN-ROUUACIJSA-N	-2	3	348.406	3.309	10	0		EGAEHL
Cc1cc(C)cc(-n2[n-][n-]c3c(=O)n(-c4cc(C)cc(C)c4)c(=O)c2=3)c1	ZINC000033114707	301225465	/nfs/dbraw/zinc/22/54/65/301225465.db2.gz	RFPFXJQFWNTLPO-MSOLQXFVSA-N	-2	3	348.406	3.418	10	0		EGAEHL
Cc1nc(C=Cc2ccc(Cl)cc2F)[n-]c(=O)c1CCC(=O)[O-]	ZINC000443448195	309901335	/nfs/dbraw/zinc/90/13/35/309901335.db2.gz	YAYOIWTWJLMQQM-UTCJRWHESA-N	-2	3	336.750	3.471	10	0		EGAEHL
Cc1ccc([N-]S(=O)(=O)c2cccc(Cl)c2[O-])c(C)c1O	ZINC000550111212	315116963	/nfs/dbraw/zinc/11/69/63/315116963.db2.gz	FHQOHWISDCUPEV-UHFFFAOYSA-N	-2	3	327.789	3.169	10	0		EGAEHL
Cc1cccc2cc(S(=O)(=O)[N-][C@H](C)CCCC(=O)[O-])sc21	ZINC000650413066	461755390	/nfs/dbraw/zinc/75/53/90/461755390.db2.gz	DGZMNKMKWJVPOB-LLVKDONJSA-N	-2	3	341.454	3.131	10	0		EGAEHL
Cc1cccc(F)c1S(=O)(=O)[N-]c1ccc(C(=O)[O-])cc1Cl	ZINC000548547573	315022984	/nfs/dbraw/zinc/02/29/84/315022984.db2.gz	KAYVCEQVDMQYJL-UHFFFAOYSA-N	-2	3	343.763	3.287	10	0		EGAEHL
Cc1ccccc1-n1[n-][n-]c2c(=O)n(-c3cccc(Cl)c3)c(=O)c1=2	ZINC000096500386	454371639	/nfs/dbraw/zinc/37/16/39/454371639.db2.gz	KWCWRVWFEKPYIH-CABCVRRESA-N	-2	3	340.770	3.146	10	0		EGAEHL
CCCc1n[n-]c(=NC(=O)c2cc3cc(Cl)sc3[n-]2)s1	ZINC000643958290	461845580	/nfs/dbraw/zinc/84/55/80/461845580.db2.gz	OUBKLIBDNKENPE-UHFFFAOYSA-N	-2	3	326.834	3.361	10	0		EGAEHL
Cc1cccc2cc(S(=O)(=O)[N-]C(C)(C)CCC(=O)[O-])sc21	ZINC000646009949	462494262	/nfs/dbraw/zinc/49/42/62/462494262.db2.gz	GBYUOXYKVKOFBD-UHFFFAOYSA-N	-2	3	341.454	3.131	10	0		EGAEHL
Cc1nc(C=Cc2cccc(Cl)c2F)[n-]c(=O)c1CCC(=O)[O-]	ZINC000195503519	266184333	/nfs/dbraw/zinc/18/43/33/266184333.db2.gz	NLSMGWAOOXAFIN-FNORWQNLSA-N	-2	3	336.750	3.058	10	0		EGAEHL
CC1(C)Cc2cccc(S(=O)(=O)[N-]c3cc([O-])cc(F)c3)c2O1	ZINC000195504993	266184646	/nfs/dbraw/zinc/18/46/46/266184646.db2.gz	SFLKQFGKOWVHEY-UHFFFAOYSA-N	-2	3	337.372	3.046	10	0		EGAEHL
CCCc1nc(=NC(=O)CCc2ccc3ccccc3c2[O-])s[n-]1	ZINC000448875472	310021890	/nfs/dbraw/zinc/02/18/90/310021890.db2.gz	RZZNPPPXWFWUPD-UHFFFAOYSA-N	-2	3	341.436	3.343	10	0		EGAEHL
