smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1ccccc1[C@H](C)NC(=O)c1ccc(S(=O)(=O)C(F)F)cc1 ZINC000017963284 695635446 /nfs/dbraw/zinc/63/54/46/695635446.db2.gz GEDOSMDGZNQDDB-LBPRGKRZSA-N 0 0 353.390 3.482 10 0 FGAERN O=C(CNC(=O)N[C@@H]1CCC[C@@H](C(F)(F)F)C1)OCc1ccccc1 ZINC000026292607 695682555 /nfs/dbraw/zinc/68/25/55/695682555.db2.gz DRAWQSARMXSPMN-ZIAGYGMSSA-N 0 0 358.360 3.150 10 0 FGAERN CCOc1ccccc1NC(=O)C(=O)N[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000041272324 695760748 /nfs/dbraw/zinc/76/07/48/695760748.db2.gz LRQFBJSDLKTCOA-NEPJUHHUSA-N 0 0 358.360 3.261 10 0 FGAERN COc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(Cl)s2)cc1F ZINC000041758197 695766817 /nfs/dbraw/zinc/76/68/17/695766817.db2.gz OHRJOGRDMQQJED-MRVPVSSYSA-N 0 0 356.806 3.365 10 0 FGAERN Cc1ccc(F)cc1NC(=O)N[C@@H](C)c1ccc(S(C)(=O)=O)cc1 ZINC000043277573 695790738 /nfs/dbraw/zinc/79/07/38/695790738.db2.gz ZWBVCIGMXXPBFO-LBPRGKRZSA-N 0 0 350.415 3.420 10 0 FGAERN Cc1ccc(F)c(NC(=O)N[C@H](C)c2ccc(S(C)(=O)=O)cc2)c1 ZINC000043351167 695791943 /nfs/dbraw/zinc/79/19/43/695791943.db2.gz NHHIUQYQAGJFNZ-GFCCVEGCSA-N 0 0 350.415 3.420 10 0 FGAERN CNS(=O)(=O)c1cc(NC(=O)N[C@@H](C)c2ccccc2C)ccc1C ZINC000043691841 695795735 /nfs/dbraw/zinc/79/57/35/695795735.db2.gz GVIKVDWBDRLSHK-AWEZNQCLSA-N 0 0 361.467 3.094 10 0 FGAERN O=c1ccc2cc(S(=O)(=O)N[C@@H]3CCCc4ccccc43)ccc2o1 ZINC000044285961 695806914 /nfs/dbraw/zinc/80/69/14/695806914.db2.gz GMBQGRNLTDQWEO-QGZVFWFLSA-N 0 0 355.415 3.149 10 0 FGAERN C[C@@H](NC(=O)C(=O)Nc1c(F)c(F)c(F)c(F)c1F)c1cccs1 ZINC000048879924 695890617 /nfs/dbraw/zinc/89/06/17/695890617.db2.gz QLSTYYXNJNZHHA-RXMQYKEDSA-N 0 0 364.295 3.260 10 0 FGAERN C[C@@H](NC(=O)NC[C@@H](c1cccs1)N1CCOCC1)c1cccs1 ZINC000053521228 695930232 /nfs/dbraw/zinc/93/02/32/695930232.db2.gz VLRIABRIIQAINB-KGLIPLIRSA-N 0 0 365.524 3.243 10 0 FGAERN Cc1ccc(NS(=O)(=O)/C=C/c2ccccc2)cc1N1CCOC1=O ZINC000072761016 695962524 /nfs/dbraw/zinc/96/25/24/695962524.db2.gz KRBUYYWABNCFFT-FMIVXFBMSA-N 0 0 358.419 3.364 10 0 FGAERN COC(=O)N[C@@H](C(=O)Nc1ccc(OC2CCCC2)c(F)c1)C(C)C ZINC000078232349 700274537 /nfs/dbraw/zinc/27/45/37/700274537.db2.gz QYWFNHGVGDUFDY-MRXNPFEDSA-N 0 0 352.406 3.466 10 0 FGAERN NC(=O)CCSc1ccccc1NS(=O)(=O)/C=C/c1ccccc1 ZINC000078668077 700284318 /nfs/dbraw/zinc/28/43/18/700284318.db2.gz RZYQOSSEVPCZAW-ACCUITESSA-N 0 0 362.476 3.067 10 0 FGAERN CCn1c(SCC(=O)O[C@@H](C)[C@H]2CCOC2)nnc1-c1cccs1 ZINC000079177992 700294992 /nfs/dbraw/zinc/29/49/92/700294992.db2.gz KXYVCVCWPPDPNN-RYUDHWBXSA-N 0 0 367.496 3.087 10 0 FGAERN C[C@H](OC(=O)c1ccn(-c2cccc(C(F)(F)F)c2)n1)[C@@H]1CCOC1 ZINC000079187233 700295508 /nfs/dbraw/zinc/29/55/08/700295508.db2.gz ZSYORXBBAVBQEG-NWDGAFQWSA-N 0 0 354.328 3.473 10 0 FGAERN C[C@H](NC(=O)c1ccccc1CSC1=NCCS1)[C@@H]1CCCO1 ZINC000080549482 700319314 /nfs/dbraw/zinc/31/93/14/700319314.db2.gz OTAISDKMCQGJMO-WFASDCNBSA-N 0 0 350.509 3.320 10 0 FGAERN CC(C)(C)OC(=O)NC[C@H]1CCCN1C(=O)c1cc(F)c(F)c(F)c1 ZINC000081341848 700333240 /nfs/dbraw/zinc/33/32/40/700333240.db2.gz CTQNKTSCSYYJRH-LLVKDONJSA-N 0 0 358.360 3.233 10 0 FGAERN C[C@@H](C(=O)N1CCC[C@@H]1CNC(=O)OC(C)(C)C)c1ccccc1F ZINC000081341856 700333315 /nfs/dbraw/zinc/33/33/15/700333315.db2.gz ATSRIMLOTWDLQJ-ZIAGYGMSSA-N 0 0 350.434 3.445 10 0 FGAERN O=C(Nc1cnn(Cc2ccc(Cl)cc2)c1)N[C@H]1CCCC[C@H]1CO ZINC000081639296 700338534 /nfs/dbraw/zinc/33/85/34/700338534.db2.gz UYCFAWJIZNAQLM-YOEHRIQHSA-N 0 0 362.861 3.257 10 0 FGAERN CCN(C(=O)N[C@@H](C)c1ccc(C)c(F)c1)[C@@H](C)CS(=O)(=O)CC ZINC000087283746 700374396 /nfs/dbraw/zinc/37/43/96/700374396.db2.gz KQPFDZAHHCYNQD-KBPBESRZSA-N 0 0 358.479 3.050 10 0 FGAERN CC(C)(C)OC(=O)NC[C@@H]1CCC[C@@H]1NC(=O)CSCC(F)(F)F ZINC000090421532 700403116 /nfs/dbraw/zinc/40/31/16/700403116.db2.gz RMQYURYNVQPNKE-QWRGUYRKSA-N 0 0 370.437 3.092 10 0 FGAERN OCCCN(C[C@H]1CC(c2ccc(Cl)cc2)=NO1)CC(F)(F)F ZINC000091744831 700424279 /nfs/dbraw/zinc/42/42/79/700424279.db2.gz NJIFCTIVHTYYRU-CYBMUJFWSA-N 0 0 350.768 3.080 10 0 FGAERN CSCCc1nc([C@H]2CCCCN2C(C)=O)n(-c2ccccc2F)n1 ZINC000096138751 700458796 /nfs/dbraw/zinc/45/87/96/700458796.db2.gz SWJKZHURDDCRNW-MRXNPFEDSA-N 0 0 362.474 3.385 10 0 FGAERN Cn1cnc(S(=O)(=O)N(C2CC2)[C@@H]2CCCc3ccccc32)c1Cl ZINC000103495029 700486628 /nfs/dbraw/zinc/48/66/28/700486628.db2.gz FJQLXVCOJARYJR-OAHLLOKOSA-N 0 0 365.886 3.304 10 0 FGAERN CC[C@@H](O)CN1CCN(C(=O)c2sc3ccccc3c2Cl)CC1 ZINC000106395119 700508163 /nfs/dbraw/zinc/50/81/63/700508163.db2.gz YAALUKZXPQQSQE-GFCCVEGCSA-N 0 0 352.887 3.083 10 0 FGAERN COC(=O)N[C@@H](C(=O)OCc1ccc(F)cc1Br)C(C)C ZINC000108625338 700527013 /nfs/dbraw/zinc/52/70/13/700527013.db2.gz NXNRCYCCZQBLQZ-GFCCVEGCSA-N 0 0 362.195 3.012 10 0 FGAERN CS(=O)(=O)Nc1ccc(OC(=O)[C@H]2C[C@@H]2c2ccc(F)c(F)c2)cc1 ZINC000109185115 700531527 /nfs/dbraw/zinc/53/15/27/700531527.db2.gz ZFVFJBWHUDHKTN-KGLIPLIRSA-N 0 0 367.373 3.045 10 0 FGAERN CCn1c(-c2cccs2)nn(CN2CC[C@H](c3cnn(C)c3)C2)c1=S ZINC000116258296 700592363 /nfs/dbraw/zinc/59/23/63/700592363.db2.gz MLHGVEXKZQMZQO-ZDUSSCGKSA-N 0 0 374.539 3.343 10 0 FGAERN C[C@@](O)(CNC(=O)N[C@@H]1CCOc2ccccc21)c1ccccc1Cl ZINC000119071942 700619409 /nfs/dbraw/zinc/61/94/09/700619409.db2.gz QJDKPAWTDJBKSX-VQIMIIECSA-N 0 0 360.841 3.371 10 0 FGAERN CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@H](c2ccsc2)C1 ZINC000120337406 700652890 /nfs/dbraw/zinc/65/28/90/700652890.db2.gz AGIZCGYDSLDGMH-GJZGRUSLSA-N 0 0 368.499 3.341 10 0 FGAERN COc1ccccc1OC[C@H](C)CNS(=O)(=O)/C=C/c1ccccc1 ZINC000120562023 700656526 /nfs/dbraw/zinc/65/65/26/700656526.db2.gz AKPURAATMWJJFF-CJTWTEFWSA-N 0 0 361.463 3.300 10 0 FGAERN C[C@@H](OC(=O)c1cccc(-n2ccc(C(F)(F)F)n2)c1)[C@@H]1CCOC1 ZINC000122003978 700683468 /nfs/dbraw/zinc/68/34/68/700683468.db2.gz ILVSJNJMNUQXEQ-DGCLKSJQSA-N 0 0 354.328 3.473 10 0 FGAERN Cc1sc(Br)cc1S(=O)(=O)N[C@@H]1COc2ccccc21 ZINC000122449882 700690072 /nfs/dbraw/zinc/69/00/72/700690072.db2.gz MBHRNEHRDHSJPK-SNVBAGLBSA-N 0 0 374.281 3.231 10 0 FGAERN CSCCCNC(=O)[C@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2 ZINC000123830854 700710612 /nfs/dbraw/zinc/71/06/12/700710612.db2.gz YSPPRCUDPTZEMG-VQBCORBOSA-N 0 0 364.555 3.063 10 0 FGAERN O=S(=O)(Cc1cccc(F)c1)N1CCC[C@@H]1C[C@@H](O)c1ccccc1 ZINC000123891747 700711724 /nfs/dbraw/zinc/71/17/24/700711724.db2.gz ZEKLWGHSEWZHRI-RTBURBONSA-N 0 0 363.454 3.244 10 0 FGAERN C[C@@H]1CC[C@H](NC(=O)CCNC(=O)OCC(F)(F)F)c2ccccc21 ZINC000124959179 700727724 /nfs/dbraw/zinc/72/77/24/700727724.db2.gz OOHIALYLPBEPAH-RISCZKNCSA-N 0 0 358.360 3.420 10 0 FGAERN COc1cccc([C@@H](O)C(=O)N2CC[C@@H](Oc3cccc(Cl)c3)C2)c1 ZINC000127120162 700757577 /nfs/dbraw/zinc/75/75/77/700757577.db2.gz OFQMICCBIGXGQX-QZTJIDSGSA-N 0 0 361.825 3.062 10 0 FGAERN C[C@@H](NC(=O)c1ccco1)C(=O)OCCCc1nc2ccccc2s1 ZINC000127318135 700759829 /nfs/dbraw/zinc/75/98/29/700759829.db2.gz DWHQWXNKYRYJSX-GFCCVEGCSA-N 0 0 358.419 3.184 10 0 FGAERN CC[C@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCC(C)(C)[C@H](O)C(C)C ZINC000127472159 700761952 /nfs/dbraw/zinc/76/19/52/700761952.db2.gz YZHMEXGKSZLJLW-RRFJBIMHSA-N 0 0 358.523 3.085 10 0 FGAERN CC(C)(C)OC(=O)NCCCCCC(=O)N1CCO[C@@H]2CCCC[C@H]21 ZINC000128710835 700778804 /nfs/dbraw/zinc/77/88/04/700778804.db2.gz OCWVUGQZPJJWFM-HZPDHXFCSA-N 0 0 354.491 3.242 10 0 FGAERN CC(=O)N[C@H]1CCCN(C(=O)/C=C(/C)c2ccc(C(F)(F)F)cc2)C1 ZINC000130265346 700798660 /nfs/dbraw/zinc/79/86/60/700798660.db2.gz VPEFYWQNRCBGRK-DMIOIOJGSA-N 0 0 354.372 3.236 10 0 FGAERN Cn1c(=S)n(CNC2(c3noc(C4CC4)n3)CCCC2)nc1C1CC1 ZINC000132220981 700825290 /nfs/dbraw/zinc/82/52/90/700825290.db2.gz SCYNHETXXRAEDG-UHFFFAOYSA-N 0 0 360.487 3.105 10 0 FGAERN CC(C)(C)OC(=O)NC[C@H]1CCCN1C(=O)c1cc(F)c(F)cc1F ZINC000132921252 700832825 /nfs/dbraw/zinc/83/28/25/700832825.db2.gz WWJQQPADRXTHDU-SNVBAGLBSA-N 0 0 358.360 3.233 10 0 FGAERN COC(=O)N[C@@H](C(=O)N1CCc2c(Cl)cc(Cl)cc2C1)C(C)C ZINC000133147409 700835463 /nfs/dbraw/zinc/83/54/63/700835463.db2.gz FNIALZYQEOQVDN-CQSZACIVSA-N 0 0 359.253 3.259 10 0 FGAERN CCc1nc(C(=O)O[C@H](C)C2CCOCC2)nn1-c1ccccc1Cl ZINC000151631253 704931122 /nfs/dbraw/zinc/93/11/22/704931122.db2.gz FJGSYKWGSBAJEH-GFCCVEGCSA-N 0 0 363.845 3.455 10 0 FGAERN O=C(N[C@@H]1CCC[C@H](C(F)(F)F)C1)c1cnn(-c2ccc(F)cc2)n1 ZINC000155500227 705080825 /nfs/dbraw/zinc/08/08/25/705080825.db2.gz AIUYKXSTQNSRKV-CMPLNLGQSA-N 0 0 356.323 3.257 10 0 FGAERN Cc1nc(Cl)ccc1C(=O)N[C@H]1CCC[C@@H]1CNC(=O)OC(C)(C)C ZINC000156350686 705112102 /nfs/dbraw/zinc/11/21/02/705112102.db2.gz BKVICGYWAJWXIX-OCCSQVGLSA-N 0 0 367.877 3.467 10 0 FGAERN CCO[C@@H]1C[C@@H](N(C)Cn2nc(N(C)C)sc2=S)C12CCCC2 ZINC000156508267 705120000 /nfs/dbraw/zinc/12/00/00/705120000.db2.gz JIHHISHYKXUVOU-CHWSQXEVSA-N 0 0 356.561 3.367 10 0 FGAERN COC(=O)NC(C)(C)C(=O)NC[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000156804749 705132794 /nfs/dbraw/zinc/13/27/94/705132794.db2.gz WTSNUJOEWJBDMS-JOYOIKCWSA-N 0 0 359.253 3.348 10 0 FGAERN O=C(c1cnn(-c2ccc(F)cc2)n1)N1CCCC[C@H]1c1nccs1 ZINC000158773976 705198590 /nfs/dbraw/zinc/19/85/90/705198590.db2.gz LANWRZIZJCRDDK-HNNXBMFYSA-N 0 0 357.414 3.230 10 0 FGAERN CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@H](c2cccs2)C1 ZINC000161811962 705283586 /nfs/dbraw/zinc/28/35/86/705283586.db2.gz RSKPIUUXIWNQCF-KBPBESRZSA-N 0 0 368.499 3.341 10 0 FGAERN C[C@@H]1CC[C@@H](NS(=O)(=O)c2ccc3c(c2)C(=O)OC3)c2ccccc21 ZINC000162291534 705293038 /nfs/dbraw/zinc/29/30/38/705293038.db2.gz SKBFAWUKCOARCQ-KZULUSFZSA-N 0 0 357.431 3.274 10 0 FGAERN CCC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCCc1c(F)cccc1F ZINC000170721854 705358460 /nfs/dbraw/zinc/35/84/60/705358460.db2.gz TULSCWHBWZOXNT-OAHLLOKOSA-N 0 0 356.413 3.317 10 0 FGAERN COC(=O)N[C@@H](C(=O)N[C@@H]1CCSc2ccc(Cl)cc21)C(C)C ZINC000170976708 705369293 /nfs/dbraw/zinc/36/92/93/705369293.db2.gz WAAWQNTZGZLFLY-TZMCWYRMSA-N 0 0 356.875 3.374 10 0 FGAERN Cc1ccc(C(=O)O[C@H](C)c2nc3ccccc3[nH]2)cc1S(C)(=O)=O ZINC000171335695 705381123 /nfs/dbraw/zinc/38/11/23/705381123.db2.gz HITBRRYBZLDYSF-GFCCVEGCSA-N 0 0 358.419 3.193 10 0 FGAERN COC(=O)[C@@H]1CCCN(C(=O)/C=C/c2ccc3ccc(Cl)cc3n2)C1 ZINC000171465765 705385047 /nfs/dbraw/zinc/38/50/47/705385047.db2.gz KBMVXZHTGLPULF-MYSGNRETSA-N 0 0 358.825 3.313 10 0 FGAERN CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CCC[C@@H](C(F)(F)F)C2)C1 ZINC000172548539 705423332 /nfs/dbraw/zinc/42/33/32/705423332.db2.gz ZMSGBCRSMDTBCR-VXGBXAGGSA-N 0 0 350.381 3.044 10 0 FGAERN C[C@H](NC(=O)N[C@H](CNC(=O)OC(C)(C)C)C1CC1)c1cccs1 ZINC000172602586 705424516 /nfs/dbraw/zinc/42/45/16/705424516.db2.gz BFKUQKKFRNZHMB-WCQYABFASA-N 0 0 353.488 3.412 10 0 FGAERN CCO[C@@H]1C[C@@H](OC(=O)c2csc(-c3cnccn3)n2)C12CCCC2 ZINC000172672592 705426232 /nfs/dbraw/zinc/42/62/32/705426232.db2.gz BGAYPDYTERTSCR-HUUCEWRRSA-N 0 0 359.451 3.495 10 0 FGAERN C[C@H](Oc1cccc(Br)c1)C(=O)N[C@@H]1COc2ccccc21 ZINC000172910140 705435459 /nfs/dbraw/zinc/43/54/59/705435459.db2.gz MPMCBZBGCKTCEM-XHDPSFHLSA-N 0 0 362.223 3.466 10 0 FGAERN CC(C)(C)OC(=O)NC[C@@H]1CCC[C@@H]1NC(=O)NCCc1cccs1 ZINC000173929373 705478099 /nfs/dbraw/zinc/47/80/99/705478099.db2.gz IJPOGFKLMWKKDL-ZFWWWQNUSA-N 0 0 367.515 3.283 10 0 FGAERN CC(C)(C)OC(=O)NC[C@@H]1CCC[C@@H]1NC(=O)c1ccc(Cl)cn1 ZINC000173928271 705478432 /nfs/dbraw/zinc/47/84/32/705478432.db2.gz BXPLOZHVYZTKDE-AAEUAGOBSA-N 0 0 353.850 3.158 10 0 FGAERN CC(=O)c1csc(C(=O)N[C@H]2CCC[C@@H]2CNC(=O)OC(C)(C)C)c1 ZINC000173929061 705478448 /nfs/dbraw/zinc/47/84/48/705478448.db2.gz GNBHJJRQZIXRKK-OCCSQVGLSA-N 0 0 366.483 3.374 10 0 FGAERN Cn1cc(Cl)cc1C(=O)N[C@H]1CCC[C@@H]1CNC(=O)OC(C)(C)C ZINC000174214235 705491819 /nfs/dbraw/zinc/49/18/19/705491819.db2.gz GOJJGKUKLJQDAG-YPMHNXCESA-N 0 0 355.866 3.102 10 0 FGAERN CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](C)CCc1cccn1C ZINC000174434154 705503754 /nfs/dbraw/zinc/50/37/54/705503754.db2.gz ZCJWRJIYXIDEJM-ZBFHGGJFSA-N 0 0 351.491 3.156 10 0 FGAERN Cc1c(NS(=O)(=O)/C=C/c2ccccc2)cccc1N1CCOC1=O ZINC000174774013 705518994 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/nfs/dbraw/zinc/18/69/80/494186980.db2.gz XDMSUAPWDSCQOM-SJORKVTESA-N 0 0 355.486 3.338 10 0 FGAERN C[C@H](NC(=O)N1CCC(C(=O)N(C)C)CC1)c1ccc2ccccc2c1 ZINC000054103706 494195861 /nfs/dbraw/zinc/19/58/61/494195861.db2.gz CUVAQLCJRASUAG-HNNXBMFYSA-N 0 0 353.466 3.411 10 0 FGAERN CC(=O)c1c(F)cccc1NCCNS(=O)(=O)c1cc(C)ccc1C ZINC000042098190 494200748 /nfs/dbraw/zinc/20/07/48/494200748.db2.gz WERBELCWNMBMRS-UHFFFAOYSA-N 0 0 364.442 3.036 10 0 FGAERN C[C@@H](NC(=O)Nc1cnn(-c2ncccn2)c1)c1ccc(F)c(Cl)c1 ZINC000072560942 494203866 /nfs/dbraw/zinc/20/38/66/494203866.db2.gz PLQAFBVHTATUKN-SNVBAGLBSA-N 0 0 360.780 3.338 10 0 FGAERN COC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2N1Cc1nc(CCc2ccccc2)no1 ZINC000072562277 494204168 /nfs/dbraw/zinc/20/41/68/494204168.db2.gz IJLDXLORGMSREY-SQNIBIBYSA-N 0 0 369.465 3.161 10 0 FGAERN CCc1nc2n(n1)CCC[C@@H]2NC(=O)c1cccc(OC2CCCC2)c1 ZINC000087562844 494210407 /nfs/dbraw/zinc/21/04/07/494210407.db2.gz HTUZLKZXQYKMQY-KRWDZBQOSA-N 0 0 354.454 3.427 10 0 FGAERN CCc1nc2n(n1)CCC[C@H]2NC(=O)COc1ccc2ccccc2c1 ZINC000088196896 494212213 /nfs/dbraw/zinc/21/22/13/494212213.db2.gz LSCPHXGGTJGUSM-QGZVFWFLSA-N 0 0 350.422 3.024 10 0 FGAERN CCOc1cc(CN(C)C(=O)N[C@@H](C)[C@H]2CCCO2)ccc1OC(F)F ZINC000042326095 494215696 /nfs/dbraw/zinc/21/56/96/494215696.db2.gz SJAFLQHAFQDHSC-GXTWGEPZSA-N 0 0 372.412 3.396 10 0 FGAERN Cc1ccc([C@H](C)NC(=O)CSc2nnnn2C2CCCC2)cc1F ZINC000088234545 494218990 /nfs/dbraw/zinc/21/89/90/494218990.db2.gz WMYWDFZQOQBUOO-LBPRGKRZSA-N 0 0 363.462 3.205 10 0 FGAERN Cc1ccc([C@H](C)NC(=O)c2ccc(=O)n(Cc3ccccc3)n2)cc1F