Cc1cc(S(=O)(=O)[N-]c2ccc(C(=O)[O-])cc2Cl)c(C)o1	ZINC000547573205	314916352	/nfs/dbraw/zinc/91/63/52/314916352.db2.gz	YVOYRKPTSFXYQA-UHFFFAOYSA-N	-2	3	329.761	3.049	10	0		EGAEHL
Cc1cc(F)cc(S(=O)(=O)[N-]c2c(Cl)cccc2C(=O)[O-])c1	ZINC000548524182	315022055	/nfs/dbraw/zinc/02/20/55/315022055.db2.gz	KBNIHAXXLGWYIN-UHFFFAOYSA-N	-2	3	343.763	3.287	10	0		EGAEHL
O=C([O-])c1c(Cl)cccc1[N-]S(=O)(=O)CCc1cccs1	ZINC000555128094	315367828	/nfs/dbraw/zinc/36/78/28/315367828.db2.gz	AWQQUQGTVFCPFX-UHFFFAOYSA-N	-2	3	345.829	3.084	10	0		EGAEHL
[O-]c1cccnc1CN=c1[n-]c(-c2cc(Cl)cc(Cl)c2)no1	ZINC000581569895	325372245	/nfs/dbraw/zinc/37/22/45/325372245.db2.gz	WPYFZNBXUJXFHL-UHFFFAOYSA-N	-2	3	337.166	3.178	10	0		EGAEHL
Cc1ccc(S(=O)(=O)[N-]c2c(Cl)cccc2C(=O)[O-])cc1F	ZINC000318661095	456619727	/nfs/dbraw/zinc/61/97/27/456619727.db2.gz	HVTBLMWEPPIKFT-UHFFFAOYSA-N	-2	3	343.763	3.287	10	0		EGAEHL
O=C(NCc1ncccc1[O-])c1cc(Oc2ccccc2)ccc1[O-]	ZINC000437000530	458421102	/nfs/dbraw/zinc/42/11/02/458421102.db2.gz	MQHBHAOMABQSEL-UHFFFAOYSA-N	-2	3	336.347	3.215	10	0		EGAEHL
CCCOc1cccc(C=Cc2nc(C)c(CCC(=O)[O-])c(=O)[n-]2)c1	ZINC000443449407	309901382	/nfs/dbraw/zinc/90/13/82/309901382.db2.gz	ANIMBGMMVSSTJS-CLFYSBASSA-N	-2	3	342.395	3.467	10	0		EGAEHL
Cc1cc(S(=O)(=O)[N-]c2cc([O-])cc(F)c2)c(Cl)cc1F	ZINC000131419887	454253241	/nfs/dbraw/zinc/25/32/41/454253241.db2.gz	BSAMDLLYAZQKDA-UHFFFAOYSA-N	-2	3	333.743	3.433	10	0		EGAEHL
CCO[C@H](CS(=O)(=O)[N-]c1ccc(C(C)(C)C)cc1[O-])C1CC1	ZINC000629299261	460716648	/nfs/dbraw/zinc/71/66/48/460716648.db2.gz	PDNCMQHGEANKEZ-MRXNPFEDSA-N	-2	3	341.473	3.247	10	0		EGAEHL
Cc1ccc(F)cc1S(=O)(=O)[N-]c1ccc(C(=O)[O-])cc1Cl	ZINC000316020734	456611793	/nfs/dbraw/zinc/61/17/93/456611793.db2.gz	SUSILHCDPQVQNE-UHFFFAOYSA-N	-2	3	343.763	3.287	10	0		EGAEHL
O=S(=O)([N-]c1cccc(-c2cc[nH]n2)c1)c1cccc(Cl)c1[O-]	ZINC000339199838	456987890	/nfs/dbraw/zinc/98/78/90/456987890.db2.gz	CVPMDDLEPTVEML-UHFFFAOYSA-N	-2	3	349.799	3.237	10	0		EGAEHL