ZINC000088234590 494219009 /nfs/dbraw/zinc/21/90/09/494219009.db2.gz ZJALOICGKNLBAH-HNNXBMFYSA-N 0 0 365.408 3.230 10 0 FGAERN Cc1nnnn1[C@H](Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(C)c(F)c1 ZINC000088233409 494219188 /nfs/dbraw/zinc/21/91/88/494219188.db2.gz BORNWXFJIILAIO-IFXJQAMLSA-N 0 0 367.428 3.090 10 0 FGAERN CC(=O)N[C@H]1CCCN(C(=O)[C@H](C)Cc2cccc(C(F)(F)F)c2)C1 ZINC000078078759 494224790 /nfs/dbraw/zinc/22/47/90/494224790.db2.gz 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ZINC000089246886 494280072 /nfs/dbraw/zinc/28/00/72/494280072.db2.gz VULRWPKPQDWAHC-SFHVURJKSA-N 0 0 361.873 3.386 10 0 FGAERN Cc1ccc(NC(=O)c2ccc(NCCCCn3cnnc3)nc2)cc1 ZINC000078510184 494310495 /nfs/dbraw/zinc/31/04/95/494310495.db2.gz IZQYIUVSJQJFTF-UHFFFAOYSA-N 0 0 350.426 3.126 10 0 FGAERN Cc1ccc([C@@H](C)NC(=O)NC2CCN(C(=O)c3ccccc3)CC2)o1 ZINC000043723248 494315117 /nfs/dbraw/zinc/31/51/17/494315117.db2.gz FZPHDQGLIITXIY-OAHLLOKOSA-N 0 0 355.438 3.253 10 0 FGAERN CC(C)(C)OC(=O)NC[C@H]1CCC[C@H]1NC(=O)c1ccncc1Cl ZINC000073120069 494324445 /nfs/dbraw/zinc/32/44/45/494324445.db2.gz JHZIZLOBCLVKOV-BXUZGUMPSA-N 0 0 353.850 3.158 10 0 FGAERN OCC1CCN(Cc2nc3ccccc3c(N3CCCCCC3)n2)CC1 ZINC000014888658 494327513 /nfs/dbraw/zinc/32/75/13/494327513.db2.gz BYKFXGOJVQUMNF-UHFFFAOYSA-N 0 0 354.498 3.215 10 0 FGAERN COc1cccc(N2C(=O)CN([C@@H](C)CCc3ccc(O)cc3)C[C@@H]2C)c1 ZINC000014973240 494331251 /nfs/dbraw/zinc/33/12/51/494331251.db2.gz CUWZLXUTNSIZLT-IRXDYDNUSA-N 0 0 368.477 3.459 10 0 FGAERN COc1ccccc1[C@H](NC(=O)N[C@H](C)[C@H]1CCCO1)c1ccccn1 ZINC000089659561 494339889 /nfs/dbraw/zinc/33/98/89/494339889.db2.gz NOJPBSVPLLHNDE-BJZITVGISA-N 0 0 355.438 3.046 10 0 FGAERN CC[C@@H](C)NS(=O)(=O)c1cccc(C(=O)Nc2ccccc2F)c1 ZINC000015422086 494353404 /nfs/dbraw/zinc/35/34/04/494353404.db2.gz MWNHNCCBKXZBBH-GFCCVEGCSA-N 0 0 350.415 3.155 10 0 FGAERN Cc1ccc(NC(=O)c2cccc(S(=O)(=O)NCC(C)C)c2)cc1C ZINC000015439356 494355077 /nfs/dbraw/zinc/35/50/77/494355077.db2.gz LGOHWBJZPUUVNG-UHFFFAOYSA-N 0 0 360.479 3.490 10 0 FGAERN O=C(N[C@H]1COc2ccccc21)C1(c2ccc(F)cc2F)CCOCC1 ZINC000089784760 494363982 /nfs/dbraw/zinc/36/39/82/494363982.db2.gz YAFBJKUADXVBPF-KRWDZBQOSA-N 0 0 359.372 3.263 10 0 FGAERN COc1cc(Cl)c(NC(=O)[C@@H]2Cc3ccccc3N2C(C)=O)c(OC)c1 ZINC000015773205 494368214 /nfs/dbraw/zinc/36/82/14/494368214.db2.gz WRUAVBWEFJGQJB-INIZCTEOSA-N 0 0 374.824 3.274 10 0 FGAERN CCc1nsc(N2CCN(C(=O)N[C@H](C)c3ccccc3C)CC2)n1 ZINC000073414182 494369086 /nfs/dbraw/zinc/36/90/86/494369086.db2.gz WXKNPLGJAVGFKX-CQSZACIVSA-N 0 0 359.499 3.002 10 0 FGAERN CCOC(=O)CC[C@H](C)NC(=O)N[C@@H](Cc1ccccc1)C(F)(F)F ZINC000089907798 494397313 /nfs/dbraw/zinc/39/73/13/494397313.db2.gz DQTSTVFOLASTNF-JSGCOSHPSA-N 0 0 360.376 3.191 10 0 FGAERN CCN(CC)C(=O)[C@@H]1CCCN1C(=O)NCc1ccc(OC(C)C)cc1 ZINC000073602596 494398039 /nfs/dbraw/zinc/39/80/39/494398039.db2.gz STJSDGAZNNPNKC-SFHVURJKSA-N 0 0 361.486 3.016 10 0 FGAERN C[C@H](NC(=O)N[C@@H]1CCOc2ccccc21)c1ccc(-n2cncn2)cc1 ZINC000045115372 494399006 /nfs/dbraw/zinc/39/90/06/494399006.db2.gz JBZHFEAKTKPLSC-KBXCAEBGSA-N 0 0 363.421 3.151 10 0 FGAERN CCOC(=O)C[C@@H](C)CNC(=O)N1CCC[C@H](c2nc(CC)cs2)C1 ZINC000089931946 494404233 /nfs/dbraw/zinc/40/42/33/494404233.db2.gz VEJOUYKQKHVGJM-KGLIPLIRSA-N 0 0 367.515 3.184 10 0 FGAERN CC(C)[C@H](C)NC(=O)c1cccc(CN2C(=O)c3ccccc3C2=O)c1 ZINC000017054573 494405934 /nfs/dbraw/zinc/40/59/34/494405934.db2.gz HYZCTWQLESKLCY-AWEZNQCLSA-N 0 0 350.418 3.257 10 0 FGAERN CCN(C(=O)N[C@H]1CCS(=O)(=O)c2ccccc21)C1CCCCC1 ZINC000045303404 494415625 /nfs/dbraw/zinc/41/56/25/494415625.db2.gz ZBOLUCSLIWJKJO-INIZCTEOSA-N 0 0 350.484 3.269 10 0 FGAERN COc1ccc([C@@H](C)NC(=O)c2cccc(C[S@@](C)=O)c2)cc1OC ZINC000045385575 494423278 /nfs/dbraw/zinc/42/32/78/494423278.db2.gz WNKQTTYCDBGZRG-SHZVTRLKSA-N 0 0 361.463 3.073 10 0 FGAERN CC(=O)N[C@@H]1CCCN(C(=O)CCOc2ccccc2-c2ccccc2)C1 ZINC000079297316 494432600 /nfs/dbraw/zinc/43/26/00/494432600.db2.gz AJEJXDPPSKGGGF-LJQANCHMSA-N 0 0 366.461 3.250 10 0 FGAERN COc1ccc([C@@H](C)NS(=O)(=O)c2cc(C)sc2C)cc1OC ZINC000056093446 494453424 /nfs/dbraw/zinc/45/34/24/494453424.db2.gz ZCHOZBZKGBBXOD-LLVKDONJSA-N 0 0 355.481 3.422 10 0 FGAERN Cc1nc2n(n1)CCC[C@@H]2N[C@@H](C)c1cnn(-c2ccc(F)cc2)c1C ZINC000090224547 494456458 /nfs/dbraw/zinc/45/64/58/494456458.db2.gz GLRJLPNVUMHIJY-SGTLLEGYSA-N 0 0 354.433 3.405 10 0 FGAERN Cc1nc2n(n1)CCC[C@@H]2N[C@@H](C)c1ccc(OCc2nccn2C)cc1 ZINC000090226681 494457881 /nfs/dbraw/zinc/45/78/81/494457881.db2.gz FPDNVFBDZRCIIH-KSSFIOAISA-N 0 0 366.469 3.085 10 0 FGAERN COC[C@H]1CN(C(=O)N[C@@H](C)c2ccc(OCCC(C)C)cc2)CCO1 ZINC000073977964 494459474 /nfs/dbraw/zinc/45/94/74/494459474.db2.gz APOWUUGUUPVEQR-QFBILLFUSA-N 0 0 364.486 3.229 10 0 FGAERN CCC(=O)Nc1ccc(Cl)c(NC(=O)[C@H](C)NC(=O)c2ccco2)c1 ZINC000056136931 494460170 /nfs/dbraw/zinc/46/01/70/494460170.db2.gz HGJWYBADVWZJLJ-JTQLQIEISA-N 0 0 363.801 3.039 10 0 FGAERN Cc1ccc([C@@H](C)NS(=O)(=O)c2ccc(Br)s2)o1 ZINC000021188303 494490171 /nfs/dbraw/zinc/49/01/71/494490171.db2.gz MRCRZLAKVRSFFO-MRVPVSSYSA-N 0 0 350.259 3.452 10 0 FGAERN O=C(N[C@@H]1CCc2cc(Cl)ccc21)c1cn(Cc2cccs2)nn1 ZINC000079726884 494515947 /nfs/dbraw/zinc/51/59/47/494515947.db2.gz NKORDZSQRUGHRR-OAHLLOKOSA-N 0 0 358.854 3.459 10 0 FGAERN O=C(NCc1ccccn1)[C@H]1CCCN(c2ccc(-c3ccccc3)nn2)C1 ZINC000022480879 494524471 /nfs/dbraw/zinc/52/44/71/494524471.db2.gz RKCSGOVRYDLBDK-SFHVURJKSA-N 0 0 373.460 3.071 10 0 FGAERN COCCOc1ccc(NC(=O)N[C@@H]2CCOc3ccccc32)cc1F ZINC000056551516 494524610 /nfs/dbraw/zinc/52/46/10/494524610.db2.gz LQTLEZYBWOWDIT-MRXNPFEDSA-N 0 0 360.385 3.496 10 0 FGAERN C[C@H](NC(=O)N1CCC(NC(=O)c2ccsc2)CC1)c1cccs1 ZINC000056555038 494525646 /nfs/dbraw/zinc/52/56/46/494525646.db2.gz SKXJEBCQPMFRGL-LBPRGKRZSA-N 0 0 363.508 3.475 10 0 FGAERN CC(C)[C@H](C)NC(=O)N(C)C[C@H](O)COc1ccccc1C(F)(F)F ZINC000067381374 494527767 /nfs/dbraw/zinc/52/77/67/494527767.db2.gz WOYHYYDNCCJESZ-STQMWFEESA-N 0 0 362.392 3.131 10 0 FGAERN O=C(Nc1cccc(Cl)c1)N[C@H]1CCS(=O)(=O)c2ccccc21 ZINC000074394517 494528915 /nfs/dbraw/zinc/52/89/15/494528915.db2.gz YXOGWTNTJPUHKY-AWEZNQCLSA-N 0 0 350.827 3.380 10 0 FGAERN COc1cccc(NC(=O)C(=O)N[C@@H](C)c2ccc(F)c(Cl)c2)c1 ZINC000067434154 494540751 /nfs/dbraw/zinc/54/07/51/494540751.db2.gz GOBMDRXZDYKJRR-JTQLQIEISA-N 0 0 350.777 3.304 10 0 FGAERN COc1ccc([C@H](C)NC(=O)Cc2ccc(NC(C)=O)cc2)cc1OC ZINC000074470938 494543921 /nfs/dbraw/zinc/54/39/21/494543921.db2.gz OXEDHWHFRGYFFM-ZDUSSCGKSA-N 0 0 356.422 3.082 10 0 FGAERN Cc1nc(Br)ccc1NC(=O)N1CC[C@]2(O)CCCC[C@H]2C1 ZINC000091189998 494551998 /nfs/dbraw/zinc/55/19/98/494551998.db2.gz NQPZRNGNTWBOES-BLLLJJGKSA-N 0 0 368.275 3.311 10 0 FGAERN CC(C)Cn1ccnc1CNC(=O)N1CCC[C@@H]1C[C@@H](O)c1ccccc1 ZINC000074535890 494554767 /nfs/dbraw/zinc/55/47/67/494554767.db2.gz IFGLLYDYZPYEEB-RTBURBONSA-N 0 0 370.497 3.337 10 0 FGAERN CC(=O)Nc1cccc2c1CCN(C(=O)N[C@H]1CCOc3ccccc31)C2 ZINC000056793863 494564496 /nfs/dbraw/zinc/56/44/96/494564496.db2.gz IKGWWXXZSBUNDQ-IBGZPJMESA-N 0 0 365.433 3.237 10 0 FGAERN C[C@@H](NC(=O)Nc1nnc(C(F)F)s1)c1ccc2c(c1)OCCO2 ZINC000067586069 494575445 /nfs/dbraw/zinc/57/54/45/494575445.db2.gz HPQLBWJVPVEYJZ-SSDOTTSWSA-N 0 0 356.354 3.130 10 0 FGAERN COc1ccc(F)cc1NC(=O)C(=O)N[C@H]1CC(C)(C)Oc2ccccc21 ZINC000092326060 494597205 /nfs/dbraw/zinc/59/72/05/494597205.db2.gz JSXFRUOKLIDQED-HNNXBMFYSA-N 0 0 372.396 3.191 10 0 FGAERN COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ncccc1C(F)(F)F ZINC000092334342 494598834 /nfs/dbraw/zinc/59/88/34/494598834.db2.gz OSMACGLHDXWRDE-DRZSPHRISA-N 0 0 356.344 3.047 10 0 FGAERN 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CC(C)(Oc1ccc(Cl)cc1)C(=O)NCc1ccnc(N2CCCC2)n1 ZINC000224199282 497048354 /nfs/dbraw/zinc/04/83/54/497048354.db2.gz NIWSBMKOKVYRTI-UHFFFAOYSA-N 0 0 374.872 3.204 10 0 FGAERN C[C@@H]1CC(=O)C=C(OC(=O)c2ccc(I)cc2)C1 ZINC000224886716 497054299 /nfs/dbraw/zinc/05/42/99/497054299.db2.gz CDXWLKHSGIYDNR-SECBINFHSA-N 0 0 356.159 3.331 10 0 FGAERN C[C@H]1C(=O)NCCCN1C(=O)[C@H](Sc1ccccc1F)c1ccccc1 ZINC000189240069 497055034 /nfs/dbraw/zinc/05/50/34/497055034.db2.gz SNRFDIFMLNHIQR-KBXCAEBGSA-N 0 0 372.465 3.396 10 0 FGAERN CC(C)c1nccc(N2CCC[C@@H](N(C)CC(=O)OC(C)(C)C)CC2)n1 ZINC000192268255 497056092 /nfs/dbraw/zinc/05/60/92/497056092.db2.gz ORQXHQJOPYNXHM-MRXNPFEDSA-N 0 0 362.518 3.232 10 0 FGAERN C[C@@H]1C[C@@H](C(=O)N[C@H](CS(C)(=O)=O)c2ccccc2)CC(C)(C)C1 ZINC000248618683 497058961 /nfs/dbraw/zinc/05/89/61/497058961.db2.gz XNJBSCZEDYCEKT-DJIMGWMZSA-N 0 0 351.512 3.351 10 0 FGAERN C[C@H](c1cc(Cl)ccc1Cl)n1nccc1NC(=O)N1CC(CO)C1 ZINC000192277228 497060337 /nfs/dbraw/zinc/06/03/37/497060337.db2.gz 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CCO[C@@H]1C[C@H](NC(=O)N[C@@H](CC)c2c(C)noc2C)C12CCOCC2 ZINC000248675605 497077881 /nfs/dbraw/zinc/07/78/81/497077881.db2.gz CSPRQYDQOXDIQM-HRCADAONSA-N 0 0 365.474 3.016 10 0 FGAERN CCO[C@@H]1C[C@H](NC(=O)NC[C@H](C)c2cccc(C)c2)C12CCOCC2 ZINC000248691599 497080386 /nfs/dbraw/zinc/08/03/86/497080386.db2.gz IPLSUHXDVWZOIF-YTQUADARSA-N 0 0 360.498 3.372 10 0 FGAERN CO[C@H]1C[C@H](c2nc(C)no2)N(Cc2cc(=O)oc3c(C)c(C)ccc23)C1 ZINC000189336495 497086121 /nfs/dbraw/zinc/08/61/21/497086121.db2.gz CTOBDDMBJMMYBS-DOTOQJQBSA-N 0 0 369.421 3.063 10 0 FGAERN CO[C@H]1C[C@H](c2nc(C)no2)N(Cc2ncc(-c3ccc(F)cc3)o2)C1 ZINC000189348375 497089943 /nfs/dbraw/zinc/08/99/43/497089943.db2.gz VNCALKDPTJBVEG-LSDHHAIUSA-N 0 0 358.373 3.134 10 0 FGAERN CC[C@H](C)[C@H](C)NC(=O)N1CCC(N(CC)CC(=O)OC(C)(C)C)CC1 ZINC000192373650 497093427 /nfs/dbraw/zinc/09/34/27/497093427.db2.gz KJKKSPJBTUEEAY-HOTGVXAUSA-N 0 0 369.550 3.259 10 0 FGAERN CCn1cc([C@@H]2CN(C[C@H]3CC(c4ccc(Cl)cc4)=NO3)CCO2)cn1 ZINC000248827294 497111546 /nfs/dbraw/zinc/11/15/46/497111546.db2.gz XOMKPVVZFIAXKV-MJGOQNOKSA-N 0 0 374.872 3.123 10 0 FGAERN CO[C@H](C)c1cccc(NC(=O)N2C[C@@H](OC)C[C@@H]2c2nc(C)no2)c1 ZINC000189422497 497113421 /nfs/dbraw/zinc/11/34/21/497113421.db2.gz FFQLQXLXQLOXTG-XFBWCDHKSA-N 0 0 360.414 3.079 10 0 FGAERN Cc1cccc(NC(=O)NC[C@@H](c2cccs2)N2CCO[C@@H](C)C2)n1 ZINC000248851980 497118418 /nfs/dbraw/zinc/11/84/18/497118418.db2.gz OWDXJTDNOYZEDD-GJZGRUSLSA-N 0 0 360.483 3.035 10 0 FGAERN CCCCN1CCOC[C@H]1C(=O)Nc1cccc(-c2noc(C3CC3)n2)c1 ZINC000192459438 497120884 /nfs/dbraw/zinc/12/08/84/497120884.db2.gz QFPJLQKOTGIHTC-KRWDZBQOSA-N 0 0 370.453 3.053 10 0 FGAERN COc1cc(OC)c(N2C(=O)[C@@H]3C[C@H]4CCCC[C@H]4N3C2=O)cc1Cl ZINC000248869332 497121188 /nfs/dbraw/zinc/12/11/88/497121188.db2.gz ZMKTZWUVLJDEBF-QKCSRTOESA-N 0 0 364.829 3.457 10 0 FGAERN CC(C)c1csc(NC(=O)C(=O)N[C@@H](C)c2ccc(F)c(F)c2)n1 ZINC000192508732 497136111 /nfs/dbraw/zinc/13/61/11/497136111.db2.gz YNRSZUJHRXZHFZ-VIFPVBQESA-N 0 0 353.394 3.361 10 0 FGAERN COCc1nc2n(n1)CCC[C@@H]2NC(=O)N[C@H]1CCC[C@@H](C(C)C)CC1 ZINC000249006873 497149488 /nfs/dbraw/zinc/14/94/88/497149488.db2.gz NZEBKCVOVUSHOM-PMPSAXMXSA-N 0 0 363.506 3.164 10 0 FGAERN C[C@H](Oc1cccc2ccccc21)C(=O)N1CCC[C@H](Cn2cncn2)C1 ZINC000192598744 497160225 /nfs/dbraw/zinc/16/02/25/497160225.db2.gz DSJSNYCQRVWHCW-IRXDYDNUSA-N 0 0 364.449 3.137 10 0 FGAERN C[C@@H](Oc1cccc2ccccc21)C(=O)N1CCC[C@H](Cn2cncn2)C1 ZINC000192598761 497160624 /nfs/dbraw/zinc/16/06/24/497160624.db2.gz DSJSNYCQRVWHCW-SJORKVTESA-N 0 0 364.449 3.137 10 0 FGAERN CCOCCN1CCN(C(=O)c2c[nH]cc2-c2ccc(C)s2)C[C@H]1C ZINC000189658733 497199084 /nfs/dbraw/zinc/19/90/84/497199084.db2.gz KYCIQRKUSZGHTD-CQSZACIVSA-N 0 0 361.511 3.234 10 0 FGAERN CCC[C@@H](NC(=O)Nc1cnn([C@H](C)C2CC2)c1)C(=O)OC(C)(C)C ZINC000189678704 497208470 /nfs/dbraw/zinc/20/84/70/497208470.db2.gz SKHKXQZBJRGGTK-IUODEOHRSA-N 0 0 350.463 3.486 10 0 FGAERN COC[C@@H](C)Oc1ccc(Cl)cc1NCc1nnc(C2CC2)n1C ZINC000189686092 497211651 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FGAERN COc1ccc(C)nc1NC(=O)N1C[C@H](O)C[C@H]1c1cc(F)ccc1F ZINC000127249818 494917174 /nfs/dbraw/zinc/91/71/74/494917174.db2.gz MGGJONMISFXZPQ-DOMZBBRYSA-N 0 0 363.364 3.017 10 0 FGAERN CCOCCN1CCN(C(=O)Nc2cccc(C(F)(F)F)c2)C[C@@H]1C ZINC000117434262 494918459 /nfs/dbraw/zinc/91/84/59/494918459.db2.gz RZHBPIPIIDRQCD-ZDUSSCGKSA-N 0 0 359.392 3.280 10 0 FGAERN COCCN1CCN(C(=O)Nc2ccc(-c3nc(C)cs3)cc2)C[C@@H]1C ZINC000117452883 494921942 /nfs/dbraw/zinc/92/19/42/494921942.db2.gz CJIMXBICKFYWHH-HNNXBMFYSA-N 0 0 374.510 3.303 10 0 FGAERN CN(C(=O)C(C)(C)c1cccc(F)c1)[C@H]1CCCN(c2cccnn2)C1 ZINC000122102907 494923647 /nfs/dbraw/zinc/92/36/47/494923647.db2.gz QTUAOIZIORECFO-KRWDZBQOSA-N 0 0 356.445 3.021 10 0 FGAERN CN(C(=O)Nc1ccc(Cl)cc1F)[C@H]1CCCN(c2cccnn2)C1 ZINC000132782945 494923755 /nfs/dbraw/zinc/92/37/55/494923755.db2.gz LJXMPPVPCFDBCL-ZDUSSCGKSA-N 0 0 363.824 3.402 10 0 FGAERN CCn1cnnc1[C@H]1CCCN(C(=O)CCCOc2cccc(F)c2)C1 ZINC000109856010 494926520 /nfs/dbraw/zinc/92/65/20/494926520.db2.gz DMTGZGAJBDWFKH-HNNXBMFYSA-N 0 0 360.433 3.002 10 0 FGAERN CCc1nc2n(n1)CCC[C@@H]2NC(=O)N(C)Cc1cc2ccccc2o1 ZINC000132871648 494935960 /nfs/dbraw/zinc/93/59/60/494935960.db2.gz RTSPHYGGZGFLKB-HNNXBMFYSA-N 0 0 353.426 3.263 10 0 FGAERN C[C@H](CNC(=O)N[C@@H](C)c1nnc2n1CCCC2)Sc1ccccc1 ZINC000132961876 494949271 /nfs/dbraw/zinc/94/92/71/494949271.db2.gz PMOCTHCJHQTGJS-KGLIPLIRSA-N 0 0 359.499 3.155 10 0 FGAERN CN(C(=O)C12CC3CC(CC(C3)C1)C2)[C@@H]1CCCN(c2cccnn2)C1 ZINC000122296581 494954305 /nfs/dbraw/zinc/95/43/05/494954305.db2.gz AQRZXJMQOGOCLM-IGDKPHCXSA-N 0 0 354.498 3.120 10 0 FGAERN Cc1ccc(N2CCCN(C(=O)C(C)(C)Cc3ccccc3)CC2)nn1 ZINC000117792618 494956580 /nfs/dbraw/zinc/95/65/80/494956580.db2.gz UTMCRZMJBKUGLW-UHFFFAOYSA-N 0 0 352.482 3.093 10 0 FGAERN CN(Cc1nccnc1Cl)C[C@@H]1CCCCN1C(=O)OC(C)(C)C ZINC000095075076 494958085 /nfs/dbraw/zinc/95/80/85/494958085.db2.gz CAIXPCNOTDIRJL-ZDUSSCGKSA-N 0 0 354.882 3.351 10 0 FGAERN O=S(=O)(NC1CC1)[C@@H]1CCOC[C@H]1Cc1c(Cl)cccc1Cl ZINC000095073924 494958289 /nfs/dbraw/zinc/95/82/89/494958289.db2.gz FFCRKYJYLAZGAH-MEBBXXQBSA-N 0 0 364.294 3.023 10 0 FGAERN CC(C)Sc1ccccc1C(=O)N1CCCN(c2cccnn2)CC1 ZINC000117819362 494958563 /nfs/dbraw/zinc/95/85/63/494958563.db2.gz RXKQQPQUJNTUBR-UHFFFAOYSA-N 0 0 356.495 3.330 10 0 FGAERN CC(C)(C)OC(=O)N1CC[C@@H](C[S@](=O)c2nc3ccccc3o2)C1 ZINC000095084394 494958793 /nfs/dbraw/zinc/95/87/93/494958793.db2.gz QVLRANRPHRWEPC-OIRASMEMSA-N 0 0 350.440 3.192 10 0 FGAERN Cc1cnn(CCNC(=O)c2cc3ccc(OC(F)(F)F)cc3[nH]2)c1 ZINC000117818506 494958737 /nfs/dbraw/zinc/95/87/37/494958737.db2.gz FFJWZMVCUQYTAB-UHFFFAOYSA-N 0 0 352.316 3.001 10 0 FGAERN COc1nc2ccccc2nc1N(C)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC000095076516 494958925 /nfs/dbraw/zinc/95/89/25/494958925.db2.gz FSHXUNZXCMMLBF-AWEZNQCLSA-N 0 0 372.469 3.474 10 0 FGAERN CSc1nccc(N(C)CC2CCN(C(=O)OC(C)(C)C)CC2)n1 ZINC000095076695 494958997 /nfs/dbraw/zinc/95/89/97/494958997.db2.gz AOOZZFBWKYQAJH-UHFFFAOYSA-N 0 0 352.504 3.282 10 0 FGAERN C[C@@H]1CN(Cc2ccc(Br)nc2)CCN1C(=O)OC(C)(C)C ZINC000095090627 494960462 /nfs/dbraw/zinc/96/04/62/494960462.db2.gz SEIGOBBMSTUYCC-GFCCVEGCSA-N 0 0 370.291 3.285 10 0 FGAERN Cc1noc([C@H](C)N2CCN(C(=O)CC[C@H](C)c3ccccc3)CC2)n1 ZINC000133061599 494962864 /nfs/dbraw/zinc/96/28/64/494962864.db2.gz XLMCPUJJHKRRDR-HOTGVXAUSA-N 0 0 356.470 3.167 10 0 FGAERN O=S(=O)(c1ccccc1Nc1nc(Cl)ncc1Cl)N1CCCC1 ZINC000117919935 494963363 /nfs/dbraw/zinc/96/33/63/494963363.db2.gz SZTOZZFAXADSOW-UHFFFAOYSA-N 0 0 373.265 3.312 10 0 FGAERN CCO[C@@H]1C[C@@H](N(C)C(=O)[C@@H](C)NC(=O)Nc2ccccc2)C12CCC2 ZINC000127591357 494967568 /nfs/dbraw/zinc/96/75/68/494967568.db2.gz RTYMIMIAERTAHX-DJIMGWMZSA-N 0 0 359.470 3.003 10 0 FGAERN COC[C@@H](C)C(=O)Nc1nnc(-c2cccc(Br)c2)s1 ZINC000110415867 494977820 /nfs/dbraw/zinc/97/78/20/494977820.db2.gz KJZGYYOZWKXTPE-MRVPVSSYSA-N 0 0 356.245 3.189 10 0 FGAERN O=C(NC[C@H](CO)c1ccccc1)N[C@@H](Cc1ccccc1)C(F)(F)F ZINC000122458167 494978146 /nfs/dbraw/zinc/97/81/46/494978146.db2.gz NBWUWZJVMQFNJY-SJORKVTESA-N 0 0 366.383 3.235 10 0 FGAERN CNc1nc(N2CCc3c(F)ccc(F)c3C2)ncc1Br ZINC000133192273 494982095 /nfs/dbraw/zinc/98/20/95/494982095.db2.gz QXEMKGROHSNZDX-UHFFFAOYSA-N 0 0 355.186 3.122 10 0 FGAERN CC(C)(C)[C@H](O)CNC(=O)COc1ccc(Br)cc1Cl ZINC000133202527 494984010 /nfs/dbraw/zinc/98/40/10/494984010.db2.gz QFCNSHIQKHFZOM-GFCCVEGCSA-N 0 0 364.667 3.005 10 0 FGAERN Cn1cc(CCC(=O)N2C[C@H](c3ccccc3Cl)OCC2(C)C)cn1 ZINC000110513166 494985192 /nfs/dbraw/zinc/98/51/92/494985192.db2.gz ZWSMSZQVVPPZMC-QGZVFWFLSA-N 0 0 361.873 3.385 10 0 FGAERN CCCn1nccc1NC(=O)C(=O)N[C@@H](C)c1ccc(CC(C)C)cc1 ZINC000133211488 494985739 /nfs/dbraw/zinc/98/57/39/494985739.db2.gz NGAGITRSKWPCLL-HNNXBMFYSA-N 0 0 356.470 3.308 10 0 FGAERN Cn1cc([C@H]2CCCN2C(=O)NCCc2csc(C(C)(C)C)n2)cn1 ZINC000133220398 494986120 /nfs/dbraw/zinc/98/61/20/494986120.db2.gz OQBWMMVLAVUPBO-OAHLLOKOSA-N 0 0 361.515 3.263 10 0 FGAERN COC(=O)c1ccc(NC(=O)[C@H](NC(=O)CC(C)C)C(C)C)cc1Cl ZINC000118258363 494987060 /nfs/dbraw/zinc/98/70/60/494987060.db2.gz QYEADAGMXXQZAA-MRXNPFEDSA-N 0 0 368.861 3.252 10 0 FGAERN CC[C@H](C)N(Cc1ccccc1)C(=O)N[C@@H]1CCCn2nc(COC)nc21 ZINC000122536116 494990165 /nfs/dbraw/zinc/99/01/65/494990165.db2.gz HRJQSWQDASTDIZ-DOTOQJQBSA-N 0 0 371.485 3.270 10 0 FGAERN CC[C@@H](C)N(Cc1ccccc1)C(=O)N[C@@H]1CCCn2nc(COC)nc21 ZINC000122535874 494990449 /nfs/dbraw/zinc/99/04/49/494990449.db2.gz HRJQSWQDASTDIZ-NVXWUHKLSA-N 0 0 371.485 3.270 10 0 FGAERN CC[NH+](CC)CCC[C@@H](C)NS(=O)(=O)c1nc2ccc(Cl)cc2[n-]1 ZINC000095850731 494990781 /nfs/dbraw/zinc/99/07/81/494990781.db2.gz FDAUDXSXPZWFPF-GFCCVEGCSA-N 0 0 372.922 3.005 10 0 FGAERN COC(=O)CCCS(=O)(=O)N[C@@H](C)c1c(Cl)ccc(F)c1Cl ZINC000118427512 495002163 /nfs/dbraw/zinc/00/21/63/495002163.db2.gz XRHJZSBAWLBUAS-QMMMGPOBSA-N 0 0 372.245 3.066 10 0 FGAERN Cc1cccn2c(=O)c(CO)c(Nc3cccc(OC(F)(F)F)c3)nc12 ZINC000118321636 494994833 /nfs/dbraw/zinc/99/48/33/494994833.db2.gz JZMHYOIQBFDBDT-UHFFFAOYSA-N 0 0 365.311 3.137 10 0 FGAERN COc1ccc(F)c(NC(=O)N2C[C@@H](O)C[C@H]2c2cc(F)ccc2F)c1 ZINC000133299698 494996692 /nfs/dbraw/zinc/99/66/92/494996692.db2.gz MDWQUMRWWBHZQX-GTNSWQLSSA-N 0 0 366.339 3.452 10 0 FGAERN COc1ccc(F)c(NC(=O)N2C[C@H](O)C[C@H]2c2cc(F)ccc2F)c1 ZINC000133299543 494996728 /nfs/dbraw/zinc/99/67/28/494996728.db2.gz MDWQUMRWWBHZQX-DIFFPNOSSA-N 0 0 366.339 3.452 10 0 FGAERN CCOc1ccccc1NC(=O)N1CC[C@H](c2nc3cccnc3n2C)C1 ZINC000096102290 495001163 /nfs/dbraw/zinc/00/11/63/495001163.db2.gz UJEMETQMPPRYGB-AWEZNQCLSA-N 0 0 365.437 3.388 10 0 FGAERN Cc1ccc(C2(C(=O)N3CCO[C@@H](c4nccs4)C3)CCOCC2)cc1 ZINC000110873212 495015734 /nfs/dbraw/zinc/01/57/34/495015734.db2.gz ROWKHDBVBBNWPH-QGZVFWFLSA-N 0 0 372.490 3.100 10 0 FGAERN O=C(CCCOc1ccccc1F)N1CCO[C@H](c2nccs2)C1 ZINC000110877028 495016706 /nfs/dbraw/zinc/01/67/06/495016706.db2.gz SSLFFFFDISKBTN-HNNXBMFYSA-N 0 0 350.415 3.041 10 0 FGAERN O=C(c1sccc1Br)N1CCO[C@H](c2nccs2)C1 ZINC000110878733 495017551 /nfs/dbraw/zinc/01/75/51/495017551.db2.gz JDRBOKCCMJNTGZ-VIFPVBQESA-N 0 0 359.270 3.181 10 0 FGAERN CCc1ccc(C(=O)CCC(=O)N2CCO[C@@H](c3nccs3)C2)cc1 ZINC000110879370 495017679 /nfs/dbraw/zinc/01/76/79/495017679.db2.gz XNMPJGXGFJLVFD-QGZVFWFLSA-N 0 0 358.463 3.269 10 0 FGAERN O=C(CCC(=O)N1CCO[C@@H](c2nccs2)C1)c1ccc(Cl)cc1 ZINC000110886465 495018265 /nfs/dbraw/zinc/01/82/65/495018265.db2.gz JRTXYEMWKRNGGT-OAHLLOKOSA-N 0 0 364.854 3.360 10 0 FGAERN CCn1c2ncccc2nc1[C@@H]1CCN(C(=O)NCc2cccc(F)c2)C1 ZINC000097151665 495025169 /nfs/dbraw/zinc/02/51/69/495025169.db2.gz BHFTUHFTNZPEGW-OAHLLOKOSA-N 0 0 367.428 3.289 10 0 FGAERN C[C@H](O)C1CCN(C(=O)[C@@H]2C[C@@H]2c2ccc(Br)cc2)CC1 ZINC000118729914 495028111 /nfs/dbraw/zinc/02/81/11/495028111.db2.gz XHAYHBDLVFGDGL-IUIKQTSFSA-N 0 0 352.272 3.172 10 0 FGAERN Cc1ccc2oc(N3CCN(C(=O)Nc4ccc(F)cn4)CC3)nc2c1 ZINC000122774825 495029787 /nfs/dbraw/zinc/02/97/87/495029787.db2.gz CECHAGDDBRUDAV-UHFFFAOYSA-N 0 0 355.373 3.024 10 0 FGAERN CCc1ccccc1NC(=O)N1CCN(C[C@H](O)c2ccccc2)CC1 ZINC000118794080 495036467 /nfs/dbraw/zinc/03/64/67/495036467.db2.gz RMCNZIOIPLEZNF-FQEVSTJZSA-N 0 0 353.466 3.132 10 0 FGAERN O=C(c1ccccc1Cc1ccccc1)N1CCO[C@H](Cn2cccn2)C1 ZINC000111083831 495037114 /nfs/dbraw/zinc/03/71/14/495037114.db2.gz KHLSEYKCFGXDRW-FQEVSTJZSA-N 0 0 361.445 3.015 10 0 FGAERN O=C(c1ccc(Oc2ccccc2)cc1)N1CCO[C@H](Cn2cccn2)C1 ZINC000111076741 495037151 /nfs/dbraw/zinc/03/71/51/495037151.db2.gz YZFLBFLPUGEQAZ-FQEVSTJZSA-N 0 0 363.417 3.217 10 0 FGAERN CC(C)CS(=O)(=O)CC(=O)N[C@@H](C)c1c(Cl)ccc(F)c1Cl ZINC000097699526 495042542 /nfs/dbraw/zinc/04/25/42/495042542.db2.gz KZSJCEXOYWIGRJ-VIFPVBQESA-N 0 0 370.273 3.381 10 0 FGAERN CC(C)COc1cccc(C(=O)N[C@H]2CCc3nc(C(C)C)nn3C2)c1 ZINC000133711910 495050190 /nfs/dbraw/zinc/05/01/90/495050190.db2.gz XAAQOFBNWZUHAA-INIZCTEOSA-N 0 0 356.470 3.181 10 0 FGAERN COCOc1ccc(OC)cc1CNC1(c2noc(C3CC3)n2)CCCC1 ZINC000118947634 495055613 /nfs/dbraw/zinc/05/56/13/495055613.db2.gz DIGIKOALYBHDLW-UHFFFAOYSA-N 0 0 373.453 3.497 10 0 FGAERN O=S(=O)(CC1CCOCC1)N[C@H]1CC2(CCCC2)Oc2ccccc21 ZINC000122956578 495059026 /nfs/dbraw/zinc/05/90/26/495059026.db2.gz SQHGCCGRXOIJCO-KRWDZBQOSA-N 0 0 365.495 3.169 10 0 FGAERN C[C@H](NC(=O)N[C@H]1CCC[C@@H]1Cc1ccccc1)c1nnc2n1CCCC2 ZINC000128268434 495070224 /nfs/dbraw/zinc/07/02/24/495070224.db2.gz ARRRTXAXXNLWBT-JQHSSLGASA-N 0 0 367.497 3.386 10 0 FGAERN Cc1ccc(NC(=O)[C@H](NC(=O)CC(C)C)C(C)C)c(Br)n1 ZINC000128272521 495071162 /nfs/dbraw/zinc/07/11/62/495071162.db2.gz YWUPLWSOLYJMBT-CQSZACIVSA-N 0 0 370.291 3.278 10 0 FGAERN CC(C)N(CCS(C)(=O)=O)C(=O)N[C@H](C)c1ccc2ccccc2c1 ZINC000128275535 495071994 /nfs/dbraw/zinc/07/19/94/495071994.db2.gz BMPHMIVEDLETBH-OAHLLOKOSA-N 0 0 362.495 3.365 10 0 FGAERN CCCC(=O)N[C@@H]1CCCN([C@@H](C)C(=O)Nc2ccc(Cl)cc2)C1 ZINC000101564968 495078210 /nfs/dbraw/zinc/07/82/10/495078210.db2.gz HGOBWKKIJJERRS-XJKSGUPXSA-N 0 0 351.878 3.048 10 0 FGAERN CNC(=O)c1cccc(CCNC(=O)N[C@H]2CCCc3cc(F)ccc32)c1 ZINC000128353211 495084218 /nfs/dbraw/zinc/08/42/18/495084218.db2.gz 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/nfs/dbraw/zinc/01/64/27/497016427.db2.gz FIMFOIYZLOWGAV-UHFFFAOYSA-N 0 0 369.124 3.403 10 0 FGAERN Cc1ccc(C(=O)N2CCC[C@@H](N(C)CC(=O)OC(C)(C)C)CC2)s1 ZINC000192161332 497019005 /nfs/dbraw/zinc/01/90/05/497019005.db2.gz AFIRRNBZZSQFCE-OAHLLOKOSA-N 0 0 366.527 3.325 10 0 FGAERN CCn1cc([C@H]2CN(C(=O)Nc3cccc([C@H](C)OC)c3)CCO2)cn1 ZINC000192197111 497028692 /nfs/dbraw/zinc/02/86/92/497028692.db2.gz XREXCQWCFAFXQR-KBXCAEBGSA-N 0 0 358.442 3.216 10 0 FGAERN CC[C@@H]1C[C@@H](C(=O)NC2C[C@H]3CC[C@@H](C2)N3C(=O)OC(C)(C)C)CCO1 ZINC000248529410 497031642 /nfs/dbraw/zinc/03/16/42/497031642.db2.gz DQNQQQFRMCPTPO-UCHQMPSGSA-N 0 0 366.502 3.238 10 0 FGAERN Cc1ccc2c(c1)[C@H](NC(=O)c1cccc3c1O[C@@H](C)C(=O)N3)[C@@H](C)C2 ZINC000248543287 497034511 /nfs/dbraw/zinc/03/45/11/497034511.db2.gz IQQWYRSZOUWPPV-ZJNRKIDTSA-N 0 0 350.418 3.378 10 0 FGAERN CCc1cnccc1C(=O)N1C[C@@H]2CC[C@H](NC(=O)OC(C)(C)C)[C@H]2C1 ZINC000248571583 497043985 /nfs/dbraw/zinc/04/39/85/497043985.db2.gz GFAFHGQXXNFURY-XIRDDKMYSA-N 0 0 359.470 3.019 10 0 FGAERN CCCC(=O)N[C@H]1CCCN(C(=O)c2cccc(Br)c2F)C1 ZINC000192249580 497048977 /nfs/dbraw/zinc/04/89/77/497048977.db2.gz OZCJYKHTVFKCOW-NSHDSACASA-N 0 0 371.250 3.109 10 0 FGAERN CC(C)(C)OC(=O)N[C@@H]1CC[C@@H]2CN(C(=O)c3cccnc3Cl)C[C@@H]12 ZINC000248591455 497050037 /nfs/dbraw/zinc/05/00/37/497050037.db2.gz LDHOTGFPKCCSJX-MRVWCRGKSA-N 0 0 365.861 3.110 10 0 FGAERN C[C@H]1C(=O)NCCCN1C(=O)C1(c2ccc(Cl)c(Cl)c2)CCC1 ZINC000189234480 497054217 /nfs/dbraw/zinc/05/42/17/497054217.db2.gz PGXKUZVXZIWXSO-NSHDSACASA-N 0 0 355.265 3.152 10 0 FGAERN C[C@@H]1C(=O)NCCCN1C(=O)C1(c2ccc(Cl)c(Cl)c2)CCC1 ZINC000189234463 497054493 /nfs/dbraw/zinc/05/44/93/497054493.db2.gz PGXKUZVXZIWXSO-LLVKDONJSA-N 0 0 355.265 3.152 10 0 FGAERN CCO[C@@H]1C[C@H](NC(=O)C[C@H](C)c2ccc(OC)cc2)C12CCOCC2 ZINC000248623999 497061484 /nfs/dbraw/zinc/06/14/84/497061484.db2.gz CAZQLRLMWAGDQX-ZYSHUDEJSA-N 0 0 361.482 3.279 10 0 FGAERN CCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(c2ccncc2)CC1 ZINC000192291232 497064597 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CCO[C@@H]1C[C@@H](NC(=O)N[C@H](CC)c2c(C)noc2C)C12CCOCC2 ZINC000248675600 497078299 /nfs/dbraw/zinc/07/82/99/497078299.db2.gz CSPRQYDQOXDIQM-BZUAXINKSA-N 0 0 365.474 3.016 10 0 FGAERN Cc1[nH]c(-c2ccccc2Oc2ccc(S(C)(=O)=O)cc2)cc1C(N)=O ZINC000226077253 497080731 /nfs/dbraw/zinc/08/07/31/497080731.db2.gz CDZPHNUIOKEJEL-UHFFFAOYSA-N 0 0 370.430 3.285 10 0 FGAERN C[C@H]1OCC[C@@]1(O)CNC(=O)OCC1c2ccccc2-c2ccccc21 ZINC000227189009 497088305 /nfs/dbraw/zinc/08/83/05/497088305.db2.gz PJUYPHJQAOABFF-SPLOXXLWSA-N 0 0 353.418 3.065 10 0 FGAERN CO[C@H]1C[C@H](c2nc(C)no2)N(CCOc2cccc3ccccc32)C1 ZINC000189346487 497089462 /nfs/dbraw/zinc/08/94/62/497089462.db2.gz UWDAKTKCIJQZEX-FUHWJXTLSA-N 0 0 353.422 3.372 10 0 FGAERN COC(=O)[C@@H]1CCCN(C(=O)c2ccc(Cl)c(Br)c2)C1 ZINC000228987828 497096409 /nfs/dbraw/zinc/09/64/09/497096409.db2.gz VWLWNOQJYLYAAJ-SNVBAGLBSA-N 0 0 360.635 3.128 10 0 FGAERN CC(C)[C@@H]1CCc2ccccc2[C@H]1NC(=O)N1CC[C@@H](N2CCOCC2)C1 ZINC000248805012 497107245 /nfs/dbraw/zinc/10/72/45/497107245.db2.gz JZOGMEQYOKIJQE-DYXWJJEUSA-N 0 0 371.525 3.062 10 0 FGAERN COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1cc2cc(OC)ccc2[nH]1 ZINC000248827170 497111861 /nfs/dbraw/zinc/11/18/61/497111861.db2.gz KOPRKGNKPYTMIK-IGNZVWTISA-N 0 0 356.422 3.123 10 0 FGAERN C[C@H]1S[C@H](c2nsc(I)n2)CS[C@H]1C ZINC000235386037 497113114 /nfs/dbraw/zinc/11/31/14/497113114.db2.gz UZVISMJSAOAAAS-JKUQZMGJSA-N 0 0 358.295 3.441 10 0 FGAERN CCOC(=O)[C@H](c1cccc(Cl)c1)N1CCO[C@@H](c2nccs2)C1 ZINC000248878576 497124090 /nfs/dbraw/zinc/12/40/90/497124090.db2.gz OQTIFLSUJQOPJV-CABCVRRESA-N 0 0 366.870 3.474 10 0 FGAERN CCn1cc([C@@H]2CN(Cc3ccc(OC[C@H]4CCCO4)cc3)CCO2)cn1 ZINC000248885729 497126244 /nfs/dbraw/zinc/12/62/44/497126244.db2.gz QUFOXTYIMXOZRS-RTWAWAEBSA-N 0 0 371.481 3.034 10 0 FGAERN CCOc1c(Cl)cccc1CC(=O)N1CC[C@@]2(O)CCCC[C@@H]2C1 ZINC000189503864 497141662 /nfs/dbraw/zinc/14/16/62/497141662.db2.gz CBSSSFDBOVLFPD-BEFAXECRSA-N 0 0 351.874 3.435 10 0 FGAERN Cc1nc(Cl)ccc1NC(=O)C(=O)N[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000192543854 497144657 /nfs/dbraw/zinc/14/46/57/497144657.db2.gz NEEFIPINZKBKQT-VHSXEESVSA-N 0 0 363.767 3.219 10 0 FGAERN COc1ccccc1N1CC[C@@H](N2CCC[C@@H]2c2noc(C(C)C)n2)C1=O ZINC000192562066 497150283 /nfs/dbraw/zinc/15/02/83/497150283.db2.gz RIIVQOAJMIJYKL-HZPDHXFCSA-N 0 0 370.453 3.144 10 0 FGAERN CCN(C(C)=O)c1nc(CN[C@@H](C)c2ccc(OC)c(OC)c2)cs1 ZINC000236815816 497150321 /nfs/dbraw/zinc/15/03/21/497150321.db2.gz QANBJONDUOLPJY-LBPRGKRZSA-N 0 0 363.483 3.384 10 0 FGAERN O=C([C@H](O)Cc1cccc(C(F)(F)F)c1)N1CCCC[C@H]1c1cn[nH]c1 ZINC000189551892 497160375 /nfs/dbraw/zinc/16/03/75/497160375.db2.gz CLFFNAVDZKEBRI-JKSUJKDBSA-N 0 0 367.371 3.086 10 0 FGAERN COc1ccc(OC)c([C@@H]2C[C@@H]2C(=O)N2CCC[C@H]2Cn2ccnc2C)c1 ZINC000249099614 497166644 /nfs/dbraw/zinc/16/66/44/497166644.db2.gz WAOCKZAEAXSAAW-IEZWGBDMSA-N 0 0 369.465 3.003 10 0 FGAERN C[C@@H](NC(=O)NCCCC(=O)NC1CC1)c1ccc(OC(F)(F)F)cc1 ZINC000192641163 497172639 /nfs/dbraw/zinc/17/26/39/497172639.db2.gz GNLWXBYRLRSBKY-LLVKDONJSA-N 0 0 373.375 3.004 10 0 FGAERN C[C@@H]1C[C@@H](CC(=O)N2CCC[C@@H]([N@H+](C)CC(=O)[O-])CC2)CC(C)(C)C1 ZINC000249175519 497177580 /nfs/dbraw/zinc/17/75/80/497177580.db2.gz YWNKXEOROCXYSY-IXDOHACOSA-N 