O=C(Nc1ccc(Br)c([O-])c1)c1ccc(F)cc1[O-]	ZINC001328619697	1388790731	/nfs/dbraw/zinc/79/07/31/1388790731.db2.gz	VKCJYIRQYLHQMX-UHFFFAOYSA-N	-2	3	326.121	3.252	10	0		EGAEHL
O=C([O-])c1cccc(Cl)c1[N-]S(=O)(=O)Cc1ccccc1F	ZINC000396553902	324293956	/nfs/dbraw/zinc/29/39/56/324293956.db2.gz	SYVABLNDGOBTCS-UHFFFAOYSA-N	-2	3	343.763	3.119	10	0		EGAEHL
CCOc1ccc([C@H](NCc2ccccc2C)P(=O)([O-])[O-])cc1	ZINC000012997509	453435948	/nfs/dbraw/zinc/43/59/48/453435948.db2.gz	GIJAOAHCAKVYGK-QGZVFWFLSA-N	-2	3	335.340	3.360	10	0		EGAEHL
CCN(CC)c1ccc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2)cc1	ZINC000007053510	1291057656	/nfs/dbraw/zinc/05/76/56/1291057656.db2.gz	QWQCHPUAPNUHAZ-UHFFFAOYSA-N	-2	3	348.424	3.032	10	0		EGAEHL
O=C([O-])c1cc(C(=O)[O-])cc(-c2cc([O-])cc(C(F)(F)F)c2)c1	ZINC000065344399	304223708	/nfs/dbraw/zinc/22/37/08/304223708.db2.gz	RIDNEJJQTMMYQG-UHFFFAOYSA-N	-3	3	326.226	3.474	10	0		EGAEHL
CC(C)c1csc2[n-]c(COc3ccccc3C(=O)[O-])nc(=O)c12	ZINC000112206896	280657820	/nfs/dbraw/zinc/65/78/20/280657820.db2.gz	MFZZTKWHGOTDPG-UHFFFAOYSA-N	-2	3	344.392	3.385	10	0		EGAEHL
Cc1ccnc2c1cccc2S(=O)(=O)[N-]c1cc([O-])cc(F)c1	ZINC000547955040	314954208	/nfs/dbraw/zinc/95/42/08/314954208.db2.gz	HUZYMVSALLDQRF-UHFFFAOYSA-N	-2	3	332.356	3.189	10	0		EGAEHL
O=P([O-])([O-])[C@@H](NCCc1cccc(F)c1)c1cccc(Cl)c1	ZINC000012997447	453436625	/nfs/dbraw/zinc/43/66/25/453436625.db2.gz	VFMLBPCHPCEBIO-OAHLLOKOSA-N	-2	3	343.722	3.488	10	0		EGAEHL
Cc1cc(C)c(C(=O)[O-])cc1[N-]S(=O)(=O)c1ccc2c(c1)CCC2	ZINC000548205193	458854299	/nfs/dbraw/zinc/85/42/99/458854299.db2.gz	KHYLDJJGYGFODJ-UHFFFAOYSA-N	-2	3	345.420	3.291	10	0		EGAEHL
COc1cc(C)c([N-]S(=O)(=O)c2cc(C)ccc2C)c(C(=O)[O-])c1	ZINC000548232902	458855323	/nfs/dbraw/zinc/85/53/23/458855323.db2.gz	ZLUMGLDFTUASAB-UHFFFAOYSA-N	-2	3	349.408	3.119	10	0		EGAEHL
Cc1ccccc1S(=O)(=O)[N-]c1ccc(Br)c([O-])c1	ZINC001344595630	1390802101	/nfs/dbraw/zinc/80/21/01/1390802101.db2.gz	SHYUSASZNYZGPD-UHFFFAOYSA-N	-2	3	342.214	3.264	10	0		EGAEHL