0 0 352.519 3.236 10 0 FGAERN COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)CCC(=O)c1ccc(C)cc1 ZINC000249319138 497191174 /nfs/dbraw/zinc/19/11/74/497191174.db2.gz KRZZLCVDILSYOU-BZSNNMDCSA-N 0 0 357.450 3.291 10 0 FGAERN COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)CCC(=O)c1ccc(C)cc1 ZINC000249319140 497191664 /nfs/dbraw/zinc/19/16/64/497191664.db2.gz KRZZLCVDILSYOU-KSZLIROESA-N 0 0 357.450 3.291 10 0 FGAERN COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1cc2ccccc2nc1C ZINC000249359777 497194494 /nfs/dbraw/zinc/19/44/94/497194494.db2.gz ZZDFDQAQFDDZFQ-IPELMVKDSA-N 0 0 352.434 3.490 10 0 FGAERN Cc1c(NC(=O)[C@@H](C)NC(=O)Nc2ccccc2)cnn1C1CCCC1 ZINC000192732268 497199235 /nfs/dbraw/zinc/19/92/35/497199235.db2.gz HDAPUMNSYLQBOT-CYBMUJFWSA-N 0 0 355.442 3.455 10 0 FGAERN Cc1nccn1C[C@@H]1CCCN1c1ccc2nnc(-c3ccsc3)n2n1 ZINC000274929980 497200704 /nfs/dbraw/zinc/20/07/04/497200704.db2.gz QQSMROOHDDNCCX-HNNXBMFYSA-N 0 0 365.466 3.027 10 0 FGAERN CCN(C[C@H](O)C(F)(F)F)C(=O)N[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000249492543 497211447 /nfs/dbraw/zinc/21/14/47/497211447.db2.gz FSDBMKDMAHXZEP-UTLUCORTSA-N 0 0 350.303 3.062 10 0 FGAERN O[C@@H](CN1CCCC[C@H]1c1nnc2n1CCCC2)c1c(F)cccc1F ZINC000249866034 497253442 /nfs/dbraw/zinc/25/34/42/497253442.db2.gz HYVLGAGJUGFJNK-HOTGVXAUSA-N 0 0 362.424 3.153 10 0 FGAERN Cc1csc([C@@H]2CN([C@H](C)C(=O)N3c4ccccc4C[C@H]3C)CCO2)n1 ZINC000249867599 497253511 /nfs/dbraw/zinc/25/35/11/497253511.db2.gz IJODMLBGPONAIZ-RKVPGOIHSA-N 0 0 371.506 3.191 10 0 FGAERN Cc1nc([C@@H]2CCCN2CC(=O)NCCO[C@@H]2CCCC[C@@H]2C)cs1 ZINC000189814088 497253685 /nfs/dbraw/zinc/25/36/85/497253685.db2.gz CXROMHMANWSHDT-JCGIZDLHSA-N 0 0 365.543 3.300 10 0 FGAERN CC(C)CCNC(=O)[C@H](C)N1CCO[C@@H](c2nc(C(C)(C)C)cs2)C1 ZINC000249907660 497256411 /nfs/dbraw/zinc/25/64/11/497256411.db2.gz VFVMBMFNSNOIPV-LSDHHAIUSA-N 0 0 367.559 3.365 10 0 FGAERN CCc1ccc(NC(=O)[C@H](C)N2CCO[C@@H](c3nc(C)cs3)C2)cc1 ZINC000249905191 497256750 /nfs/dbraw/zinc/25/67/50/497256750.db2.gz USLCFKOMRAJIHC-WMLDXEAASA-N 0 0 359.495 3.414 10 0 FGAERN COc1c(CNc2nnc(SCc3ccccc3)s2)c(C)nn1C ZINC000192959974 497260729 /nfs/dbraw/zinc/26/07/29/497260729.db2.gz RNDWCWIKJOXIOA-UHFFFAOYSA-N 0 0 361.496 3.493 10 0 FGAERN CC[C@@H]1[C@H](C)CCN1C(=O)NC[C@@H](c1cccs1)N1CCO[C@@H](C)C1 ZINC000251436895 497272847 /nfs/dbraw/zinc/27/28/47/497272847.db2.gz CIWRUNPZEQXBME-TWMKSMIVSA-N 0 0 365.543 3.340 10 0 FGAERN Cc1cc(NC(=O)N[C@H]2CCS(=O)(=O)c3ccccc32)ccc1N(C)C ZINC000193030204 497280829 /nfs/dbraw/zinc/28/08/29/497280829.db2.gz GRXBUDYGNHHRRN-INIZCTEOSA-N 0 0 373.478 3.101 10 0 FGAERN Cc1cccc(C)c1-n1nnnc1CN[C@H](C)c1cccc(-n2ccnc2)c1 ZINC000189913590 497291157 /nfs/dbraw/zinc/29/11/57/497291157.db2.gz ZLKSWXABKRHXTQ-QGZVFWFLSA-N 0 0 373.464 3.316 10 0 FGAERN 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ZINC000301703871 498231390 /nfs/dbraw/zinc/23/13/90/498231390.db2.gz FQZLWXYFXCCQPD-CYBMUJFWSA-N 0 0 354.433 3.383 10 0 FGAERN O=S(=O)(c1ccccc1NCCc1nc2cc(F)ccc2[nH]1)C(F)F ZINC000301743893 498248873 /nfs/dbraw/zinc/24/88/73/498248873.db2.gz ZLOZLTIPRWNHFE-UHFFFAOYSA-N 0 0 369.368 3.353 10 0 FGAERN C[C@@H]1CCCN(c2cc(N3CCO[C@@]4(CCc5ccccc54)C3)ncn2)C1 ZINC000301764116 498254940 /nfs/dbraw/zinc/25/49/40/498254940.db2.gz FJNYWYBJDZWZDG-VGSWGCGISA-N 0 0 364.493 3.391 10 0 FGAERN COCc1cc(NCCC(=O)Nc2cccc(C)n2)nc(C(C)(C)C)n1 ZINC000301776959 498260437 /nfs/dbraw/zinc/26/04/37/498260437.db2.gz GXFAQUGKDMPLRV-UHFFFAOYSA-N 0 0 357.458 3.065 10 0 FGAERN CCOC(=O)[C@@]1(C)CCN(c2nc(-c3ccncc3)nc3ccccc32)C1 ZINC000301786409 498264836 /nfs/dbraw/zinc/26/48/36/498264836.db2.gz VEBBWZLQKQJNPQ-NRFANRHFSA-N 0 0 362.433 3.471 10 0 FGAERN C[C@@H]1CN(c2nn3cc(C(C)(C)C)nc3s2)CCN1CC(F)(F)F ZINC000301853332 498294288 /nfs/dbraw/zinc/29/42/88/498294288.db2.gz CAOFWANFDPZRPY-SNVBAGLBSA-N 0 0 361.437 3.161 10 0 FGAERN Cc1ccn(-c2ccc(N[C@H](C)c3cnn(Cc4ccccc4)c3)nn2)n1 ZINC000301873375 498305115 /nfs/dbraw/zinc/30/51/15/498305115.db2.gz XKLRQPLQVDFPNQ-MRXNPFEDSA-N 0 0 359.437 3.389 10 0 FGAERN CCc1nc2sccc2c(NCc2ccnc(O[C@H]3CCOC3)c2)n1 ZINC000301897063 498318392 /nfs/dbraw/zinc/31/83/92/498318392.db2.gz QVXGJUVECGYNBG-ZDUSSCGKSA-N 0 0 356.451 3.429 10 0 FGAERN COc1ncc(Cl)c(N2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)n1 ZINC000301952409 498343435 /nfs/dbraw/zinc/34/34/35/498343435.db2.gz HAVTZPPIFHGQNV-SNVBAGLBSA-N 0 0 374.750 3.210 10 0 FGAERN COC(=O)C(C)(C)[C@@H]1CCCN(c2cc(N3CCC[C@@H](C)C3)ncn2)C1 ZINC000301965284 498347506 /nfs/dbraw/zinc/34/75/06/498347506.db2.gz WUDZFRRATYLCGV-HZPDHXFCSA-N 0 0 360.502 3.129 10 0 FGAERN CCOC(=O)c1cnc2c(C)cccc2c1NCc1ccnc2ccnn21 ZINC000302037800 498379595 /nfs/dbraw/zinc/37/95/95/498379595.db2.gz KLOZAIZPIWFLHR-UHFFFAOYSA-N 0 0 361.405 3.375 10 0 FGAERN FC(F)(F)c1cc(NCc2ccnc3ccnn32)nc(-c2ccccn2)n1 ZINC000302044334 498382623 /nfs/dbraw/zinc/38/26/23/498382623.db2.gz MKKMKYQTCXMVJD-UHFFFAOYSA-N 0 0 371.326 3.212 10 0 FGAERN COC(=O)[C@@]12CCC[C@@H]1CN(c1nc3ccccc3nc1N1CCCC1)C2 ZINC000302199776 498439323 /nfs/dbraw/zinc/43/93/23/498439323.db2.gz UTDJVXXKUMFKMT-QVKFZJNVSA-N 0 0 366.465 3.010 10 0 FGAERN CNc1c(Cl)ncnc1NC[C@H](c1cccs1)N1CCO[C@@H](C)C1 ZINC000302215466 498447511 /nfs/dbraw/zinc/44/75/11/498447511.db2.gz HJPHNBRMVNUSJV-NWDGAFQWSA-N 0 0 367.906 3.107 10 0 FGAERN COC(=O)CSc1cncc(N2CCC(c3ccccc3C)CC2)n1 ZINC000302237685 498455822 /nfs/dbraw/zinc/45/58/22/498455822.db2.gz WHJCOPQAEJRWPT-UHFFFAOYSA-N 0 0 357.479 3.434 10 0 FGAERN Cc1ccc(CN(C)c2ncnc3ccc(S(C)(=O)=O)cc32)c(C)c1 ZINC000302652811 498524585 /nfs/dbraw/zinc/52/45/85/498524585.db2.gz GVRFXYDUJRDOBY-UHFFFAOYSA-N 0 0 355.463 3.287 10 0 FGAERN O=S(=O)(c1ccc(N[C@H]2CCCc3c(O)cccc32)nc1)N1CCCC1 ZINC000302732150 498550589 /nfs/dbraw/zinc/55/05/89/498550589.db2.gz UBVRLLXTULTARL-KRWDZBQOSA-N 0 0 373.478 3.061 10 0 FGAERN C[C@H]1CC(=O)Oc2cc(Oc3ccc4nnc(C(F)(F)F)n4n3)ccc21 ZINC000302798590 498580302 /nfs/dbraw/zinc/58/03/02/498580302.db2.gz BCQNQIFUROJZQW-QMMMGPOBSA-N 0 0 364.283 3.348 10 0 FGAERN C[C@@H]1CC(=O)Oc2cc(Oc3ccc4nnc(C(F)(F)F)n4n3)ccc21 ZINC000302798588 498580578 /nfs/dbraw/zinc/58/05/78/498580578.db2.gz BCQNQIFUROJZQW-MRVPVSSYSA-N 0 0 364.283 3.348 10 0 FGAERN CC(=O)N1CCCC[C@H]1c1ccc(C(=O)N(C)Cc2ccoc2C)n1C ZINC000328617224 498875863 /nfs/dbraw/zinc/87/58/63/498875863.db2.gz CMQDDBTUWDSDOL-SFHVURJKSA-N 0 0 357.454 3.272 10 0 FGAERN CC(C)c1noc([C@H](NCc2cccc3c2OCO3)C2CCOCC2)n1 ZINC000328617800 498877583 /nfs/dbraw/zinc/87/75/83/498877583.db2.gz DBCAWXMURAWFDD-MRXNPFEDSA-N 0 0 359.426 3.179 10 0 FGAERN O=C(c1cccn1C1CC1)N1CC[C@H](Oc2cccnc2N2CCCC2)C1 ZINC000328619493 498877895 /nfs/dbraw/zinc/87/78/95/498877895.db2.gz FWULIPJOIWYCAN-KRWDZBQOSA-N 0 0 366.465 3.112 10 0 FGAERN COc1cc(C)nc(CN[C@H](c2nc(C(C)C)no2)C2CCOCC2)c1 ZINC000328638363 498885265 /nfs/dbraw/zinc/88/52/65/498885265.db2.gz WHNWTTIVFGVZHK-KRWDZBQOSA-N 0 0 360.458 3.163 10 0 FGAERN CC(C)c1nnc(CN(C)C[C@H]2CCc3nc(C(F)(F)F)cn3C2)o1 ZINC000328643582 498886168 /nfs/dbraw/zinc/88/61/68/498886168.db2.gz RLPCRHGOZGEQQW-LLVKDONJSA-N 0 0 357.380 3.103 10 0 FGAERN COc1nc(N2CCC(c3nccs3)CC2)ncc1Br ZINC000367972189 499250731 /nfs/dbraw/zinc/25/07/31/499250731.db2.gz JOCFUHBDTQOLEG-UHFFFAOYSA-N 0 0 355.261 3.088 10 0 FGAERN CC[C@@H]1C[C@@H](CC(=O)N2CCCC[C@@H]2c2nnc3n2CCCC3)CCO1 ZINC000378614397 499537821 /nfs/dbraw/zinc/53/78/21/499537821.db2.gz FICFBSTZISAPLE-GVDBMIGSSA-N 0 0 360.502 3.263 10 0 FGAERN Cc1cc(Br)ccc1SCC(=O)N1CCC[C@@H](O)[C@H]1C ZINC000384782668 499547734 /nfs/dbraw/zinc/54/77/34/499547734.db2.gz UHGWUGJTAKDEBO-DGCLKSJQSA-N 0 0 358.301 3.221 10 0 FGAERN C[C@H](COCc1ccccc1)NC(=O)c1ccc(Br)cc1O ZINC000390782632 499555513 /nfs/dbraw/zinc/55/55/13/499555513.db2.gz LDJCZPONOPTZBE-GFCCVEGCSA-N 0 0 364.239 3.490 10 0 FGAERN O=C(c1cccc(Br)c1Cl)N1C[C@@H]2CC[C@H](O)C[C@@H]2C1 ZINC000398720197 499567929 /nfs/dbraw/zinc/56/79/29/499567929.db2.gz YKTRUTFZEVBAAQ-AXFHLTTASA-N 0 0 358.663 3.336 10 0 FGAERN O=C(c1ccc(Cl)cc1Br)N1C[C@@H]2CC[C@H](O)C[C@H]2C1 ZINC000398719470 499567983 /nfs/dbraw/zinc/56/79/83/499567983.db2.gz YEVNELDQIYGZPX-NHCYSSNCSA-N 0 0 358.663 3.336 10 0 FGAERN O=C(c1cccc(Br)c1Cl)N1C[C@@H]2CC[C@H](O)C[C@H]2C1 ZINC000398720199 499568024 /nfs/dbraw/zinc/56/80/24/499568024.db2.gz YKTRUTFZEVBAAQ-DCAQKATOSA-N 0 0 358.663 3.336 10 0 FGAERN COC(=O)[C@@H](NC(=O)c1cscc1Br)c1ccccc1 ZINC000404831996 499570574 /nfs/dbraw/zinc/57/05/74/499570574.db2.gz IXWIOGLCIZPOBZ-LBPRGKRZSA-N 0 0 354.225 3.155 10 0 FGAERN O=S(=O)(c1ccc(Cl)c(Br)c1)N1C[C@H]2CCC[C@H]21 ZINC000428396304 500505741 /nfs/dbraw/zinc/50/57/41/500505741.db2.gz CLMGTKHKELBAPK-PRHODGIISA-N 0 0 350.665 3.276 10 0 FGAERN CC(C)C(=O)N[C@@H]1CCCN(C(=O)CCCc2ccc(Cl)cc2)C1 ZINC000505263035 502879046 /nfs/dbraw/zinc/87/90/46/502879046.db2.gz ZOXVWLROAHIEFP-QGZVFWFLSA-N 0 0 350.890 3.426 10 0 FGAERN CC(C)c1ccc2c(c1)[C@@]1(C[C@H]1C(=O)N1CCn3cnnc3[C@H]1C)CCO2 ZINC000583620223 506880454 /nfs/dbraw/zinc/88/04/54/506880454.db2.gz NTRLEMUHIYCERN-FNXXIHLHSA-N 0 0 366.465 3.045 10 0 FGAERN O=c1[nH]c2cnc(-c3cnc4ccccn43)nc2n1Cc1ccccc1F ZINC000584661221 507438589 /nfs/dbraw/zinc/43/85/89/507438589.db2.gz XNLALCSCBJNKNY-UHFFFAOYSA-N 0 0 360.352 3.034 10 0 FGAERN CC(C)c1noc([C@@H](NC(=O)NCCC2=CCCC2)C2CCOCC2)n1 ZINC000275714432 519908456 /nfs/dbraw/zinc/90/84/56/519908456.db2.gz SNJPEOJSXJZXQX-INIZCTEOSA-N 0 0 362.474 3.460 10 0 FGAERN CC(C)(C)OC(=O)N1CCN(c2nc(Cl)nc3ccsc32)CC1 ZINC000095081257 534841332 /nfs/dbraw/zinc/84/13/32/534841332.db2.gz UJRGEDJWIXOVOP-UHFFFAOYSA-N 0 0 354.863 3.402 10 0 FGAERN CC(=O)c1ccc(SCC(=O)N2CCN(c3ccccc3)CC2)c(F)c1 ZINC000027066129 534877534 /nfs/dbraw/zinc/87/75/34/534877534.db2.gz IQQMWBKHOOFQJH-UHFFFAOYSA-N 0 0 372.465 3.469 10 0 FGAERN Cc1cn2nc(N[C@H](c3nc(C(C)C)no3)C3CCOCC3)sc2n1 ZINC000275479244 525955314 /nfs/dbraw/zinc/95/53/14/525955314.db2.gz VHOOAVMNEGTTOG-LBPRGKRZSA-N 0 0 362.459 3.185 10 0 FGAERN Cc1nc(NC(=O)N[C@@H](c2nc(C(C)C)no2)C2CCOCC2)oc1C ZINC000275222979 526984659 /nfs/dbraw/zinc/98/46/59/526984659.db2.gz AOORSASHWGONNM-CYBMUJFWSA-N 0 0 363.418 3.087 10 0 FGAERN Nc1nnc(CNC(=O)c2cc(-c3ccccc3)nc3ccccc32)s1 ZINC000020201606 527577295 /nfs/dbraw/zinc/57/72/95/527577295.db2.gz AAAJAQXWNUNVOT-UHFFFAOYSA-N 0 0 361.430 3.266 10 0 FGAERN O=C(OCc1ccccc1)[C@@H](Cc1ccccc1)CS(=O)(=O)Cl ZINC000138605205 534974493 /nfs/dbraw/zinc/97/44/93/534974493.db2.gz OWHSSAXHAVUEHX-INIZCTEOSA-N 0 0 352.839 3.157 10 0 FGAERN CCNC(=O)N1CCN(c2nc(-c3ccsc3)nc3ccccc32)CC1 ZINC000096967181 535791351 /nfs/dbraw/zinc/79/13/51/535791351.db2.gz RPJJSQSAMWNXMT-UHFFFAOYSA-N 0 0 367.478 3.210 10 0 FGAERN O=C(N[C@@H](c1nnc(N2CCCCC2)o1)c1ccccc1)C1CCCC1 ZINC000065209564 570819654 /nfs/dbraw/zinc/81/96/54/570819654.db2.gz AQRRDMCLDFPNMZ-QGZVFWFLSA-N 0 0 354.454 3.456 10 0 FGAERN C[C@@H](NC(=O)c1nc(Cl)ccc1Cl)c1ccc(S(C)(=O)=O)cc1 ZINC000015198806 695616836 /nfs/dbraw/zinc/61/68/36/695616836.db2.gz SDESQYRHDZEGAG-SECBINFHSA-N 0 0 373.261 3.283 10 0 FGAERN Cc1ccc([C@H](C)NC(=O)CN2C(=S)N=NC2c2cccc(C)c2)o1 ZINC000023306214 695660874 /nfs/dbraw/zinc/66/08/74/695660874.db2.gz KCKZWRNXPNFMSD-ZDUSSCGKSA-N 0 0 356.451 3.321 10 0 FGAERN CSCC[C@H]1NC(=S)N([C@H](C)c2cccc(Br)c2)C1=O ZINC000028961578 695707603 /nfs/dbraw/zinc/70/76/03/695707603.db2.gz IYDNFOSFFPTHEG-BXKDBHETSA-N 0 0 373.341 3.349 10 0 FGAERN Cc1nc(C2CCN(S(=O)(=O)c3ccc(Cl)nc3)CC2)sc1C ZINC000040666080 695758438 /nfs/dbraw/zinc/75/84/38/695758438.db2.gz KTMOTKZCPGOVEU-UHFFFAOYSA-N 0 0 371.915 3.377 10 0 FGAERN Cc1ccc([C@@H](C)NC(=O)c2cccc(CN3C(=O)CSC3=O)c2)o1 ZINC000043632372 695795375 /nfs/dbraw/zinc/79/53/75/695795375.db2.gz HUIIRBWENIUSAN-GFCCVEGCSA-N 0 0 358.419 3.274 10 0 FGAERN C[C@H](NC(=O)N[C@H](CN1CCOCC1)c1ccccc1)c1cccs1 ZINC000045867205 695828012 /nfs/dbraw/zinc/82/80/12/695828012.db2.gz FDRUNRHWNVXWEU-DOTOQJQBSA-N 0 0 359.495 3.182 10 0 FGAERN C[C@@H](OC(=O)Cn1c(=O)cnc2ccccc21)c1ccc(F)c(Cl)c1 ZINC000050056146 695899757 /nfs/dbraw/zinc/89/97/57/695899757.db2.gz ZRNKBVCXUPTPDQ-LLVKDONJSA-N 0 0 360.772 3.493 10 0 FGAERN COc1ccc([C@@H](C)NC(=O)c2c(Cl)nc3ccccn32)cc1OC ZINC000052513634 695923425 /nfs/dbraw/zinc/92/34/25/695923425.db2.gz WNVBHZCNOAXJLP-LLVKDONJSA-N 0 0 359.813 3.496 10 0 FGAERN Cc1ccc(-n2cnnc2SCC(=O)O[C@@H](C)c2cccnc2)cc1 ZINC000073837059 695973574 /nfs/dbraw/zinc/97/35/74/695973574.db2.gz LYPRUIJVWLJQCU-AWEZNQCLSA-N 0 0 354.435 3.367 10 0 FGAERN CN(Cc1ccc(Cl)nc1)C(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC000073856925 695974299 /nfs/dbraw/zinc/97/42/99/695974299.db2.gz UBCCQYOTSNZVMD-AWEZNQCLSA-N 0 0 367.877 3.341 10 0 FGAERN CC[C@@H](NC(=O)N1CCC[C@@H]1CNC(=O)OC(C)(C)C)c1nccs1 ZINC000074365823 700192010 /nfs/dbraw/zinc/19/20/10/700192010.db2.gz RCUYJBNFMYHWGD-CHWSQXEVSA-N 0 0 368.503 3.293 10 0 FGAERN C[C@H]1CN(c2ccc(NS(=O)(=O)/C=C/c3ccccc3)cc2)CCO1 ZINC000076557815 700235052 /nfs/dbraw/zinc/23/50/52/700235052.db2.gz ORXUEYGUOZENFG-UKYUDJEDSA-N 0 0 358.463 3.324 10 0 FGAERN 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CC(=O)c1ccc(NC(=O)CNC2(c3noc(C4CC4)n3)CCCC2)cc1 ZINC000173713331 495659334 /nfs/dbraw/zinc/65/93/34/495659334.db2.gz CXJZTIGWUWMVHD-UHFFFAOYSA-N 0 0 368.437 3.147 10 0 FGAERN CC(C)(C)N(Cc1ccccc1)C(=O)CN1CCCC[C@@H]1c1nc[nH]n1 ZINC000182677123 495660822 /nfs/dbraw/zinc/66/08/22/495660822.db2.gz VXBJABIVRVUNAL-QGZVFWFLSA-N 0 0 355.486 3.159 10 0 FGAERN Cc1csc([C@H]2CCCN(S(=O)(=O)Cc3ccc(F)cc3)C2)n1 ZINC000173721152 495662591 /nfs/dbraw/zinc/66/25/91/495662591.db2.gz VAIWLZRRSIMGKO-AWEZNQCLSA-N 0 0 354.472 3.300 10 0 FGAERN CCc1nc(C2(NC(=O)Nc3cccc(NC(C)=O)c3C)CCCC2)no1 ZINC000176485112 495667459 /nfs/dbraw/zinc/66/74/59/495667459.db2.gz YBCYZXQKUPEKTF-UHFFFAOYSA-N 0 0 371.441 3.490 10 0 FGAERN CC(C)n1ccnc1CN1C[C@@H](C(=O)N2CCCCC2)Oc2ccccc21 ZINC000170957914 495667474 /nfs/dbraw/zinc/66/74/74/495667474.db2.gz GJMLFZHCCXOLIV-IBGZPJMESA-N 0 0 368.481 3.244 10 0 FGAERN Cc1nccn1C[C@@H]1CCCN1S(=O)(=O)c1ccccc1C(F)(F)F ZINC000173744546 495673331 /nfs/dbraw/zinc/67/33/31/495673331.db2.gz 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FGAERN Cn1nccc1C1CCN(C(=O)c2oc3ccccc3c2C[NH+](C)C)CC1 ZINC000174030708 495796142 /nfs/dbraw/zinc/79/61/42/495796142.db2.gz YWBNGARFFIBMPB-UHFFFAOYSA-N 0 0 366.465 3.248 10 0 FGAERN CCc1ccc([C@H](C)NC(=O)NCc2c(=O)[nH]nc(CC)c2CC)cc1 ZINC000155000430 495798903 /nfs/dbraw/zinc/79/89/03/495798903.db2.gz QHYOFPSUCUHSNI-ZDUSSCGKSA-N 0 0 356.470 3.018 10 0 FGAERN CCc1nnsc1C(=O)N1C[C@@H](O)C[C@H]1c1cccc(C(F)(F)F)c1 ZINC000179954489 495799329 /nfs/dbraw/zinc/79/93/29/495799329.db2.gz BIAWWMGFSBCPLS-AAEUAGOBSA-N 0 0 371.384 3.067 10 0 FGAERN C[C@@H](Oc1ccccc1NC(=O)NC[C@H]1CN(C)CCO1)c1ccccc1 ZINC000151310342 495801195 /nfs/dbraw/zinc/80/11/95/495801195.db2.gz PVEKFLYEECNLCV-AEFFLSMTSA-N 0 0 369.465 3.279 10 0 FGAERN C[C@@H]1CCC[C@@H]1CC(=O)N(C)C[C@@H](c1cccs1)N1CCOCC1 ZINC000185971620 495804183 /nfs/dbraw/zinc/80/41/83/495804183.db2.gz KYNMWNZWTHQJDE-ZACQAIPSSA-N 0 0 350.528 3.406 10 0 FGAERN C[C@@H](NC(=O)Nc1ccccc1)C(=O)N1C[C@H](C)CN(C)c2ccccc21 ZINC000174059484 495805071 /nfs/dbraw/zinc/80/50/71/495805071.db2.gz DBCGPQFZFAGTAA-HZPDHXFCSA-N 0 0 366.465 3.316 10 0 FGAERN O=C(C[C@@H]1CCCCO1)N1C[C@H](O)C[C@H]1c1cccc(C(F)(F)F)c1 ZINC000179970112 495805429 /nfs/dbraw/zinc/80/54/29/495805429.db2.gz QFQSBSUAMKYTKI-PMPSAXMXSA-N 0 0 357.372 3.299 10 0 FGAERN CC(C)c1nc([C@@H]2CCCN2C(=O)Nc2ccc3c(c2)CCC(=O)N3)no1 ZINC000176839255 495806161 /nfs/dbraw/zinc/80/61/61/495806161.db2.gz VQTOGCOMRARZNW-HNNXBMFYSA-N 0 0 369.425 3.447 10 0 FGAERN CCn1cnnc1[C@@H]1CCCN(C(=O)Nc2cccc(-c3cc[nH]n3)c2)C1 ZINC000185977067 495806262 /nfs/dbraw/zinc/80/62/62/495806262.db2.gz FJFGFBGGAHSNIB-OAHLLOKOSA-N 0 0 365.441 3.100 10 0 FGAERN Cc1nccn1C[C@@H]1CCCN1C(=O)Nc1cccc(NC(=O)C2CC2)c1 ZINC000176840494 495806566 /nfs/dbraw/zinc/80/65/66/495806566.db2.gz PPBMLFWSHNEZLA-SFHVURJKSA-N 0 0 367.453 3.237 10 0 FGAERN O=C(c1nn(-c2ccccc2)c2c1CCC2)N1CC[C@]2(O)CCCC[C@H]2C1 ZINC000151346073 495810434 /nfs/dbraw/zinc/81/04/34/495810434.db2.gz ALRPDAQNTDYLMK-KSFYIVLOSA-N 0 0 365.477 3.128 10 0 FGAERN C[C@@H]1CN(C(=O)c2c(F)cccc2I)CCS1 ZINC000155046893 495815404 /nfs/dbraw/zinc/81/54/04/495815404.db2.gz DFLIUDDYEFFSCT-MRVPVSSYSA-N 0 0 365.211 3.008 10 0 FGAERN COc1cc(Br)ccc1C(=O)N1CC[C@]2(O)CCCC[C@H]2C1 ZINC000151363419 495816694 /nfs/dbraw/zinc/81/66/94/495816694.db2.gz KWLJHVSNYACLTL-YVEFUNNKSA-N 0 0 368.271 3.225 10 0 FGAERN Cc1nnc([C@H]2CN(CCCOc3ccc(C(C)(C)C)cc3)CCO2)[nH]1 ZINC000174097785 495819330 /nfs/dbraw/zinc/81/93/30/495819330.db2.gz MQGIOZVRFGGGGT-GOSISDBHSA-N 0 0 358.486 3.253 10 0 FGAERN C[C@H](NC(=O)[C@H](C)N1CCC(C(=O)C(F)(F)F)CC1)c1ccccc1 ZINC000186023416 495825114 /nfs/dbraw/zinc/82/51/14/495825114.db2.gz FBZXDRAGWNJEOQ-STQMWFEESA-N 0 0 356.388 3.096 10 0 FGAERN O=C(NCCc1ccccc1)N1CCCC[C@@H]1c1nnc2n1CCCC2 ZINC000180020761 495826562 /nfs/dbraw/zinc/82/65/62/495826562.db2.gz BCFZUNGSHOYJKU-QGZVFWFLSA-N 0 0 353.470 3.094 10 0 FGAERN CC(C)n1ccnc1C[S@@](=O)[C@H](C)C(=O)N1CCCc2ccccc21 ZINC000176889515 495829391 /nfs/dbraw/zinc/82/93/91/495829391.db2.gz BCYDJAFSTGBQHN-SGANQWHYSA-N 0 0 359.495 3.081 10 0 FGAERN CCc1cccc(NC(=O)CNC(=O)N[C@H](C)COCc2ccccc2)c1 ZINC000174128332 495830116 /nfs/dbraw/zinc/83/01/16/495830116.db2.gz YIFCMTWKZFEUDB-MRXNPFEDSA-N 0 0 369.465 3.092 10 0 FGAERN C[C@@H](NC(=O)CNC(=O)NCc1ccc(Cl)cc1)c1cccs1 ZINC000171352053 495833465 /nfs/dbraw/zinc/83/34/65/495833465.db2.gz DMTYJLXBPAXCKK-LLVKDONJSA-N 0 0 351.859 3.078 10 0 FGAERN CCOc1ccc(OC)cc1NC(=O)N1CCC[C@@H](c2nncn2CC)C1 ZINC000183098492 495834270 /nfs/dbraw/zinc/83/42/70/495834270.db2.gz MKROXELQSPZICG-CQSZACIVSA-N 0 0 373.457 3.117 10 0 FGAERN C[C@@H](C(=O)OC(C)(C)C)N(C)C(=O)c1cnc(OCC2CC2)c(Cl)c1 ZINC000183110397 495839431 /nfs/dbraw/zinc/83/94/31/495839431.db2.gz NCHZQHXOXSNJDU-NSHDSACASA-N 0 0 368.861 3.326 10 0 FGAERN CC1(C)C[C@H](NC(=O)NCCNC(=O)c2ccccc2)c2ccccc2O1 ZINC000155110130 495840353 /nfs/dbraw/zinc/84/03/53/495840353.db2.gz ONSNTLMUQVULHF-KRWDZBQOSA-N 0 0 367.449 3.018 10 0 FGAERN O=C(Nc1ccn(CCc2ccncc2)n1)N1CCCC[C@@H]1c1cn[nH]c1 ZINC000186062901 495841467 /nfs/dbraw/zinc/84/14/67/495841467.db2.gz YAKNTGLVLKYLHU-QGZVFWFLSA-N 0 0 365.441 3.003 10 0 FGAERN Cc1ccc(C(=O)N2C[C@@H](C)C[C@H](C)C2)cc1NCc1nnnn1C(C)C ZINC000171371207 495842623 /nfs/dbraw/zinc/84/26/23/495842623.db2.gz QDRNFPQEUCFDBB-GJZGRUSLSA-N 0 0 370.501 3.293 10 0 FGAERN CCO[C@H]1C[C@H](N(C)C(=O)Nc2ccc3c(c2)oc(=O)n3C)C12CCCC2 ZINC000151450100 495843473 /nfs/dbraw/zinc/84/34/73/495843473.db2.gz AHEYKQXYVSPFML-IRXDYDNUSA-N 0 0 373.453 3.333 10 0 FGAERN CCOc1ccc(NC(=O)N2CC[C@@H](c3cnn(C)c3)C2)c2ncccc12 ZINC000186068617 495844388 /nfs/dbraw/zinc/84/43/88/495844388.db2.gz XPPUJGZXFLCSKM-CQSZACIVSA-N 0 0 365.437 3.388 10 0 FGAERN O=C(Nc1cccc(N2CCCNC2=O)c1)N[C@H]1CCOc2ccccc21 ZINC000174170564 495847531 /nfs/dbraw/zinc/84/75/31/495847531.db2.gz CONVHGSIOHLNKC-KRWDZBQOSA-N 0 0 366.421 3.252 10 0 FGAERN COC(=O)c1ccsc1NC(=O)C(=O)N[C@@H]1CC[C@@H](C)c2ccccc21 ZINC000151474922 495851337 /nfs/dbraw/zinc/85/13/37/495851337.db2.gz PABWFGGPBNBYPX-IAQYHMDHSA-N 0 0 372.446 3.228 10 0 FGAERN Cn1cc([C@H]2CCCN2C(=O)C(=O)Nc2ccccc2C(C)(C)C)cn1 ZINC000171396547 495855134 /nfs/dbraw/zinc/85/51/34/495855134.db2.gz MZUUZDAGBALLNB-QGZVFWFLSA-N 0 0 354.454 3.020 10 0 FGAERN Cc1nc(C[C@H]2CCCN(CC(=O)N[C@@H](c3ccccc3)C(C)C)C2)no1 ZINC000171405508 495858357 /nfs/dbraw/zinc/85/83/57/495858357.db2.gz JUUYYYKOAARXIF-DYESRHJHSA-N 0 0 370.497 3.146 10 0 FGAERN CCc1cc(NC(=O)[C@@H](NC(=O)c2ccccc2)[C@@H](C)CC)nc(C)n1 ZINC000174205753 495863250 /nfs/dbraw/zinc/86/32/50/495863250.db2.gz BGBYKQUHGYBITG-UGSOOPFHSA-N 0 0 354.454 3.131 10 0 FGAERN CC(C)(C)Oc1cccc(CCC(=O)N2CC[C@]3(O)CCCC[C@@H]3C2)n1 ZINC000151517991 495864262 /nfs/dbraw/zinc/86/42/62/495864262.db2.gz MVYCBEALLCJPOT-IIBYNOLFSA-N 0 0 360.498 3.345 10 0 FGAERN O=C(c1ccc(-n2cccn2)cc1)N1C[C@@H](O)C[C@@H]1c1cc(F)ccc1F ZINC000180117964 495865800 /nfs/dbraw/zinc/86/58/00/495865800.db2.gz WWFAGNYMKWXBNB-QFBILLFUSA-N 0 0 369.371 3.099 10 0 FGAERN Clc1cccc(N2CCCC2)c1CN1CCO[C@H](Cn2cccn2)C1 ZINC000180128267 495870348 /nfs/dbraw/zinc/87/03/48/495870348.db2.gz WIQQDAAHQYSIOG-INIZCTEOSA-N 0 0 360.889 3.038 10 0 FGAERN Cc1cc(Br)c2c(c1)CN(C(=O)N[C@H](C)[C@@H]1CCCO1)CC2 ZINC000186153472 495874840 /nfs/dbraw/zinc/87/48/40/495874840.db2.gz BRDGPXVOLRNTHG-WBMJQRKESA-N 0 0 367.287 3.393 10 0 FGAERN CC(C)[C@H](C)NC(=O)C(=O)Nc1ccc(N2CCc3sccc3C2)cc1 ZINC000155204235 495875536 /nfs/dbraw/zinc/87/55/36/495875536.db2.gz VGTZPFPRQLXYHN-AWEZNQCLSA-N 0 0 371.506 3.410 10 0 FGAERN CCn1cnnc1[C@H]1CCCN(C(=O)Nc2ccc3c(c2)C(=O)CCC3)C1 ZINC000183194119 495875497 /nfs/dbraw/zinc/87/54/97/495875497.db2.gz JZBLGDFAVFFQBZ-HNNXBMFYSA-N 0 0 367.453 3.229 10 0 FGAERN CCOC(=O)c1ccc(NC(=O)N2CCC[C@H](Cc3noc(C)n3)C2)cc1 ZINC000171445903 495878193 /nfs/dbraw/zinc/87/81/93/495878193.db2.gz JGSXMBMKPLEECY-CQSZACIVSA-N 0 0 372.425 3.041 10 0 FGAERN C[C@@H](CNC(=O)N[C@@H](C)c1cc(Cl)ccc1Cl)N1CCOCC1 ZINC000186165142 495880093 /nfs/dbraw/zinc/88/00/93/495880093.db2.gz UCJZITKIXXUHHN-RYUDHWBXSA-N 0 0 360.285 3.074 10 0 FGAERN COC(=O)c1cccc(OCCNC2(c3noc(C4CC4)n3)CCCC2)c1 ZINC000174247424 495881164 /nfs/dbraw/zinc/88/11/64/495881164.db2.gz YNLYIQFAGDCKAR-UHFFFAOYSA-N 0 0 371.437 3.172 10 0 FGAERN CCCOCc1ccccc1CNC(=O)N1CCC[C@@H]1c1cnn(C)c1 ZINC000171459379 495883316 /nfs/dbraw/zinc/88/33/16/495883316.db2.gz MSVDHMDGUWUZPZ-LJQANCHMSA-N 0 0 356.470 3.393 10 0 FGAERN Cc1ccc(OCCCCNC(=O)N2CCC[C@@H]2c2cnn(C)c2)cc1 ZINC000171459011 495883727 /nfs/dbraw/zinc/88/37/27/495883727.db2.gz NUEBIDYPUMPIAN-LJQANCHMSA-N 0 0 356.470 3.434 10 0 FGAERN Cc1nc(C)n(-c2ccccc2NC(=O)N2CCCC[C@@H]2c2cn[nH]c2)n1 ZINC000183215164 495883986 /nfs/dbraw/zinc/88/39/86/495883986.db2.gz MIQGJLMXKDCIJZ-QGZVFWFLSA-N 0 0 365.441 3.366 10 0 FGAERN C[C@@H](COc1ccc(F)cc1F)NC(=O)N1CCC[C@@H]1c1cnn(C)c1 ZINC000171465544 495886760 /nfs/dbraw/zinc/88/67/60/495886760.db2.gz USBMIWPRVVEYDG-BLLLJJGKSA-N 0 0 364.396 3.012 10 0 FGAERN CNc1cc(N2CCC[C@H]2CNC(=O)Nc2cccc(Cl)c2C)ncn1 ZINC000174268026 495888528 /nfs/dbraw/zinc/88/85/28/495888528.db2.gz ZNAHKLRSHYNSIG-ZDUSSCGKSA-N 0 0 374.876 3.271 10 0 FGAERN Cn1cc([C@H]2CCCN2C(=O)NCCCCOCc2ccccc2)cn1 ZINC000171468956 495888910 /nfs/dbraw/zinc/88/89/10/495888910.db2.gz DCEZZNIVKQEEGO-LJQANCHMSA-N 0 0 356.470 3.264 10 0 FGAERN CC[C@H](C)NC(=O)c1ccc(NC(=O)C2CCC(C(=O)OC)CC2)cc1 ZINC000180172644 495891132 /nfs/dbraw/zinc/89/11/32/495891132.db2.gz XLEPHKSOHKKBGY-HLIUYOAVSA-N 0 0 360.454 3.133 10 0 FGAERN CSCc1ccccc1NC(=O)C(=O)N[C@H]1CCOc2ccccc21 ZINC000186201316 495894374 /nfs/dbraw/zinc/89/43/74/495894374.db2.gz WLFBUUHQHIAZRX-INIZCTEOSA-N 0 0 356.447 3.128 10 0 FGAERN COC(=O)[C@@H](C)NC(=O)[C@H]1CCCO[C@H]1c1ccc(Cl)cc1Cl ZINC000183245038 495896393 /nfs/dbraw/zinc/89/63/93/495896393.db2.gz CMHBQGRNBPTBCX-LQJRIPTKSA-N 0 0 360.237 3.139 10 0 FGAERN COc1cccc(C(=O)N2C[C@@H]3CC[C@H](NC(=O)OC(C)(C)C)[C@H]3C2)c1 ZINC000183258526 495903897 /nfs/dbraw/zinc/90/38/97/495903897.db2.gz MEZCUJMGGYNTPO-XIRDDKMYSA-N 0 0 360.454 3.071 10 0 FGAERN Cc1cc(C)c(CC(=O)N(C)[C@H]2CCCN(c3cccnn3)C2)c(C)c1 ZINC000180204980 495905838 /nfs/dbraw/zinc/90/58/38/495905838.db2.gz CMUGRRTXIWDOAU-SFHVURJKSA-N 0 0 352.482 3.072 10 0 FGAERN CC(C)CNC(=O)c1ccc(NC(=O)N2CCC[C@@H]2c2cnn(C)c2)cc1 ZINC000171512017 495906650 /nfs/dbraw/zinc/90/66/50/495906650.db2.gz VZNIOHOONYJEMA-GOSISDBHSA-N 0 0 369.469 3.175 10 0 FGAERN Cc1nc(C)n(C[C@H]2CCCN(C(=O)[C@@H](C)CCOc3ccccc3)C2)n1 ZINC000174319789 495907799 /nfs/dbraw/zinc/90/77/99/495907799.db2.gz BOLWYQFSGZEEDY-LPHOPBHVSA-N 0 0 370.497 3.239 10 0 FGAERN CC(C)(C)OC(=O)N[C@@H]1CC[C@@H]2CN(C(=O)Cc3cccs3)C[C@H]12 ZINC000183270924 495909529 /nfs/dbraw/zinc/90/95/29/495909529.db2.gz CIKWNQRMBFUMQB-VHDGCEQUSA-N 0 0 350.484 3.052 10 0 FGAERN C[C@@H](O)CN1CCN(C(=O)c2ccc(-c3ccc(F)cc3)cc2F)C[C@@H]1C ZINC000174324157 495909842 /nfs/dbraw/zinc/90/98/42/495909842.db2.gz MGEOPXPWDGEJBG-LSDHHAIUSA-N 0 0 374.431 3.159 10 0 FGAERN CC(C)c1ccc([C@H](C)NC(=O)NC[C@@H]2COC3(CCOCC3)O2)cc1 ZINC000180219569 495913278 /nfs/dbraw/zinc/91/32/78/495913278.db2.gz 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Cc1nc(NC(=O)N2CCCC[C@@H]2c2nnc3n2CCCC3)sc1C ZINC000176672027 495743069 /nfs/dbraw/zinc/74/30/69/495743069.db2.gz HJWKGOCWFKNUPZ-CYBMUJFWSA-N 0 0 360.487 3.447 10 0 FGAERN CCc1ccc(C(C)(C)C(=O)N[C@H]2CCc3nc(C(C)C)nn3C2)cc1 ZINC000176675408 495744091 /nfs/dbraw/zinc/74/40/91/495744091.db2.gz WQXJSZUCHQSYHV-KRWDZBQOSA-N 0 0 354.498 3.373 10 0 FGAERN Cc1nn(C)c(C)c1CCC(=O)N[C@H](C)c1cccc(-n2ccnc2)c1 ZINC000173912011 495744596 /nfs/dbraw/zinc/74/45/96/495744596.db2.gz NOGIQXLUWXLLDA-CQSZACIVSA-N 0 0 351.454 3.033 10 0 FGAERN CC(C)C[C@H](N[C@H](C)c1cnn(C(C)C)c1)c1nc(-c2nc[nH]n2)no1 ZINC000179813507 495744756 /nfs/dbraw/zinc/74/47/56/495744756.db2.gz FHZZSTISERWVIT-OCCSQVGLSA-N 0 0 358.450 3.070 10 0 FGAERN COc1ccc([C@H](C)N[C@H](CC(C)C)c2nc(-c3nc[nH]n3)no2)cc1 ZINC000179812817 495745283 /nfs/dbraw/zinc/74/52/83/495745283.db2.gz KYLOIVJHUKWCCI-SWLSCSKDSA-N 0 0 356.430 3.301 10 0 FGAERN O=C(c1ccc(O)cc1O)N1C[C@H](O)C[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000182894877 495745862 /nfs/dbraw/zinc/74/58/62/495745862.db2.gz KFUIXWFLOFLBAL-UKRRQHHQSA-N 0 0 367.323 3.065 10 0 FGAERN C[C@@H](NC(=O)c1ccc(N2CCCC2)nc1)c1cccc(-n2ccnc2)c1 ZINC000173920561 495747845 /nfs/dbraw/zinc/74/78/45/495747845.db2.gz VYOGGCAETIWGEM-MRXNPFEDSA-N 0 0 361.449 3.359 10 0 FGAERN CCC1CCC(NC(=O)N2CCC(NC(=O)c3ccoc3C)CC2)CC1 ZINC000171160873 495749772 /nfs/dbraw/zinc/74/97/72/495749772.db2.gz SISWRRSLGFFFEP-UHFFFAOYSA-N 0 0 361.486 3.461 10 0 FGAERN C[C@H]1C[C@@H]1NC(=O)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1 ZINC000185862757 495754244 /nfs/dbraw/zinc/75/42/44/495754244.db2.gz KMVZGZZWTJAODF-NHYWBVRUSA-N 0 0 369.387 3.018 10 0 FGAERN CC(=O)c1cccc(OCC(=O)N[C@@H](C)c2cccc(-n3ccnc3)c2)c1 ZINC000173939013 495755542 /nfs/dbraw/zinc/75/55/42/495755542.db2.gz SNARWUOQVKCIOS-HNNXBMFYSA-N 0 0 363.417 3.331 10 0 FGAERN CCc1ccc([C@H](C)NC(=O)NCCN2c3ccccc3CC2=O)cc1 ZINC000171177961 495756524 /nfs/dbraw/zinc/75/65/24/495756524.db2.gz UZKDIOKRDGABBV-HNNXBMFYSA-N 0 0 351.450 3.199 10 0 FGAERN Cc1cc(C)c(C(=O)N2CCN(Cc3cnn(-c4ccccc4)c3)CC2)o1 ZINC000176711380 495759114 /nfs/dbraw/zinc/75/91/14/495759114.db2.gz GGHJBQQSSIYYNA-UHFFFAOYSA-N 0 0 364.449 3.040 10 0 FGAERN C[C@@H](NC(=O)c1ccccc1Cn1cncn1)c1cccc(-n2ccnc2)c1 ZINC000173953565 495761565 /nfs/dbraw/zinc/76/15/65/495761565.db2.gz XHRYDCUVQDPKLP-MRXNPFEDSA-N 0 0 372.432 3.003 10 0 FGAERN C[C@@H](NS(=O)(=O)c1cc(F)cc(F)c1)c1cccc(-n2ccnc2)c1 ZINC000173963600 495766147 /nfs/dbraw/zinc/76/61/47/495766147.db2.gz OUVWIQQSYBEVOD-GFCCVEGCSA-N 0 0 363.389 3.190 10 0 FGAERN Cc1nc(C)n(C[C@H]2CCCN(C(=O)C/C=C/c3cccc(F)c3)C2)n1 ZINC000176738705 495767596 /nfs/dbraw/zinc/76/75/96/495767596.db2.gz CENOGQGCEXDSOV-UKTKYZJWSA-N 0 0 356.445 3.376 10 0 FGAERN C[C@@H](NS(=O)(=O)CCc1ccccc1)c1cccc(-n2ccnc2)c1 ZINC000173964993 495767774 /nfs/dbraw/zinc/76/77/74/495767774.db2.gz GLNDPDPGNMMEPM-MRXNPFEDSA-N 0 0 355.463 3.095 10 0 FGAERN COc1ccc(NC(=O)[C@H]2CC(=O)N(C)[C@H]2c2ccc(F)cc2)c(OC)c1 ZINC000179877835 495768618 /nfs/dbraw/zinc/76/86/18/495768618.db2.gz WRLUUISVLPIGNU-KXBFYZLASA-N 0 0 372.396 3.001 10 0 FGAERN CC(=O)c1ccccc1NC(=O)[C@@H]1CC(=O)N(C)[C@H]1c1ccc(F)cc1 ZINC000179881359 495768711 /nfs/dbraw/zinc/76/87/11/495768711.db2.gz VNRPJLGQRRNKKQ-APWZRJJASA-N 0 0 354.381 3.186 10 0 FGAERN C[C@H](NC(=O)C(=O)Nc1ccc(-c2ncon2)cc1)c1cccc(Cl)c1 ZINC000171218895 495774644 /nfs/dbraw/zinc/77/46/44/495774644.db2.gz BSCUWHNEFDJULF-NSHDSACASA-N 0 0 370.796 3.206 10 0 FGAERN C[C@H]1CC[C@H](C(=O)Nc2ccc(C(=O)N3CCc4ccccc43)cc2)O1 ZINC000151219185 495774870 /nfs/dbraw/zinc/77/48/70/495774870.db2.gz XBYLKMUBLJPSIB-IFXJQAMLSA-N 0 0 350.418 3.396 10 0 FGAERN CCc1nc2n(n1)CCC[C@@H]2NC(=O)C1(c2ccc(F)cc2)CCCC1 ZINC000151230938 495779269 /nfs/dbraw/zinc/77/92/69/495779269.db2.gz WHCXWVPUYXAOIK-INIZCTEOSA-N 0 0 356.445 3.443 10 0 FGAERN Cc1c(C(=O)N2CC[C@@]3(O)CCCC[C@@H]3C2)cnn1-c1ccccc1C ZINC000151234606 495780651 /nfs/dbraw/zinc/78/06/51/495780651.db2.gz ARZMJDXJCOYUPF-UTKZUKDTSA-N 0 0 353.466 3.256 10 0 FGAERN CC(C)c1nc([C@H]2CCCN2C(=O)c2cc(COC(C)(C)C)on2)no1 ZINC000185921465 495782221 /nfs/dbraw/zinc/78/22/21/495782221.db2.gz MQGTUGCJOSJRJV-CQSZACIVSA-N 0 0 362.430 3.473 10 0 FGAERN Cc1nc(C[C@H]2CCCN(C(=O)c3nc(C(C)C)ncc3Cl)C2)no1 ZINC000171235079 495782143 /nfs/dbraw/zinc/78/21/43/495782143.db2.gz FJJLPPDPOOCALI-GFCCVEGCSA-N 0 0 363.849 3.040 10 0 FGAERN Cc1nc(C[C@@H]2CCCN(C(=O)c3ccc(-n4cccc4)cc3)C2)no1 ZINC000171241590 495785079 /nfs/dbraw/zinc/78/50/79/495785079.db2.gz VDBVOLJAYXIVRX-INIZCTEOSA-N 0 0 350.422 3.264 10 0 FGAERN Cc1nc(C[C@H]2CCCN(C(=O)c3ccccc3Br)C2)no1 ZINC000171240254 495785228 /nfs/dbraw/zinc/78/52/28/495785228.db2.gz KOBPVGMHOVVNNS-GFCCVEGCSA-N 0 0 364.243 3.235 10 0 FGAERN Cc1nc(C[C@H]2CCCN(C(=O)COc3ccc(Cl)cc3C)C2)no1 ZINC000171242505 495785300 /nfs/dbraw/zinc/78/53/00/495785300.db2.gz ZSIWUDFHHAKHMT-CQSZACIVSA-N 0 0 363.845 3.200 10 0 FGAERN CCO[C@@H]1C[C@H](NC(=O)Nc2nc3c(s2)CCCC3)C12CCOCC2 ZINC000185931562 495786018 /nfs/dbraw/zinc/78/60/18/495786018.db2.gz FAFSEPTVGCTBFG-LSDHHAIUSA-N 0 0 365.499 3.118 10 0 FGAERN Cc1nc(C[C@@H]2CCCN(C(=O)c3cccc(OC(F)F)c3)C2)no1 ZINC000171244210 495786509 /nfs/dbraw/zinc/78/65/09/495786509.db2.gz UWISEESUNJDXCV-LBPRGKRZSA-N 0 0 351.353 3.074 10 0 FGAERN Cc1nc(C[C@H]2CCCN(C(=O)c3ccccc3OC(F)F)C2)no1 ZINC000171246814 495787430 /nfs/dbraw/zinc/78/74/30/495787430.db2.gz KZFHTMIANBRROU-GFCCVEGCSA-N 0 0 351.353 3.074 10 0 FGAERN CC(C)[C@@H](C)NC(=O)Nc1cc(Br)cnc1-n1cccn1 ZINC000154967891 495787970 /nfs/dbraw/zinc/78/79/70/495787970.db2.gz YDIJUWQELGECHR-SNVBAGLBSA-N 0 0 352.236 3.196 10 0 FGAERN CCc1nc2n(n1)CCC[C@@H]2NC(=O)COc1cc(Cl)cc(Cl)c1 ZINC000151265182 495788008 /nfs/dbraw/zinc/78/80/08/495788008.db2.gz NGOHOJIEYOQPJJ-ZDUSSCGKSA-N 0 0 369.252 3.177 10 0 FGAERN Cc1nn(C)c(C)c1[C@H]1CCCN1C(=O)NCc1ccc(C(C)(C)O)cc1 ZINC000185937206 495788047 /nfs/dbraw/zinc/78/80/47/495788047.db2.gz QCGDBODCFDYWMC-GOSISDBHSA-N 0 0 370.497 3.311 10 0 FGAERN COc1ccc(F)cc1NC(=O)[C@@H]1CCC(=O)N(C)[C@@H]1c1ccccc1 ZINC000179937868 495791656 /nfs/dbraw/zinc/79/16/56/495791656.db2.gz JAZAZEDGJLPKPN-DNVCBOLYSA-N 0 0 356.397 3.383 10 0 FGAERN CCCNS(=O)(=O)c1ccc(NC(=O)N[C@H](C)c2ccc(C)o2)cc1 ZINC000174024749 495793137 /nfs/dbraw/zinc/79/31/37/495793137.db2.gz XNSIWPDSZCDLME-CYBMUJFWSA-N 0 0 365.455 3.159 10 0 FGAERN CCCC(=O)N[C@@H]1CCCN(C(=O)Nc2ccc(F)cc2OC(F)F)C1 ZINC000174049412 495802964 /nfs/dbraw/zinc/80/29/64/495802964.db2.gz HAUDKZIPAWBZNM-GFCCVEGCSA-N 0 0 373.375 3.340 10 0 FGAERN CC[C@@H](Cc1ccccc1)NC(=O)N[C@H](C)c1ccc(S(C)(=O)=O)cc1 ZINC000171283230 495803506 /nfs/dbraw/zinc/80/35/06/495803506.db2.gz KIDVDVKBNUCVFO-QAPCUYQASA-N 0 0 374.506 3.472 10 0 FGAERN O=C(N[C@@H]1CCCc2ccccc21)N1CCCN(Cc2cscn2)CC1 ZINC000171289153 495805591 /nfs/dbraw/zinc/80/55/91/495805591.db2.gz ZSYCXYNRBRSYLL-LJQANCHMSA-N 0 0 370.522 3.438 10 0 FGAERN C[C@]1(O)CCN(C(=O)[C@H]2CCCO[C@@H]2c2ccc(Cl)cc2Cl)C1 ZINC000183030622 495805941 /nfs/dbraw/zinc/80/59/41/495805941.db2.gz QOZYQCOEZDYIIH-LXZKKBNFSA-N 0 0 358.265 3.444 10 0 FGAERN COc1ccc([C@H](C)OC(=O)Cc2cnn(C)c2)c(Br)c1 ZINC000179974157 495806668 /nfs/dbraw/zinc/80/66/68/495806668.db2.gz IYIUNNMVCMOAJO-JTQLQIEISA-N 0 0 353.216 3.038 10 0 FGAERN Cc1ccc(-c2ccncc2)cc1NC(=O)C(=O)N[C@@H]1COc2ccccc21 ZINC000171293345 495808226 /nfs/dbraw/zinc/80/82/26/495808226.db2.gz GPFHIZRVZYWGDR-LJQANCHMSA-N 0 0 373.412 3.245 10 0 FGAERN CCOCCN1CCN(C(=O)c2scnc2C(C)(C)C)C[C@@H]1CC ZINC000176853280 495811869 /nfs/dbraw/zinc/81/18/69/495811869.db2.gz LPBOHBVCGHQABL-AWEZNQCLSA-N 0 0 353.532 3.014 10 0 FGAERN C[C@@H](NC(=O)CCCC(=O)N[C@@H](C)c1cccc(O)c1)c1cccc(O)c1 ZINC000171305560 495812804 /nfs/dbraw/zinc/81/28/04/495812804.db2.gz IHZKUQUWABSYPR-GASCZTMLSA-N 0 0 370.449 3.323 10 0 FGAERN Cn1nccc1C1CCN(C(=O)Nc2cccc(-c3cc[nH]n3)c2)CC1 ZINC000185992935 495813122 /nfs/dbraw/zinc/81/31/22/495813122.db2.gz CPFDOZIMFXYOSX-UHFFFAOYSA-N 0 0 350.426 3.222 10 0 FGAERN CCn1cnnc1[C@@H]1CCCN(C(=O)Nc2ccc3scnc3c2)C1 ZINC000183060228 495818113 /nfs/dbraw/zinc/81/81/13/495818113.db2.gz PTYVZSWDKHCFCK-GFCCVEGCSA-N 0 0 356.455 3.319 10 0 FGAERN Cc1nnc([C@@H]2CN(CCCOc3ccc(C(C)(C)C)cc3)CCO2)[nH]1 ZINC000174097770 495819378 /nfs/dbraw/zinc/81/93/78/495819378.db2.gz MQGIOZVRFGGGGT-SFHVURJKSA-N 0 0 358.486 3.253 10 0 FGAERN CSc1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(N)=O)cc1Cl ZINC000176871215 495819520 /nfs/dbraw/zinc/81/95/20/495819520.db2.gz NTIMKCRXRKOLRQ-CQSZACIVSA-N 0 0 363.870 3.280 10 0 FGAERN CC(C)n1ccnc1C[S@@](=O)CC(=O)Nc1cccc(C(F)(F)F)c1 ZINC000176884110 495825614 /nfs/dbraw/zinc/82/56/14/495825614.db2.gz CJSVHVVYDDWKTJ-RUZDIDTESA-N 0 0 373.400 3.370 10 0 FGAERN Cc1nc(C[C@H]2CCCN(C(=O)c3sccc3-n3cccc3)C2)no1 ZINC000171336041 495826989 /nfs/dbraw/zinc/82/69/89/495826989.db2.gz HLPAYEKYABSMCG-CQSZACIVSA-N 0 0 356.451 3.325 10 0 FGAERN Cc1noc2nc(C3CC3)cc(C(=O)N3CC[C@@]4(O)CCCC[C@H]4C3)c12 ZINC000151396804 495827441 /nfs/dbraw/zinc/82/74/41/495827441.db2.gz QGYIZNAJPLORDJ-XOBRGWDASA-N 0 0 355.438 3.176 10 0 FGAERN CC/C(=C/C(=O)N[C@@H]1CCCn2nc(COC)nc21)c1ccc(C)cc1 ZINC000155084137 495830250 /nfs/dbraw/zinc/83/02/50/495830250.db2.gz VSPZJVZVFSPKQR-MLRPBERTSA-N 0 0 354.454 3.178 10 0 FGAERN CCN(Cc1ccccc1)C(=O)[C@H](C)[S@](=O)Cc1nccn1C(C)C ZINC000176897628 495832947 /nfs/dbraw/zinc/83/29/47/495832947.db2.gz JJMNQIHQJBVYRT-IVCQMTBJSA-N 0 0 361.511 3.150 10 0 FGAERN O=C(NCCCNC(=O)c1cccs1)N[C@H]1CCCc2ccccc21 ZINC000155109343 495838802 /nfs/dbraw/zinc/83/88/02/495838802.db2.gz TUIMNCDDQBSZGN-INIZCTEOSA-N 0 0 357.479 3.245 10 0 FGAERN O=C(c1cc(-c2ccco2)on1)N1C[C@@H](O)C[C@H]1c1cc(F)ccc1F ZINC000180067334 495842534 /nfs/dbraw/zinc/84/25/34/495842534.db2.gz GUORPCCYTUBABB-NHYWBVRUSA-N 0 0 360.316 3.161 10 0 FGAERN CC(C)c1nnc(CCC(=O)N[C@H](C)c2cccc(-n3ccnc3)c2)o1 ZINC000176928192 495844944 /nfs/dbraw/zinc/84/49/44/495844944.db2.gz HKKBWIJQLYOGRD-CQSZACIVSA-N 0 0 353.426 3.189 10 0 FGAERN COc1ncc(C)cc1NC(=O)C(=O)N[C@H]1CC[C@@H](C)c2ccccc21 ZINC000151462908 495848348 /nfs/dbraw/zinc/84/83/48/495848348.db2.gz UBNSVHZUYJPHTA-CJNGLKHVSA-N 0 0 353.422 3.092 10 0 FGAERN COC(=O)c1ccc(NC(=O)C(=O)N[C@H]2CC[C@H](C)c3ccccc32)cc1 ZINC000151470929 495850927 /nfs/dbraw/zinc/85/09/27/495850927.db2.gz HEPUOMCRBINJPM-UGSOOPFHSA-N 0 0 366.417 3.167 10 0 FGAERN CN(C(=O)[C@@H]1C[C@H]1c1ccc(F)c(F)c1)c1cccc(S(C)(=O)=O)c1 ZINC000155143104 495851888 /nfs/dbraw/zinc/85/18/88/495851888.db2.gz BDTMYLUBCISXGS-LSDHHAIUSA-N 0 0 365.401 3.135 10 0 FGAERN CN(C(=O)[C@H]1C[C@H]1c1ccc(F)c(F)c1)c1cccc(S(C)(=O)=O)c1 ZINC000155143221 495852357 /nfs/dbraw/zinc/85/23/57/495852357.db2.gz BDTMYLUBCISXGS-GJZGRUSLSA-N 0 0 365.401 3.135 10 0 FGAERN COc1cccc([C@H](C)C(=O)N2C[C@H](O)C[C@@H]2c2cc(F)ccc2F)c1 ZINC000180090889 495854482 /nfs/dbraw/zinc/85/44/82/495854482.db2.gz NYOZPDBBZMWJOZ-IOHHAYIISA-N 0 0 361.388 3.411 10 0 FGAERN Cn1cc([C@@H]2CCCN2C(=O)C(=O)Nc2cc(Cl)ccc2Cl)cn1 ZINC000171397242 495855087 /nfs/dbraw/zinc/85/50/87/495855087.db2.gz JTTYKMNIRGACGD-AWEZNQCLSA-N 0 0 367.236 3.029 10 0 FGAERN O=C(Nc1cc(F)c(F)cc1F)N1CCC(Nc2cccnn2)CC1 ZINC000151491234 495856949 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Cc1csc([C@H]2CCCN(C(=O)Cn3cc(-c4ccccc4)nn3)C2)n1 ZINC000121651291 494830058 /nfs/dbraw/zinc/83/00/58/494830058.db2.gz ZOWWLRVGERDOAY-INIZCTEOSA-N 0 0 367.478 3.116 10 0 FGAERN CCCCNC(=O)[C@@H]1CCCN(C(=O)[C@@H]2C[C@@H]2c2ccc(F)c(F)c2)C1 ZINC000109095574 494831920 /nfs/dbraw/zinc/83/19/20/494831920.db2.gz PZQHAPYLXVAVFQ-BZUAXINKSA-N 0 0 364.436 3.223 10 0 FGAERN CCOC(=O)c1csc(NC(=O)[C@@H]2C[C@H]2c2ccc(F)c(F)c2)n1 ZINC000109098306 494832003 /nfs/dbraw/zinc/83/20/03/494832003.db2.gz HJVDPBJECRCSCU-VHSXEESVSA-N 0 0 352.362 3.340 10 0 FGAERN O=C(Nc1ccc(-n2cncn2)c(F)c1)[C@@H]1C[C@H]1c1ccc(F)c(F)c1 ZINC000109101445 494832553 /nfs/dbraw/zinc/83/25/53/494832553.db2.gz DHAQGKCNDQRURS-QWHCGFSZSA-N 0 0 358.323 3.427 10 0 FGAERN CCc1cc(=O)n2nc(Nc3ccc4c(c3)nc(C3CC3)n4C)sc2n1 ZINC000132203966 494838437 /nfs/dbraw/zinc/83/84/37/494838437.db2.gz GEQBPHHLPNNHOQ-UHFFFAOYSA-N 0 0 366.450 3.221 10 0 FGAERN CCc1ccc([C@@H](C)NC(=O)N[C@H](Cc2ccccc2)C(=O)N(C)C)cc1 ZINC000109164787 494839584 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CCCC(=O)N[C@H]1CCCN(C(=O)c2c[nH]nc2-c2cccc(Cl)c2)C1 ZINC000132436162 494873818 /nfs/dbraw/zinc/87/38/18/494873818.db2.gz OLHWYHMCJBOXLX-HNNXBMFYSA-N 0 0 374.872 3.251 10 0 FGAERN O=C(N[C@@H]1CCO[C@@H](c2ccccc2)C1)N1CCC(Cn2cccn2)CC1 ZINC000132441509 494875049 /nfs/dbraw/zinc/87/50/49/494875049.db2.gz KPWFFXTYWKLZOD-WOJBJXKFSA-N 0 0 368.481 3.225 10 0 FGAERN Cc1cc(C)n(-c2ccc(C(=O)N3CC[C@]4(O)CCCC[C@H]4C3)cc2)n1 ZINC000121860641 494876301 /nfs/dbraw/zinc/87/63/01/494876301.db2.gz RVHDWHPMXSBLLY-GHTZIAJQSA-N 0 0 353.466 3.256 10 0 FGAERN C[C@@H]1CN(C(=O)N[C@H]2CCN(c3ccccc3OC(F)F)C2)CCS1 ZINC000116969719 494877720 /nfs/dbraw/zinc/87/77/20/494877720.db2.gz GMMPTLRNLMRXIU-OLZOCXBDSA-N 0 0 371.453 3.014 10 0 FGAERN CCCC(=O)N[C@@H]1CCCN(C(=O)Nc2ccc(OCC(C)C)nc2)C1 ZINC000117009220 494883342 /nfs/dbraw/zinc/88/33/42/494883342.db2.gz JOOYRKIYMLMEAV-MRXNPFEDSA-N 0 0 362.474 3.029 10 0 FGAERN CCCn1cc(CN2CCCN(C(=O)Nc3ccc(F)cc3C)CC2)cn1 ZINC000121903040 494885814 /nfs/dbraw/zinc/88/58/14/494885814.db2.gz MDMGOCCWZALFCO-UHFFFAOYSA-N 0 0 373.476 3.480 10 0 FGAERN CC(C)c1ccc(CCCNC(=O)N2CCO[C@H](Cn3cccn3)C2)cc1 ZINC000117056280 494888556 /nfs/dbraw/zinc/88/85/56/494888556.db2.gz UFHGDCYEGLOFQC-FQEVSTJZSA-N 0 0 370.497 3.050 10 0 FGAERN CC(C)c1nc2n(n1)C[C@@H](NC(=O)c1ccc(F)cc1C(F)(F)F)CC2 ZINC000132530698 494889270 /nfs/dbraw/zinc/88/92/70/494889270.db2.gz VJSFKWHXUZZWBX-NSHDSACASA-N 0 0 370.350 3.304 10 0 FGAERN CC(C)c1ccc(-n2cnnc2SCC(=O)N[C@H](C)[C@H]2CCCO2)cc1 ZINC000027897320 494889444 /nfs/dbraw/zinc/88/94/44/494889444.db2.gz ZVNOMMZGWXEDIW-RHSMWYFYSA-N 0 0 374.510 3.167 10 0 FGAERN CC(C)COc1ccc([C@@H](C)NS(=O)(=O)CC2CCOCC2)cc1 ZINC000127078982 494890681 /nfs/dbraw/zinc/89/06/81/494890681.db2.gz BAEHKCMRYWQTIX-OAHLLOKOSA-N 0 0 355.500 3.128 10 0 FGAERN O=C(Nc1cccc2[nH]ccc21)C(=O)N1CCCC[C@@H]1c1nccs1 ZINC000127098166 494893294 /nfs/dbraw/zinc/89/32/94/494893294.db2.gz CCVFQAAGGOUDEY-OAHLLOKOSA-N 0 0 354.435 3.317 10 0 FGAERN COC(=O)c1ccc(S(=O)(=O)N[C@H](C)c2cccc(Cl)c2)c(C)c1 ZINC000109605089 494895179 /nfs/dbraw/zinc/89/51/79/494895179.db2.gz BFLSDHBYRRUIEY-GFCCVEGCSA-N 0 0 367.854 3.475 10 0 FGAERN O=C(Nc1cc(F)cc(F)c1)C(=O)N1CCCC[C@H]1c1nccs1 ZINC000127117889 494896056 /nfs/dbraw/zinc/89/60/56/494896056.db2.gz SJLJFEKHLSMEQD-ZDUSSCGKSA-N 0 0 351.378 3.114 10 0 FGAERN O=C(Cc1c[nH]c2ccc(Cl)cc12)N1CCO[C@H](c2nccs2)C1 ZINC000121950807 494898132 /nfs/dbraw/zinc/89/81/32/494898132.db2.gz VJRALCQJMCDOAL-HNNXBMFYSA-N 0 0 361.854 3.420 10 0 FGAERN CN(C(=O)CCSc1ccccc1F)[C@@H]1CCCN(c2cccnn2)C1 ZINC000121960746 494899227 /nfs/dbraw/zinc/89/92/27/494899227.db2.gz FTCUGSGVCFDSPR-OAHLLOKOSA-N 0 0 374.485 3.225 10 0 FGAERN O=C(CCc1nc(C2CCCC2)no1)N1CCC[C@H]1C[C@H](O)c1ccco1 ZINC000127135791 494899457 /nfs/dbraw/zinc/89/94/57/494899457.db2.gz LBFHLEMBYQHKSX-HOTGVXAUSA-N 0 0 373.453 3.368 10 0 FGAERN CC(C)COc1cccc(C(=O)N2CCC(Nc3cccnn3)CC2)c1 ZINC000109637284 494899565 /nfs/dbraw/zinc/89/95/65/494899565.db2.gz 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C[C@H](NC(=O)N(Cc1cccc(F)c1)C1CC1)c1nnc2n1CCCC2 ZINC000121345653 494712677 /nfs/dbraw/zinc/71/26/77/494712677.db2.gz YJWVKEPYNKMHGX-ZDUSSCGKSA-N 0 0 357.433 3.189 10 0 FGAERN CCc1nc2n(n1)CCC[C@@H]2NC(=O)NC[C@H](C)Sc1ccccc1 ZINC000121353711 494716686 /nfs/dbraw/zinc/71/66/86/494716686.db2.gz UYJAODLUSXXOFZ-ZFWWWQNUSA-N 0 0 359.499 3.155 10 0 FGAERN CC[C@H](C)[C@@H](NC(=O)c1ccccc1)C(=O)NCc1ccccc1COC ZINC000025303775 494719269 /nfs/dbraw/zinc/71/92/69/494719269.db2.gz FOQVWWOIECSLLV-OXJNMPFZSA-N 0 0 368.477 3.294 10 0 FGAERN CN(C(=O)[C@H]1CCC[C@@H](NC(=O)OC(C)(C)C)C1)c1ncccc1F ZINC000131765419 494724642 /nfs/dbraw/zinc/72/46/42/494724642.db2.gz JQXSKADLYYBYLO-QWHCGFSZSA-N 0 0 351.422 3.267 10 0 FGAERN CCN(CC)C(=O)[C@@H]1CCCN1C(=O)NC[C@H](C)c1ccc(F)cc1F ZINC000080557117 494733780 /nfs/dbraw/zinc/73/37/80/494733780.db2.gz PUQVZNIBDSESEA-GUYCJALGSA-N 0 0 367.440 3.111 10 0 FGAERN COc1cc(OC)c(OC)cc1CN1CCO[C@H](c2nc(C)cs2)C1 ZINC000092790076 494749213 /nfs/dbraw/zinc/74/92/13/494749213.db2.gz CQBXXBUKZLVKLA-KRWDZBQOSA-N 0 0 364.467 3.051 10 0 FGAERN Cc1csc([C@H]2CN(Cc3cc(O)ccc3Br)CCO2)n1 ZINC000092790217 494749380 /nfs/dbraw/zinc/74/93/80/494749380.db2.gz KCWFRHSTZXOLPY-CQSZACIVSA-N 0 0 369.284 3.493 10 0 FGAERN COCCc1ccc(Oc2ccc(NC(=O)C(=O)N[C@H]3C[C@H]3C)cc2)cc1 ZINC000108613353 494751914 /nfs/dbraw/zinc/75/19/14/494751914.db2.gz XUUYMPFVDDOEFV-KUHUBIRLSA-N 0 0 368.433 3.131 10 0 FGAERN Cc1ccccc1[C@H](C)NC(=O)N1CCOC[C@H]1C[C@H](O)c1ccco1 ZINC000121437938 494756343 /nfs/dbraw/zinc/75/63/43/494756343.db2.gz YYIZPKONSWEAQP-JZXOWHBKSA-N 0 0 358.438 3.183 10 0 FGAERN Cn1cc([C@H]2CCN(CC(=O)Nc3ccccc3SC(F)F)C2)cn1 ZINC000116316363 494760617 /nfs/dbraw/zinc/76/06/17/494760617.db2.gz JOKAGZWUMKVVTL-LBPRGKRZSA-N 0 0 366.437 3.163 10 0 FGAERN Cc1nn(C)c(C)c1CN1CCN(Cc2cc(Cl)ccc2F)CC1 ZINC000121457885 494765249 /nfs/dbraw/zinc/76/52/49/494765249.db2.gz XJNPQJMQVDFVHR-UHFFFAOYSA-N 0 0 350.869 3.147 10 0 FGAERN O=S(=O)(c1c(Cl)nc2ccccn21)N1CCC[C@@H]1c1ccco1 ZINC000116354154 494766705 /nfs/dbraw/zinc/76/67/05/494766705.db2.gz KCPXIGHUSYSWLY-LLVKDONJSA-N 0 0 351.815 3.107 10 0 FGAERN Cc1nc(CN2CCCN(C(=O)Nc3cccnc3Cl)CC2)cs1 ZINC000116405534 494776057 /nfs/dbraw/zinc/77/60/57/494776057.db2.gz BGFSEPAOFSVQLE-UHFFFAOYSA-N 0 0 365.890 3.240 10 0 FGAERN C[C@H](OCCCNC(=O)N1CC[C@H](c2cnn(C)c2)C1)c1ccccc1 ZINC000116415906 494779124 /nfs/dbraw/zinc/77/91/24/494779124.db2.gz OTXLQSMFJFZKMW-WMZOPIPTSA-N 0 0 356.470 3.087 10 0 FGAERN Cn1cc([C@H]2CCN(C(=O)NCCOc3cccc(C(C)(C)C)c3)C2)cn1 ZINC000116432860 494785550 /nfs/dbraw/zinc/78/55/50/494785550.db2.gz FVVWZUMLQFQRTC-INIZCTEOSA-N 0 0 370.497 3.296 10 0 FGAERN COc1ccccc1NC(=O)C(=O)N[C@@H]1CC(C)(C)Oc2ccccc21 ZINC000126562728 494790126 /nfs/dbraw/zinc/79/01/26/494790126.db2.gz AVBQDNAYTOSNES-OAHLLOKOSA-N 0 0 354.406 3.052 10 0 FGAERN Cc1cccc(NC(=O)N2CCN(c3cc(-c4cccnc4)[nH]n3)CC2)c1 ZINC000075541025 494790124 /nfs/dbraw/zinc/79/01/24/494790124.db2.gz WFEGMURMPXWZHW-UHFFFAOYSA-N 0 0 362.437 3.134 10 0 FGAERN CCn1ccnc1CSc1ncnc2c1cnn2Cc1ccccc1 ZINC000126565772 494790777 /nfs/dbraw/zinc/79/07/77/494790777.db2.gz OAKRQTPOAZTCLI-UHFFFAOYSA-N 0 0 350.451 3.383 10 0 FGAERN Cn1cc([C@H]2CCCN2CCOc2ccccc2Br)cn1 ZINC000126580500 494794029 /nfs/dbraw/zinc/79/40/29/494794029.db2.gz YKYAHFHKPHSPLU-OAHLLOKOSA-N 0 0 350.260 3.399 10 0 FGAERN O=C(c1ccnc(OC2CCCCC2)c1)N1CC[C@@H](Oc2cccnc2)C1 ZINC000092960264 494794555 /nfs/dbraw/zinc/79/45/55/494794555.db2.gz WVMOBQQPXSFXRS-LJQANCHMSA-N 0 0 367.449 3.482 10 0 FGAERN C[C@@H](NC(=O)CNC(=O)c1ccsc1)c1cccc(Br)c1 ZINC000108849476 494795072 /nfs/dbraw/zinc/79/50/72/494795072.db2.gz CWUOXYXFAVIIAB-SNVBAGLBSA-N 0 0 367.268 3.118 10 0 FGAERN C[C@H](NC(=O)[C@H]1C[C@@H]1c1ccc(F)cc1)c1ccc(S(C)(=O)=O)cc1 ZINC000025994670 494795466 /nfs/dbraw/zinc/79/54/66/494795466.db2.gz MCKKHNNGWLGPBL-RZAIGCCYSA-N 0 0 361.438 3.210 10 0 FGAERN Cn1cc([C@@H]2CCN(C(=O)Nc3ccc(OC(F)F)c(F)c3)C2)cn1 ZINC000116487620 494798239 /nfs/dbraw/zinc/79/82/39/494798239.db2.gz WFYDRAYYYUNXES-SNVBAGLBSA-N 0 0 354.332 3.182 10 0 FGAERN CC(=O)c1cccc(NC(=O)C(=O)N[C@@H]2CC(C)(C)Oc3ccccc32)c1 ZINC000126606882 494800543 /nfs/dbraw/zinc/80/05/43/494800543.db2.gz LFQDPSWATASJES-QGZVFWFLSA-N 0 0 366.417 3.246 10 0 FGAERN Cc1nnnn1-c1cc(NC(=O)N2CCC[C@H]2c2ccco2)ccc1F ZINC000116497486 494801395 /nfs/dbraw/zinc/80/13/95/494801395.db2.gz DBAPSDPSMRCFGY-AWEZNQCLSA-N 0 0 356.361 3.072 10 0 FGAERN CN(CC(F)(F)F)C(=O)[C@H](Cc1ccccc1)NC(=O)c1cccs1 ZINC000126619644 494803634 /nfs/dbraw/zinc/80/36/34/494803634.db2.gz FKJYIQSBIBMKMW-ZDUSSCGKSA-N 0 0 370.396 3.110 10 0 FGAERN Cc1nc(CN2CCCN(C(=O)N[C@@H](C)CCC(C)C)CC2)cs1 ZINC000116520250 494805479 /nfs/dbraw/zinc/80/54/79/494805479.db2.gz FTMJBNBQPMPQEB-HNNXBMFYSA-N 0 0 352.548 3.494 10 0 FGAERN Cc1ccsc1CNC(=O)N[C@H](C)c1ccc(S(C)(=O)=O)cc1 ZINC000026177342 494807347 /nfs/dbraw/zinc/80/73/47/494807347.db2.gz HRWGOPOYUOBZQI-GFCCVEGCSA-N 0 0 352.481 3.020 10 0 FGAERN CN(C)c1ccc(NC(=O)C(=O)N[C@H]2CC(C)(C)Oc3ccccc32)cc1 ZINC000126638893 494808337 /nfs/dbraw/zinc/80/83/37/494808337.db2.gz YZKJGTNUEBYASQ-KRWDZBQOSA-N 0 0 367.449 3.110 10 0 FGAERN COC(=O)c1ccccc1S(=O)(=O)N[C@@H](C)c1ccc(Cl)s1 ZINC000093050472 494815446 /nfs/dbraw/zinc/81/54/46/494815446.db2.gz MZBDXAKRFUIXQC-VIFPVBQESA-N 0 0 359.856 3.228 10 0 FGAERN C[C@H](NC(=O)[C@H](C)Sc1nnnn1C1CC1)c1ccc(Cl)s1 ZINC000093076960 494822133 /nfs/dbraw/zinc/82/21/33/494822133.db2.gz QSSPLHCQZKNMJT-YUMQZZPRSA-N 0 0 357.892 3.081 10 0 FGAERN Cn1cc([C@H]2CCN(C(=O)C(=O)Nc3ccccc3-c3ccccc3)C2)cn1 ZINC000116586416 494822669 /nfs/dbraw/zinc/82/26/69/494822669.db2.gz BUBNLFWPZLKYIK-KRWDZBQOSA-N 0 0 374.444 3.042 10 0 FGAERN O=C(NCc1cccnc1)N1C[C@@H](O)C[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000132131705 494825964 /nfs/dbraw/zinc/82/59/64/494825964.db2.gz NVSYLKXITWFCFN-JKSUJKDBSA-N 0 0 365.355 3.118 10 0 FGAERN CC(C)c1ccc([C@@H]2C[C@@H]2C(=O)N[C@H](C(N)=O)c2ccc(F)cc2)cc1 ZINC000132130921 494826084 /nfs/dbraw/zinc/82/60/84/494826084.db2.gz KHOXHLHRNVDBCQ-FHWLQOOXSA-N 0 0 354.425 3.395 10 0 FGAERN COc1ccc([C@H](C)NC(=O)c2cnc(-c3ncccn3)s2)cc1OC ZINC000121635496 494826172 /nfs/dbraw/zinc/82/61/72/494826172.db2.gz PBPPVWZVXHVWKM-NSHDSACASA-N 0 0 370.434 3.108 10 0 FGAERN O=C(NCc1ccccn1)N1C[C@@H](O)C[C@H]1c1cccc(C(F)(F)F)c1 ZINC000132131263 494826351 /nfs/dbraw/zinc/82/63/51/494826351.db2.gz IXJFIRGNIVTLEM-HOTGVXAUSA-N 0 0 365.355 3.118 10 0 FGAERN Cc1cc(C)n(-c2ccc(NCCc3ccc(Br)o3)nn2)n1 ZINC000132143093 494827716 /nfs/dbraw/zinc/82/77/16/494827716.db2.gz OUGBNWNHIRLAFU-UHFFFAOYSA-N 0 0 362.231 3.289 10 0 FGAERN COc1ccccc1N1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(F)c(F)c2)CC1 ZINC000109078699 494827792 /nfs/dbraw/zinc/82/77/92/494827792.db2.gz YJCGRLUXUOWADD-JKSUJKDBSA-N 0 0 372.415 3.426 10 0 FGAERN Cc1c(C(=O)N2CCN3CCCC[C@H]3C2)cnn1-c1cc(C)ccc1C ZINC000121643937 494828080 /nfs/dbraw/zinc/82/80/80/494828080.db2.gz IPAJVMRFZLCFKV-SFHVURJKSA-N 0 0 352.482 3.108 10 0 FGAERN CCCNC(=O)c1ccc(NCCc2ccc(Br)o2)nc1 ZINC000132141986 494828034 /nfs/dbraw/zinc/82/80/34/494828034.db2.gz APSBZXHADWNIGS-UHFFFAOYSA-N 0 0 352.232 3.232 10 0 FGAERN CCOC(=O)Cc1csc(NC(=O)[C@H]2C[C@@H]2c2ccc(F)c(F)c2)n1 ZINC000109082485 494828668 /nfs/dbraw/zinc/82/86/68/494828668.db2.gz HKURHRKLHUEGDQ-NEPJUHHUSA-N 0 0 366.389 3.269 10 0 FGAERN CN(C)C(=O)c1ccc(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)c(F)c2)cc1 ZINC000109083369 494828771 /nfs/dbraw/zinc/82/87/71/494828771.db2.gz AIOVUVWGZTXDCW-JKSUJKDBSA-N 0 0 358.388 3.087 10 0 FGAERN O=C(Nc1ccc(Cn2cncn2)cc1)[C@H]1C[C@@H]1c1ccc(F)c(F)c1 ZINC000109085488 494828913 /nfs/dbraw/zinc/82/89/13/494828913.db2.gz JXCPHVUQGCEECZ-CVEARBPZSA-N 0 0 354.360 3.347 10 0 FGAERN COc1ccc(NC(=O)[C@@H](NC(=O)c2ccccc2C)C(C)C)cc1OC ZINC000026520906 494829515 /nfs/dbraw/zinc/82/95/15/494829515.db2.gz QNNYYVSOJYLSRS-IBGZPJMESA-N 0 0 370.449 3.405 10 0 FGAERN CC(C)N(C(=O)[C@H](C)N1C(=O)c2ccccc2C1=O)c1ccc(F)cc1 ZINC000132159025 494831188 /nfs/dbraw/zinc/83/11/88/494831188.db2.gz NIXTZHKTXBOGGT-ZDUSSCGKSA-N 0 0 354.381 3.252 10 0 FGAERN COC(=O)c1sc(NC(=O)[C@@H]2C[C@H]2c2ccc(F)c(F)c2)nc1C ZINC000109099088 494831589 /nfs/dbraw/zinc/83/15/89/494831589.db2.gz LQTYPVVDXAYDGI-VHSXEESVSA-N 0 0 352.362 3.259 10 0 FGAERN COc1cccc(NC(=O)C(=O)N[C@H](C)c2ccc(F)cc2Cl)c1 ZINC000126753174 494832147 /nfs/dbraw/zinc/83/21/47/494832147.db2.gz HZYXNROETIXQFQ-SNVBAGLBSA-N 0 0 350.777 3.304 10 0 FGAERN Cc1cc(CNC(=O)[C@@H]2CC(=O)N(C)[C@H]2c2ccc(F)cc2)ccc1F ZINC000126751386 494832237 /nfs/dbraw/zinc/83/22/37/494832237.db2.gz HVRSKZXFHHALHI-APWZRJJASA-N 0 0 358.388 3.109 10 0 FGAERN CN(C(=O)[C@H]1C[C@@H]1c1ccc(F)c(F)c1)c1ccc(S(C)(=O)=O)cc1 ZINC000109101741 494832563 /nfs/dbraw/zinc/83/25/63/494832563.db2.gz ZCMWIFHKXVUXDV-CABCVRRESA-N 0 0 365.401 3.135 10 0 FGAERN O=C(Nc1ccc(-n2cncn2)c(F)c1)[C@H]1C[C@@H]1c1ccc(F)c(F)c1 ZINC000109101443 494832721 /nfs/dbraw/zinc/83/27/21/494832721.db2.gz DHAQGKCNDQRURS-OLZOCXBDSA-N 0 0 358.323 3.427 10 0 FGAERN CCN(C(=O)N[C@@H](C)c1ccc(Cl)s1)[C@@H](C)CS(=O)(=O)CC ZINC000093156203 494836552 /nfs/dbraw/zinc/83/65/52/494836552.db2.gz ZEALJAWRLRJVCR-QWRGUYRKSA-N 0 0 366.936 3.317 10 0 FGAERN COC(=O)[C@@H]1C[C@H]1C(=O)Nc1cccc(C[S@@](=O)C2CCCCC2)c1 ZINC000116685739 494837385 /nfs/dbraw/zinc/83/73/85/494837385.db2.gz COYKADVUXZGFIJ-BFIDETRKSA-N 0 0 363.479 3.016 10 0 FGAERN CCOC(=O)[C@H]1Sc2nnc(C)n2N[C@H]1c1ccc(Cl)cc1Cl ZINC000027028341 494848913 /nfs/dbraw/zinc/84/89/13/494848913.db2.gz GJBNDVCHBFVQTP-RYUDHWBXSA-N 0 0 373.265 3.216 10 0 FGAERN CCc1ccc(CCC(=O)N2CCC[C@H](Cn3nc(C)nc3C)C2)cc1 ZINC000116776628 494851678 /nfs/dbraw/zinc/85/16/78/494851678.db2.gz LCNXFFLMZDPWNJ-FQEVSTJZSA-N 0 0 354.498 3.329 10 0 FGAERN Cc1nc(C)n(C[C@H]2CCCN(C(=O)CCc3cccc(F)c3F)C2)n1 ZINC000116780728 494853516 /nfs/dbraw/zinc/85/35/16/494853516.db2.gz AKAGANSZBXVQGC-HNNXBMFYSA-N 0 0 362.424 3.045 10 0 FGAERN CCc1nc2n(n1)CCC[C@@H]2NC(=O)NCC1(c2ccccc2Cl)CC1 ZINC000132308830 494854989 /nfs/dbraw/zinc/85/49/89/494854989.db2.gz LATIUYTUKFLEIP-HNNXBMFYSA-N 0 0 373.888 3.360 10 0 FGAERN 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CC(C)(C)OC(=O)N[C@@H]1CC[C@H]2CN(C(=O)c3ccc(Cl)nc3)C[C@@H]21 ZINC000183988006 496188970 /nfs/dbraw/zinc/18/89/70/496188970.db2.gz YJCIGHHZFMJIIX-MELADBBJSA-N 0 0 365.861 3.110 10 0 FGAERN O=C(Cc1ccc(OC(F)(F)F)cc1)N1CCC[C@@H]1Cn1ccnc1 ZINC000177781251 496192948 /nfs/dbraw/zinc/19/29/48/496192948.db2.gz WXDBYQYUZRWJBA-CQSZACIVSA-N 0 0 353.344 3.015 10 0 FGAERN CC(C)c1nc2n(n1)C[C@H](NC(=O)[C@H](C)CCc1cccc(F)c1)CC2 ZINC000174985446 496194733 /nfs/dbraw/zinc/19/47/33/496194733.db2.gz AKIQDXBFJQRXTF-RHSMWYFYSA-N 0 0 358.461 3.241 10 0 FGAERN CCOCc1ccc(CNC(=O)N2CCC(c3ccnn3C)CC2)cc1 ZINC000156242241 496195926 /nfs/dbraw/zinc/19/59/26/496195926.db2.gz HRXUKBLIPQGBHN-UHFFFAOYSA-N 0 0 356.470 3.046 10 0 FGAERN C[C@H]1C[C@H]1NC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1 ZINC000152604704 496199395 /nfs/dbraw/zinc/19/93/95/496199395.db2.gz OMUWQPFJIOBTFI-BLLLJJGKSA-N 0 0 366.303 3.121 10 0 FGAERN CCOC(=O)c1cn(C)nc1NC(=O)N[C@@H]1CC[C@H](C)c2ccccc21 ZINC000184014562 496202068 /nfs/dbraw/zinc/20/20/68/496202068.db2.gz GWANOWXCDMVJAE-BLLLJJGKSA-N 0 0 356.426 3.357 10 0 FGAERN COC(=O)C(C)(C)CNC(=O)N[C@H](C)c1ccccc1Br ZINC000156266072 496202733 /nfs/dbraw/zinc/20/27/33/496202733.db2.gz SKHZVRGQYDMIHE-SNVBAGLBSA-N 0 0 357.248 3.009 10 0 FGAERN CC(C)Cc1nnc(NC(=O)CCC(=O)N[C@H](C)c2cccs2)s1 ZINC000184018541 496204337 /nfs/dbraw/zinc/20/43/37/496204337.db2.gz GCAKREWXXDGULB-LLVKDONJSA-N 0 0 366.512 3.394 10 0 FGAERN CCOCCC1(CNC(=O)N2CC[C@@]3(O)CCCC[C@H]3C2)CCCC1 ZINC000152617947 496204297 /nfs/dbraw/zinc/20/42/97/496204297.db2.gz HUHNXHBDPCGFOP-PXNSSMCTSA-N 0 0 352.519 3.310 10 0 FGAERN COCCCS(=O)(=O)NC[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl ZINC000152623901 496205927 /nfs/dbraw/zinc/20/59/27/496205927.db2.gz VONKVEBCGBNGMS-GXFFZTMASA-N 0 0 352.283 3.053 10 0 FGAERN NC(=O)CCOc1ccc(NC(=O)N[C@H]2CCCc3cc(F)ccc32)cc1 ZINC000161618614 496208612 /nfs/dbraw/zinc/20/86/12/496208612.db2.gz YGKGGTISXHZTLC-SFHVURJKSA-N 0 0 371.412 3.279 10 0 FGAERN Cc1ccc2c(c1)[C@H](NC(=O)Nc1ccc(NS(C)(=O)=O)cc1)[C@H](C)C2 ZINC000184034847 496211935 /nfs/dbraw/zinc/21/19/35/496211935.db2.gz JUNCMHQAPRVQBF-FZKQIMNGSA-N 0 0 373.478 3.422 10 0 FGAERN Cc1nc2n(n1)CCC[C@H]2NC(=O)Nc1ccc(-n2cccn2)c(Cl)c1 ZINC000177826900 496212902 /nfs/dbraw/zinc/21/29/02/496212902.db2.gz LDPLOJFWQWANDJ-CQSZACIVSA-N 0 0 371.832 3.082 10 0 FGAERN COc1ccc([C@H](C)NC(=O)c2cccc(-n3cccn3)c2)cc1OC ZINC000172227901 496217222 /nfs/dbraw/zinc/21/72/22/496217222.db2.gz UGJAJOKWYUERDK-AWEZNQCLSA-N 0 0 351.406 3.381 10 0 FGAERN C[C@H](O)C[C@@H](CNC(=O)N[C@@H](C)COCc1ccccc1)c1ccccc1 ZINC000177841269 496218482 /nfs/dbraw/zinc/21/84/82/496218482.db2.gz BHJPLJVGPXPMBQ-WFXMLNOXSA-N 0 0 370.493 3.446 10 0 FGAERN CNC(=O)c1ccc(Cl)c(NC(=O)N2CCCC[C@@H]2c2cn[nH]c2)c1 ZINC000184080701 496229928 /nfs/dbraw/zinc/22/99/28/496229928.db2.gz QNRFNVDPMRMULH-OAHLLOKOSA-N 0 0 361.833 3.182 10 0 FGAERN C[C@@H](O)CN1CCN(Cc2nc(-c3ccccc3Cl)cs2)C[C@@H]1C ZINC000186970059 496234571 /nfs/dbraw/zinc/23/45/71/496234571.db2.gz KNSAHNRHAFKNEC-UONOGXRCSA-N 0 0 365.930 3.350 10 0 FGAERN Cc1nc2n(n1)CCC[C@@H]2NC(=O)Nc1ccccc1CC(F)(F)F ZINC000177878727 496235808 /nfs/dbraw/zinc/23/58/08/496235808.db2.gz YUQRIIMXYMYQOH-ZDUSSCGKSA-N 0 0 353.348 3.348 10 0 FGAERN COCCn1ccc2ccc(NC(=O)C(=O)N[C@H](C)c3cccs3)cc21 ZINC000181012327 496240126 /nfs/dbraw/zinc/24/01/26/496240126.db2.gz QLQLYDOYZNHFBQ-CYBMUJFWSA-N 0 0 371.462 3.165 10 0 FGAERN O=C(Nc1ccc(OCC2CC2)cc1)C(=O)N[C@@H]1CCOc2ccccc21 ZINC000172282976 496240553 /nfs/dbraw/zinc/24/05/53/496240553.db2.gz YSJUVUWSNOUEIT-GOSISDBHSA-N 0 0 366.417 3.054 10 0 FGAERN C[C@@H]1CN(C(=O)Nc2ccc(OC(F)F)c3cccnc23)C[C@@H](C)O1 ZINC000186984924 496240592 /nfs/dbraw/zinc/24/05/92/496240592.db2.gz HIZRHLOYGCFTBF-GHMZBOCLSA-N 0 0 351.353 3.477 10 0 FGAERN Fc1ccccc1COc1ccc(CN2CCC[C@@H](n3cncn3)C2)cn1 ZINC000186989994 496241891 /nfs/dbraw/zinc/24/18/91/496241891.db2.gz JZCOXMXRGKEATC-GOSISDBHSA-N 0 0 367.428 3.228 10 0 FGAERN Cc1ccc(CCNC(=O)[C@H]2CCC(=O)N(C)[C@H]2c2ccccc2)cc1 ZINC000172294435 496243463 /nfs/dbraw/zinc/24/34/63/496243463.db2.gz MHXPVEZADAIHDS-FPOVZHCZSA-N 0 0 350.462 3.263 10 0 FGAERN COC(=O)C1(CNC(=O)N[C@@H]2CC3(CCCC3)Oc3ccccc32)CC1 ZINC000187015550 496253425 /nfs/dbraw/zinc/25/34/25/496253425.db2.gz ILCUAUGHWZADIO-OAHLLOKOSA-N 0 0 358.438 3.075 10 0 FGAERN CCCN(CCc1cccs1)C(=O)N[C@H]1CCCn2nc(CC)nc21 ZINC000184134690 496253864 /nfs/dbraw/zinc/25/38/64/496253864.db2.gz RDHABWFYNGKRQS-HNNXBMFYSA-N 0 0 361.515 3.401 10 0 FGAERN C[C@@H](NC(=O)N(C)CCc1ccc(Cl)cc1)c1nnc2n1CCCC2 ZINC000177924854 496253996 /nfs/dbraw/zinc/25/39/96/496253996.db2.gz DSSXIPIPSBSJKA-CYBMUJFWSA-N 0 0 361.877 3.213 10 0 FGAERN O=C(NCCOc1cccc(Cl)c1)N1CCC(Cn2cccn2)CC1 ZINC000172350223 496264913 /nfs/dbraw/zinc/26/49/13/496264913.db2.gz GBGHKQGHHBCOIT-UHFFFAOYSA-N 0 0 362.861 3.037 10 0 FGAERN CCOCCC1(C(=O)N[C@H](C)c2ccc(S(C)(=O)=O)cc2)CCCC1 ZINC000177959976 496266630 /nfs/dbraw/zinc/26/66/30/496266630.db2.gz LWQMQVNMMZITIA-OAHLLOKOSA-N 0 0 367.511 3.254 10 