Cc1ccc(C)c(S(=O)(=O)[N-]c2cc(C(=O)[O-])ccc2Cl)c1	ZINC000013340916	275120869	/nfs/dbraw/zinc/12/08/69/275120869.db2.gz	FUXAKPUDUCQTKQ-UHFFFAOYSA-N	-2	3	339.800	3.456	10	0		EGAEHL
O=C(Cc1ccc(Br)cc1[O-])Nc1ccc(F)cc1[O-]	ZINC000490649343	311147562	/nfs/dbraw/zinc/14/75/62/311147562.db2.gz	OFQISAQBWXLUDY-UHFFFAOYSA-N	-2	3	340.148	3.181	10	0		EGAEHL
COc1ccc(S(=O)(=O)[N-]c2cc([O-])cc(F)c2)c2ccccc12	ZINC000131389431	454250426	/nfs/dbraw/zinc/25/04/26/454250426.db2.gz	CBLPPMIRDSVGQU-UHFFFAOYSA-N	-2	3	347.367	3.494	10	0		EGAEHL
O=S(=O)([N-]c1cc([O-])cc(F)c1)c1cccc(C(F)(F)F)c1	ZINC000161306343	455557375	/nfs/dbraw/zinc/55/73/75/455557375.db2.gz	FKGSMZZUTAAMPX-UHFFFAOYSA-N	-2	3	335.278	3.351	10	0		EGAEHL
COC(C)(C)CS(=O)(=O)[N-]c1cc(Cc2ccccc2)ccc1[O-]	ZINC000436475167	458309022	/nfs/dbraw/zinc/30/90/22/458309022.db2.gz	GAXYKDMTOXQDGX-UHFFFAOYSA-N	-2	3	349.452	3.150	10	0		EGAEHL
Cc1cc(C)cc(-c2cc(=NC(=O)c3c(F)ccc([O-])c3F)[nH][n-]2)c1	ZINC000577661300	459069825	/nfs/dbraw/zinc/06/98/25/459069825.db2.gz	DJELLLKCQHALCG-UHFFFAOYSA-N	-2	3	343.333	3.352	10	0		EGAEHL
O=c1[n-]c(-c2cccc(OCC(F)(F)F)n2)nc2ccc([O-])cc12	ZINC000436923356	547904789	/nfs/dbraw/zinc/90/47/89/547904789.db2.gz	BXQTYNVZVPNHRH-UHFFFAOYSA-N	-2	3	337.257	3.044	10	0		EGAEHL
CCc1ccc(-n2c(=O)c3[n-][n-]n(-c4cccc(C)c4C)c=3c2=O)cc1	ZINC000102808039	219232328	/nfs/dbraw/zinc/23/23/28/219232328.db2.gz	CTMAQJSHTUDBKC-ZWKOTPCHSA-N	-2	3	348.406	3.364	10	0		EGAEHL
O=C([O-])c1ccc(NC(=O)c2csc(Br)c2)c([O-])c1	ZINC000037588000	213160524	/nfs/dbraw/zinc/16/05/24/213160524.db2.gz	IWOSQZYJISGFEH-UHFFFAOYSA-N	-2	3	342.170	3.167	10	0		EGAEHL
Cc1c(Cl)cccc1NC(=O)c1c([O-])[n-]c2ccccc2c1=O	ZINC000035508411	213034233	/nfs/dbraw/zinc/03/42/33/213034233.db2.gz	PPEPWZWPQYNJPZ-UHFFFAOYSA-N	-2	3	328.755	3.448	10	0		EGAEHL
O=C([O-])c1cc(F)cc([N-]S(=O)(=O)c2cccc(Cl)c2)c1F	ZINC000548591215	315024107	/nfs/dbraw/zinc/02/41/07/315024107.db2.gz	CYRGKXGKVWLTFG-UHFFFAOYSA-N	-2	3	347.726	3.117	10	0		EGAEHL
CSc1cc(C(=O)[O-])ccc1[N-]S(=O)(=O)Cc1ccccc1	ZINC000013279319	323212423	/nfs/dbraw/zinc/21/24/23/323212423.db2.gz	SGGFUBOPCREWOU-UHFFFAOYSA-N	-2	3	337.422	3.049	10	0		EGAEHL
O=C([O-])c1ccc([N-]S(=O)(=O)c2cc(F)cc(F)c2)c(Cl)c1	ZINC000387088658	324270079	/nfs/dbraw/zinc/27/00/79/324270079.db2.gz	RDUJXSNOTRKXOC-UHFFFAOYSA-N	-2	3	347.726	3.117	10	0		EGAEHL
Cc1c(S(=O)(=O)[N-]c2cc([O-])cc(F)c2)c2ccccc2n1C	ZINC000340743154	456662843	/nfs/dbraw/zinc/66/28/43/456662843.db2.gz	TUYMSMMOOZBOHF-UHFFFAOYSA-N	-2	3	334.372	3.132	10	0		EGAEHL
Cc1nc(C=Cc2cnc(C(C)(C)C)s2)[n-]c(=O)c1CCC(=O)[O-]	ZINC000578287844	459173968	/nfs/dbraw/zinc/17/39/68/459173968.db2.gz	HSOSEHXXHFXMLZ-ALCCZGGFSA-N	-2	3	347.440	3.432	10	0		EGAEHL
CSc1[n-]c2ccccc2c(=O)c1C(=O)Nc1ccccc1[O-]	ZINC000020849508	546521620	/nfs/dbraw/zinc/52/16/20/546521620.db2.gz	KXWRIEZMJDVRII-UHFFFAOYSA-N	-2	3	326.377	3.208	10	0		EGAEHL
O=C(Nc1ccc(OC(F)(F)F)cc1[O-])c1ccc([O-])c(F)c1	ZINC000682388836	550092899	/nfs/dbraw/zinc/09/28/99/550092899.db2.gz	CFIXTEFOKQJUDH-UHFFFAOYSA-N	-2	3	331.221	3.388	10	0		EGAEHL
O=C(Nc1cc(F)c([O-])cc1Cl)c1n[n-]c2ccccc2c1=O	ZINC001179660619	1386542978	/nfs/dbraw/zinc/54/29/78/1386542978.db2.gz	ZIODWEZWWNXUCO-UHFFFAOYSA-N	-2	3	333.706	3.086	10	0		EGAEHL
CC(C)(C)c1ccc([N-]S(=O)(=O)C[C@H]2CCCCO2)c([O-])c1	ZINC000443525846	309902610	/nfs/dbraw/zinc/90/26/10/309902610.db2.gz	BEUKYHWOHGMQFB-CYBMUJFWSA-N	-2	3	327.446	3.001	10	0		EGAEHL
CSc1ccc(C=Cc2nc(C)c(CCC(=O)[O-])c(=O)[n-]2)cc1	ZINC000347390889	323953166	/nfs/dbraw/zinc/95/31/66/323953166.db2.gz	MLWUGRXPQCZJIR-UITAMQMPSA-N	-2	3	330.409	3.400	10	0		EGAEHL
CCc1ccc(-n2c(=O)c3[n-][n-]n(-c4cc(C)ccc4C)c=3c2=O)cc1	ZINC000102808032	454521972	/nfs/dbraw/zinc/52/19/72/454521972.db2.gz	YHPLCEPSQXQMCO-MSOLQXFVSA-N	-2	3	348.406	3.364	10	0		EGAEHL
CCc1cc([N-]S(=O)(=O)c2cccc(C(=O)[O-])c2C)ccc1C	ZINC000324246611	456662856	/nfs/dbraw/zinc/66/28/56/456662856.db2.gz	HMSLOBCNRNZSKB-UHFFFAOYSA-N	-2	3	333.409	3.365	10	0		EGAEHL
COc1ccc(C(=O)Nc2ccc(OC(F)(F)F)cc2[O-])c([O-])c1	ZINC000443567642	457781666	/nfs/dbraw/zinc/78/16/66/457781666.db2.gz	PPFNXPJMABCESP-UHFFFAOYSA-N	-2	3	343.257	3.257	10	0		EGAEHL
Cc1cc(=O)[n-]c(-c2ccc(NC(=O)c3ccc(C)c(C)c3[O-])cc2)n1	ZINC000436556248	458331858	/nfs/dbraw/zinc/33/18/58/458331858.db2.gz	RIGKAWFMDYMKNK-UHFFFAOYSA-N	-2	3	349.390	3.320	10	0		EGAEHL
O=C([O-])c1ccc([O-])c(S(=O)(=O)[N-]c2csc3ccccc23)c1	ZINC000436901326	458402886	/nfs/dbraw/zinc/40/28/86/458402886.db2.gz	LXVIEQCOYCAUIT-UHFFFAOYSA-N	-3	3	349.389	3.106	10	0		EGAEHL
O=C([O-])c1c(Cl)cccc1[N-]S(=O)(=O)Cc1cccc(F)c1	ZINC000547865808	458808634	/nfs/dbraw/zinc/80/86/34/458808634.db2.gz	DDPWORMJGUTVCZ-UHFFFAOYSA-N	-2	3	343.763	3.119	10	0		EGAEHL
CCc1ccccc1-n1cc([O-])c(C(=O)Nc2c([O-])cccc2F)n1	ZINC000084403716	546621004	/nfs/dbraw/zinc/62/10/04/546621004.db2.gz	ULQHJPONHAXLNX-UHFFFAOYSA-N	-2	3	341.342	3.237	10	0		EGAEHL
CCCOc1ccc(S(=O)(=O)[N-]c2cc([O-])cc(F)c2)cc1	ZINC000348884712	156273886	/nfs/dbraw/zinc/27/38/86/156273886.db2.gz	PRDZJMJLFOJJTG-UHFFFAOYSA-N	-2	3	325.361	3.121	10	0		EGAEHL
CC1(c2nc(=NC(=O)c3cc4cc(Cl)sc4[n-]3)s[n-]2)CC1	ZINC000529696720	313388658	/nfs/dbraw/zinc/38/86/58/313388658.db2.gz	LATADDAWUCOOPD-UHFFFAOYSA-N	-2	3	338.845	3.460	10	0		EGAEHL
O=C([O-])c1cccc(Cl)c1[N-]S(=O)(=O)c1ccc(F)cc1F	ZINC000013269525	323212469	/nfs/dbraw/zinc/21/24/69/323212469.db2.gz	OCIFHKKAPZAYBS-UHFFFAOYSA-N	-2	3	347.726	3.117	10	0		EGAEHL
COc1cc(Br)c([O-])c(C=C2SC(=S)[N-]C2=O)c1	ZINC000000975112	452638786	/nfs/dbraw/zinc/63/87/86/452638786.db2.gz	NEHKSLXTGXFCJD-FPYGCLRLSA-N	-2	3	346.227	3.492	10	0		EGAEHL
Cc1cc(S(=O)(=O)[N-]c2c(F)ccc(C)c2C(=O)[O-])c(C)s1	ZINC000090164058	454287483	/nfs/dbraw/zinc/28/74/83/454287483.db2.gz	VYTJGJNRKLXJDW-UHFFFAOYSA-N	-2	3	343.401	3.311	10	0		EGAEHL
O=S(=O)([N-]c1cc([O-])cc(F)c1)c1ccccc1Br	ZINC000161300894	455557409	/nfs/dbraw/zinc/55/74/09/455557409.db2.gz	UZYVPQJPKSRNPB-UHFFFAOYSA-N	-2	3	346.177	3.095	10	0		EGAEHL
CC(C)Oc1ccc(C(=O)[O-])cc1[N-]S(=O)(=O)C1(C(C)C)CC1	ZINC000629296154	460716923	/nfs/dbraw/zinc/71/69/23/460716923.db2.gz	WBJGSPHGFCCMLL-UHFFFAOYSA-N	-2	3	341.429	3.102	10	0		EGAEHL
CCc1cc([N-]S(=O)(=O)c2ccc(C)c(C(=O)[O-])c2)ccc1C	ZINC000391913928	457453901	/nfs/dbraw/zinc/45/39/01/457453901.db2.gz	MNCMRIZYSBDQLQ-UHFFFAOYSA-N	-2	3	333.409	3.365	10	0		EGAEHL
CCc1cccc(S(=O)(=O)[N-]c2c(C)cc(OC)cc2C(=O)[O-])c1	ZINC000547615056	458761757	/nfs/dbraw/zinc/76/17/57/458761757.db2.gz	MZOINWAATKZEDR-UHFFFAOYSA-N	-2	3	349.408	3.065	10	0		EGAEHL
O=S(=O)([N-]c1cc([O-])cc(F)c1)c1ccc(C(F)(F)F)s1	ZINC000359583029	167200894	/nfs/dbraw/zinc/20/08/94/167200894.db2.gz	COLSGTNSNDCYAJ-UHFFFAOYSA-N	-2	3	341.307	3.412	10	0		EGAEHL
Cc1nc(C=Cc2ccc(Cl)c(F)c2)[n-]c(=O)c1CCC(=O)[O-]	ZINC000195503744	266185176	/nfs/dbraw/zinc/18/51/76/266185176.db2.gz	VBXYLRSDWYYWHR-ZZXKWVIFSA-N	-2	3	336.750	3.058	10	0		EGAEHL
O=S(=O)([N-]c1cc([O-])cc(F)c1)c1cccc2c1N=S=N2	ZINC000131410294	307642944	/nfs/dbraw/zinc/64/29/44/307642944.db2.gz	XOXMNUDJQPHTMT-UHFFFAOYSA-N	-2	3	325.346	3.059	10	0		EGAEHL
COc1cc(C)c([N-]S(=O)(=O)c2ccc(C)cc2C)c(C(=O)[O-])c1	ZINC000547904854	314951121	/nfs/dbraw/zinc/95/11/21/314951121.db2.gz	XQLHHULMZSEGPL-UHFFFAOYSA-N	-2	3	349.408	3.119	10	0		EGAEHL
CCc1ccc(-n2c(=O)c3[n-][n-]n(-c4cc(C)ccc4C)c=3c2=O)cc1	ZINC000033114642	453906031	/nfs/dbraw/zinc/90/60/31/453906031.db2.gz	YHPLCEPSQXQMCO-ZWKOTPCHSA-N	-2	3	348.406	3.364	10	0		EGAEHL
CCO[C@H](CS(=O)(=O)[N-]c1cc(C(C)(C)C)ccc1[O-])C1CC1	ZINC000629285084	460714266	/nfs/dbraw/zinc/71/42/66/460714266.db2.gz	OHDWXRBOIDCCJX-MRXNPFEDSA-N	-2	3	341.473	3.247	10	0		EGAEHL
O=C([O-])c1ccc(CS(=O)(=O)[N-]c2cc(Cl)ccc2F)cc1	ZINC000314391619	456602925	/nfs/dbraw/zinc/60/29/25/456602925.db2.gz	CJLBIAWTYRMSPZ-UHFFFAOYSA-N	-2	3	343.763	3.119	10	0		EGAEHL
O=C([O-])c1ccc(CS(=O)(=O)[N-]c2ccc(Cl)c(F)c2)cc1	ZINC000315645529	456608897	/nfs/dbraw/zinc/60/88/97/456608897.db2.gz	ZOUQOXJPJOJSMX-UHFFFAOYSA-N	-2	3	343.763	3.119	10	0		EGAEHL
C[C@@H]1CCN(C(=O)c2cc(=O)c3ccccc3[n-]2)c2c([O-])cccc21	ZINC000345133828	456937130	/nfs/dbraw/zinc/93/71/30/456937130.db2.gz	MNGQSHVEWGHCHQ-GFCCVEGCSA-N	-2	3	334.375	3.388	10	0		EGAEHL