0 FGAERN CCO[C@H]1C[C@H](NC(=O)Cc2c(F)cccc2Cl)C12CCOCC2 ZINC000187048004 496268994 /nfs/dbraw/zinc/26/89/94/496268994.db2.gz IKSAUBCOURFWMO-HOTGVXAUSA-N 0 0 355.837 3.112 10 0 FGAERN CCO[C@@H]1C[C@H](NC(=O)c2cccc(OC(F)(F)F)c2)C12CCOCC2 ZINC000187053492 496270885 /nfs/dbraw/zinc/27/08/85/496270885.db2.gz HJNRFRNZRAQQST-LSDHHAIUSA-N 0 0 373.371 3.289 10 0 FGAERN C[C@@H]1CN([C@@H](CNC(=O)c2cc3ccccc3[nH]2)c2cccs2)CCO1 ZINC000177974824 496272037 /nfs/dbraw/zinc/27/20/37/496272037.db2.gz NNFYUPGXAAHFNW-KDOFPFPSSA-N 0 0 369.490 3.421 10 0 FGAERN C[C@@H]1CN([C@@H](CNC(=O)c2cccc3[nH]ccc32)c2cccs2)CCO1 ZINC000177979616 496274670 /nfs/dbraw/zinc/27/46/70/496274670.db2.gz AIFHMIDGHUTEQJ-KDOFPFPSSA-N 0 0 369.490 3.421 10 0 FGAERN Cc1ccc2c(c1)[C@H](NC(=O)c1c[nH]c(=O)c(Br)c1)[C@H](C)C2 ZINC000181113039 496275252 /nfs/dbraw/zinc/27/52/52/496275252.db2.gz CKGPJSGVSUZGOY-MEBBXXQBSA-N 0 0 361.239 3.109 10 0 FGAERN CCO[C@H]1C[C@H](NC(=O)c2ccccc2OCC2CC2)C12CCOCC2 ZINC000187066666 496277370 /nfs/dbraw/zinc/27/73/70/496277370.db2.gz SFKFCEGHGQVLPZ-OALUTQOASA-N 0 0 359.466 3.179 10 0 FGAERN COc1ccc(Cl)cc1C(=O)N1CCN(c2nc3ccccc3o2)CC1 ZINC000172386981 496277870 /nfs/dbraw/zinc/27/78/70/496277870.db2.gz QPQYCENJIKWDAZ-UHFFFAOYSA-N 0 0 371.824 3.452 10 0 FGAERN O=C(c1ccc2ncccc2c1)N1CCN(c2nc3ccccc3o2)CC1 ZINC000172390227 496280144 /nfs/dbraw/zinc/28/01/44/496280144.db2.gz PKLWXQWNFCCAJH-UHFFFAOYSA-N 0 0 358.401 3.338 10 0 FGAERN CCO[C@H]1C[C@H](NC(=O)c2ccccc2Br)C12CCOCC2 ZINC000187077081 496281756 /nfs/dbraw/zinc/28/17/56/496281756.db2.gz LGJLHFZTJUZWCD-GJZGRUSLSA-N 0 0 368.271 3.153 10 0 FGAERN CC(C)c1nnc2n1C[C@@H](NC(=O)Cc1c[nH]c3ccc(Cl)cc13)CC2 ZINC000172396070 496282074 /nfs/dbraw/zinc/28/20/74/496282074.db2.gz QCMJLFNXMSUZEV-AWEZNQCLSA-N 0 0 371.872 3.210 10 0 FGAERN CSc1cccc(C)c1NC(=O)C(=O)N[C@H]1CCOc2ccccc21 ZINC000187076017 496282463 /nfs/dbraw/zinc/28/24/63/496282463.db2.gz LIKQDPNZVZNBNY-AWEZNQCLSA-N 0 0 356.447 3.295 10 0 FGAERN CCCOc1ccccc1NC(=O)N(C)[C@H]1CCCN(c2cccnn2)C1 ZINC000172400590 496283470 /nfs/dbraw/zinc/28/34/70/496283470.db2.gz STXYQDDQMDAAHT-INIZCTEOSA-N 0 0 369.469 3.398 10 0 FGAERN COc1ccc2c(c1)nc(CNC(=O)[C@H]1C[C@H]1c1ccc(F)c(F)c1)n2C ZINC000184202876 496284410 /nfs/dbraw/zinc/28/44/10/496284410.db2.gz FYIDTEMSRLUDHU-KBPBESRZSA-N 0 0 371.387 3.280 10 0 FGAERN COc1ccc([C@H](Cc2ccc(F)cc2)NCc2nnnn2C(C)C)cc1 ZINC000181139625 496285165 /nfs/dbraw/zinc/28/51/65/496285165.db2.gz WCPAJUZYDCBGGN-IBGZPJMESA-N 0 0 369.444 3.475 10 0 FGAERN CCO[C@@H]1C[C@@H](NC(=O)c2cc3ccccc3nc2C)C12CCOCC2 ZINC000187086250 496286955 /nfs/dbraw/zinc/28/69/55/496286955.db2.gz XJFXEANWRCLPEM-RTBURBONSA-N 0 0 354.450 3.247 10 0 FGAERN COc1ccc([C@H](CO)N(C)C(=O)N[C@H](C)c2ccc(F)c(F)c2)cc1 ZINC000162061247 496289932 /nfs/dbraw/zinc/28/99/32/496289932.db2.gz WSXVXAAXCWPWEH-XIKOKIGWSA-N 0 0 364.392 3.409 10 0 FGAERN CCO[C@H]1C[C@@H](NC(=O)CCOc2cc(C)cc(C)c2)C12CCOCC2 ZINC000187103205 496294175 /nfs/dbraw/zinc/29/41/75/496294175.db2.gz CFERDCVXGUJWJB-MOPGFXCFSA-N 0 0 361.482 3.163 10 0 FGAERN CN(C(=O)/C=C/c1ccc(Cl)s1)[C@@H]1CCCN(c2cccnn2)C1 ZINC000172433244 496296332 /nfs/dbraw/zinc/29/63/32/496296332.db2.gz SXVYHHINDHRBMU-BUUCAEBMSA-N 0 0 362.886 3.332 10 0 FGAERN CCO[C@@H]1C[C@H](NC(=O)[C@@H](C)CCc2cccc(F)c2)C12CCOCC2 ZINC000187109509 496296693 /nfs/dbraw/zinc/29/66/93/496296693.db2.gz QLBISBUIAXTIDJ-ZYSHUDEJSA-N 0 0 363.473 3.485 10 0 FGAERN CC(=O)N1CCCc2ccc(S(=O)(=O)N[C@H](C)c3cccs3)cc21 ZINC000172441084 496298415 /nfs/dbraw/zinc/29/84/15/496298415.db2.gz FBPAURJLXHGBKL-GFCCVEGCSA-N 0 0 364.492 3.087 10 0 FGAERN C[C@@H](NC(=O)CCN1C(=O)c2ccccc2C1=O)c1ccc(F)cc1Cl ZINC000172441857 496298807 /nfs/dbraw/zinc/29/88/07/496298807.db2.gz ZEMHNLDZIDWIRZ-LLVKDONJSA-N 0 0 374.799 3.343 10 0 FGAERN COc1ccc([C@@H](CCO)NC(=O)N[C@@H]2CCCc3ccccc32)cc1 ZINC000162147756 496303760 /nfs/dbraw/zinc/30/37/60/496303760.db2.gz OWGBKEBCUTUCMF-WOJBJXKFSA-N 0 0 354.450 3.496 10 0 FGAERN CCO[C@@H]1C[C@@H](NC(=O)c2cc(F)c(Cl)cc2F)C12CCOCC2 ZINC000187128888 496305858 /nfs/dbraw/zinc/30/58/58/496305858.db2.gz KPDQTWGDVMAVEI-HUUCEWRRSA-N 0 0 359.800 3.322 10 0 FGAERN CCO[C@H]1C[C@@H](NC(=O)CCCc2ccc(C)s2)C12CCOCC2 ZINC000187127849 496306024 /nfs/dbraw/zinc/30/60/24/496306024.db2.gz GVTCGRWAAKAKME-SJORKVTESA-N 0 0 351.512 3.470 10 0 FGAERN CCO[C@H]1C[C@@H](NC(=O)CSc2cc(C)ccc2C)C12CCOCC2 ZINC000187131796 496307049 /nfs/dbraw/zinc/30/70/49/496307049.db2.gz GMKBXXAAEAMODK-MSOLQXFVSA-N 0 0 363.523 3.486 10 0 FGAERN COc1ccc(NC(=O)C(=O)N[C@H](C)c2ccc(C(C)C)cc2)c(C)n1 ZINC000178056585 496308838 /nfs/dbraw/zinc/30/88/38/496308838.db2.gz UJCXCPHZRFRKIV-CYBMUJFWSA-N 0 0 355.438 3.338 10 0 FGAERN C[C@H](NC(=O)Nc1ccc(S(C)(=O)=O)nc1)c1ccc(F)cc1Cl ZINC000172478020 496312180 /nfs/dbraw/zinc/31/21/80/496312180.db2.gz COZZLWYTEMXVTH-VIFPVBQESA-N 0 0 371.821 3.160 10 0 FGAERN O=C(Cc1cccc(OCC(F)(F)F)c1)N1CCO[C@@H]2CCCC[C@H]21 ZINC000162196367 496312614 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CC(C)(C)n1cc(CN2CCN(C(=O)NCC3(C)CCCC3)CC2)cn1 ZINC000114027739 495345554 /nfs/dbraw/zinc/34/55/54/495345554.db2.gz WKROYTCINQJVPF-UHFFFAOYSA-N 0 0 361.534 3.046 10 0 FGAERN O=C(CCOc1cccc(Br)c1)N[C@@H]1CCCCC[C@H]1O ZINC000135954995 495346174 /nfs/dbraw/zinc/34/61/74/495346174.db2.gz ONLDIEYBFDYKPG-HUUCEWRRSA-N 0 0 356.260 3.028 10 0 FGAERN COC(=O)[C@H]1CCCN1Cc1ccc(OCc2ccccc2)c(OC)c1 ZINC000124811383 495347340 /nfs/dbraw/zinc/34/73/40/495347340.db2.gz SWWRVXGJMUTFRM-GOSISDBHSA-N 0 0 355.434 3.412 10 0 FGAERN Cc1cnn(-c2ccc(NC(=O)N3CC[C@]4(O)CCCC[C@@H]4C3)cc2F)c1 ZINC000130228344 495359761 /nfs/dbraw/zinc/35/97/61/495359761.db2.gz UXJATXSXBLMTFW-FOIQADDNSA-N 0 0 372.444 3.479 10 0 FGAERN CCOC(=O)C1=C(C)NC(c2cscn2)=N[C@@H]1c1cccc(OC)c1 ZINC000114405019 495369515 /nfs/dbraw/zinc/36/95/15/495369515.db2.gz RCALJYBURUCSMJ-MRXNPFEDSA-N 0 0 357.435 3.080 10 0 FGAERN C[C@H](c1ccc(Cl)cc1)N(C)C(=O)CCCS(=O)(=O)N1CCCC1 ZINC000124955826 495370278 /nfs/dbraw/zinc/37/02/78/495370278.db2.gz 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CCC(=O)c1cccc(NC(=O)C(=O)N[C@H]2CCC[C@H](C(F)(F)F)C2)c1 ZINC000135759993 495331461 /nfs/dbraw/zinc/33/14/61/495331461.db2.gz HZDTUPOJXCGQRH-JSGCOSHPSA-N 0 0 370.371 3.455 10 0 FGAERN COc1cc(CCC(=O)N2CCCC[C@@H]2c2cn[nH]c2)cc(OC)c1OC ZINC000113890347 495333082 /nfs/dbraw/zinc/33/30/82/495333082.db2.gz WBGUQTYOVSMHTQ-MRXNPFEDSA-N 0 0 373.453 3.122 10 0 FGAERN CSCc1nc2ccccc2n1CC(=O)N1CCCC[C@H]1c1cn[nH]c1 ZINC000113897948 495334574 /nfs/dbraw/zinc/33/45/74/495334574.db2.gz POUUDGIXFHEFHQ-INIZCTEOSA-N 0 0 369.494 3.376 10 0 FGAERN CCc1csc([C@@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)n1 ZINC000113944546 495338936 /nfs/dbraw/zinc/33/89/36/495338936.db2.gz BVFOOFRHTDENOG-OAHLLOKOSA-N 0 0 350.509 3.415 10 0 FGAERN FC(F)(F)c1ccc2c(c1)nccc2N1CCO[C@H](Cn2cccn2)C1 ZINC000124773408 495340886 /nfs/dbraw/zinc/34/08/86/495340886.db2.gz SIZXSFLFQNUZPV-AWEZNQCLSA-N 0 0 362.355 3.356 10 0 FGAERN Cc1ccccc1NC(=O)N1CCN(Cc2cnn(C(C)(C)C)c2)CC1 ZINC000113998605 495343065 /nfs/dbraw/zinc/34/30/65/495343065.db2.gz UOUWRJKCQFUVKE-UHFFFAOYSA-N 0 0 355.486 3.296 10 0 FGAERN CCCn1c(CN2CCC(Nc3cccnn3)CC2)nc2ccccc21 ZINC000120291540 495345081 /nfs/dbraw/zinc/34/50/81/495345081.db2.gz HFFBRHZDUFSFLA-UHFFFAOYSA-N 0 0 350.470 3.313 10 0 FGAERN O=C(CSCc1cscn1)N1CCC[C@H]1C[C@@H](O)c1ccco1 ZINC000124837810 495352398 /nfs/dbraw/zinc/35/23/98/495352398.db2.gz VZDFJFXXEISJAK-UONOGXRCSA-N 0 0 352.481 3.084 10 0 FGAERN O=C(CN1CCCC[C@@H]1c1cn[nH]c1)Nc1ccccc1Br ZINC000114201390 495354347 /nfs/dbraw/zinc/35/43/47/495354347.db2.gz VMAXSCJSGVVTAV-OAHLLOKOSA-N 0 0 363.259 3.338 10 0 FGAERN COC(=O)[C@H](NC(=O)Cc1ccc(Br)s1)c1ccccc1 ZINC000114255814 495357683 /nfs/dbraw/zinc/35/76/83/495357683.db2.gz KNADVADVYXAQTJ-CQSZACIVSA-N 0 0 368.252 3.084 10 0 FGAERN Cc1cc(OC(F)F)c(C(=O)N2CCC(Nc3cccnn3)CC2)s1 ZINC000114330841 495363408 /nfs/dbraw/zinc/36/34/08/495363408.db2.gz VDBAGEOMDDYAPB-UHFFFAOYSA-N 0 0 368.409 3.165 10 0 FGAERN CC(C)c1nc([C@H]2CCCN2C(=O)NCC(C)(C)c2ccncc2)no1 ZINC000130303098 495370871 /nfs/dbraw/zinc/37/08/71/495370871.db2.gz PBBGAZWWKXEGRJ-OAHLLOKOSA-N 0 0 357.458 3.412 10 0 FGAERN CCN(Cc1ccc(OC)cc1)C(=O)[C@H](C)NC(=O)Nc1ccccc1 ZINC000105594989 495375394 /nfs/dbraw/zinc/37/53/94/495375394.db2.gz KNBVKDPUBABEEM-HNNXBMFYSA-N 0 0 355.438 3.254 10 0 FGAERN COc1ccc(C(C)(C)C(=O)N2CC[C@@]3(O)CCCC[C@@H]3C2)cc1OC ZINC000120426697 495375783 /nfs/dbraw/zinc/37/57/83/495375783.db2.gz KMCARXPVCVCBGS-IERDGZPVSA-N 0 0 361.482 3.135 10 0 FGAERN CCOc1cc(Cl)ccc1NC(=O)C(=O)N[C@@H](C)c1ccc(C)o1 ZINC000130345472 495377245 /nfs/dbraw/zinc/37/72/45/495377245.db2.gz QQXZHQAPWLAZMX-NSHDSACASA-N 0 0 350.802 3.456 10 0 FGAERN CCCOc1ccc(CNC(=O)CN2CCCC[C@H]2c2cn[nH]c2)cc1 ZINC000114484115 495382971 /nfs/dbraw/zinc/38/29/71/495382971.db2.gz MTRMDTUUSXKPEG-IBGZPJMESA-N 0 0 356.470 3.042 10 0 FGAERN CCOc1ccc(NC(=O)CNC(=O)N[C@H](C)c2ccccc2C)cc1 ZINC000120469591 495386485 /nfs/dbraw/zinc/38/64/85/495386485.db2.gz HRVVHTGCTSAZOO-OAHLLOKOSA-N 0 0 355.438 3.393 10 0 FGAERN Cc1cccc(COc2ccc(NC(=O)C(=O)N[C@H]3C[C@H]3C)c(C)c2)c1 ZINC000105724497 495389161 /nfs/dbraw/zinc/38/91/61/495389161.db2.gz MDYSSOVHRKHYSV-BEFAXECRSA-N 0 0 352.434 3.346 10 0 FGAERN COCc1nc2n(n1)CCC[C@H]2NC(=O)NCC1(CC(C)C)CCCC1 ZINC000120490831 495390119 /nfs/dbraw/zinc/39/01/19/495390119.db2.gz DGDLUQIGAOLJHN-OAHLLOKOSA-N 0 0 363.506 3.165 10 0 FGAERN Cc1ncc(CN2CCN(C(=O)CCc3ccc(F)cc3F)CC2)s1 ZINC000130454862 495394390 /nfs/dbraw/zinc/39/43/90/495394390.db2.gz CIPYNMGFKPXWNO-UHFFFAOYSA-N 0 0 365.449 3.007 10 0 FGAERN COCc1ccccc1CNC(=O)N1CCC[C@@H]1c1c(C)nn(C)c1C ZINC000114586997 495394781 /nfs/dbraw/zinc/39/47/81/495394781.db2.gz LABYLDPLZOWHKJ-GOSISDBHSA-N 0 0 356.470 3.230 10 0 FGAERN Cc1cc(C)c(NC(=O)N2CCCN(Cc3cnn(C)c3)CC2)c(C)c1 ZINC000136696442 495395235 /nfs/dbraw/zinc/39/52/35/495395235.db2.gz GUVHSKPNNNKBPB-UHFFFAOYSA-N 0 0 355.486 3.085 10 0 FGAERN Cc1nn(C)c(C)c1[C@@H]1CCCN1C(=O)NCc1ccc(OC(C)C)nc1 ZINC000114588004 495395648 /nfs/dbraw/zinc/39/56/48/495395648.db2.gz FKDHXGLWZSIXMY-KRWDZBQOSA-N 0 0 371.485 3.266 10 0 FGAERN CC(C)COC[C@@H](NC(=O)N1CCC(Cn2cccn2)CC1)c1ccco1 ZINC000125142372 495397535 /nfs/dbraw/zinc/39/75/35/495397535.db2.gz PWQVNNOWXHRFSU-GOSISDBHSA-N 0 0 374.485 3.312 10 0 FGAERN Fc1ccc(Br)c(CN2CCCN(c3cccnn3)CC2)c1 ZINC000106068855 495408532 /nfs/dbraw/zinc/40/85/32/495408532.db2.gz NUEUCRMKRRDKRQ-UHFFFAOYSA-N 0 0 365.250 3.091 10 0 FGAERN COCc1nc2n(n1)CCC[C@@H]2N[C@H](C)c1ccc(SC)c(F)c1 ZINC000125222732 495409084 /nfs/dbraw/zinc/40/90/84/495409084.db2.gz KIPSCYMFAXDWFO-RISCZKNCSA-N 0 0 350.463 3.471 10 0 FGAERN Cc1ncc(CN2CCN([C@H](C)C(=O)Nc3ccc(C)cc3C)CC2)s1 ZINC000106090627 495413251 /nfs/dbraw/zinc/41/32/51/495413251.db2.gz ULMCMSXXOSLRDV-MRXNPFEDSA-N 0 0 372.538 3.213 10 0 FGAERN CCCC[C@@H](CCC)CNC(=O)N1CCO[C@@H](c2nnc(CC)[nH]2)C1 ZINC000120601599 495414897 /nfs/dbraw/zinc/41/48/97/495414897.db2.gz BONVMIGQXGVOHD-HUUCEWRRSA-N 0 0 351.495 3.057 10 0 FGAERN CCOCC[N@@H+]1CCN([C@@H](C)C(=O)Nc2cccc(Cl)c2)C[C@H]1CC ZINC000106120116 495417757 /nfs/dbraw/zinc/41/77/57/495417757.db2.gz DKEZFYTVHDNDJN-MAUKXSAKSA-N 0 0 367.921 3.100 10 0 FGAERN Cc1noc([C@@H](C)N2CCN(Cc3ccccc3Br)CC2)n1 ZINC000106135693 495418648 /nfs/dbraw/zinc/41/86/48/495418648.db2.gz URUHKFFAOJZEDS-GFCCVEGCSA-N 0 0 365.275 3.019 10 0 FGAERN CCc1noc([C@@H](C)N2CCN(CCCOc3ccccc3C)CC2)n1 ZINC000106136913 495419851 /nfs/dbraw/zinc/41/98/51/495419851.db2.gz MPNBTWHXNPQCJA-QGZVFWFLSA-N 0 0 358.486 3.088 10 0 FGAERN CCCOc1ccc(NC(=O)N[C@H]2CCc3nc(C(C)C)nn3C2)cc1 ZINC000125294203 495420878 /nfs/dbraw/zinc/42/08/78/495420878.db2.gz QBNBRWIQJSNEMP-HNNXBMFYSA-N 0 0 357.458 3.327 10 0 FGAERN Cc1ccc(NC(=O)N2CC[C@]3(O)CCCC[C@@H]3C2)cc1C(=O)NC(C)C ZINC000125290113 495421020 /nfs/dbraw/zinc/42/10/20/495421020.db2.gz HQOISQCWNMMJSH-IIBYNOLFSA-N 0 0 373.497 3.292 10 0 FGAERN CN(Cc1cccnc1Cl)C[C@@H](c1cccs1)N1CCOCC1 ZINC000106160345 495421266 /nfs/dbraw/zinc/42/12/66/495421266.db2.gz ZPIZVPQHXLILEZ-HNNXBMFYSA-N 0 0 351.903 3.302 10 0 FGAERN O=C(NC[C@@H]1CCCS1)N1C[C@H](O)C[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000130626836 495421848 /nfs/dbraw/zinc/42/18/48/495421848.db2.gz IUOKNQQHEYSEHP-QLFBSQMISA-N 0 0 374.428 3.418 10 0 FGAERN CC(C)N1CC[C@@H](NC(=O)N[C@H](C)c2ccc(Cl)c(Cl)c2)C1=O ZINC000114780816 495424690 /nfs/dbraw/zinc/42/46/90/495424690.db2.gz SETDOGGUGOJLPF-QMTHXVAHSA-N 0 0 358.269 3.363 10 0 FGAERN Cc1cc(C)n(C[C@@H]2CN(Cc3ccc(Br)s3)CCO2)n1 ZINC000106199854 495428590 /nfs/dbraw/zinc/42/85/90/495428590.db2.gz YBFPQEHWIDDTMR-ZDUSSCGKSA-N 0 0 370.316 3.225 10 0 FGAERN Cc1cc(C)n(C[C@@H]2CN(CCOc3cccc4ccccc43)CCO2)n1 ZINC000106199323 495429016 /nfs/dbraw/zinc/42/90/16/495429016.db2.gz MTMNYVGXLXRKAR-FQEVSTJZSA-N 0 0 365.477 3.433 10 0 FGAERN COCc1nc2n(n1)CCC[C@H]2N[C@H](C)c1cc(Cl)ccc1OC ZINC000125360025 495432109 /nfs/dbraw/zinc/43/21/09/495432109.db2.gz XWYYBTYGIQCHKO-BXUZGUMPSA-N 0 0 350.850 3.272 10 0 FGAERN Cc1cc2occ(CC(=O)N3CCC(Nc4cccnn4)CC3)c2cc1C ZINC000114861463 495436086 /nfs/dbraw/zinc/43/60/86/495436086.db2.gz RLVKYEMDZUQNEL-UHFFFAOYSA-N 0 0 364.449 3.485 10 0 FGAERN CCOc1ccc(-c2noc(CN3CCC[C@H](n4cc(C)cn4)C3)n2)cc1 ZINC000106221377 495436375 /nfs/dbraw/zinc/43/63/75/495436375.db2.gz GKQIRHWZNAEAJF-KRWDZBQOSA-N 0 0 367.453 3.477 10 0 FGAERN CCc1nc2n(n1)C[C@H](NC(=O)c1ccc(-c3ccsc3)nc1C)CC2 ZINC000114866651 495436876 /nfs/dbraw/zinc/43/68/76/495436876.db2.gz ZDXWJEWOLXWJFA-CQSZACIVSA-N 0 0 367.478 3.017 10 0 FGAERN CCc1nc2n(n1)C[C@@H](NC(=O)[C@H](C)Oc1cccc(C(C)(C)C)c1)CC2 ZINC000114862761 495437111 /nfs/dbraw/zinc/43/71/11/495437111.db2.gz IUXQWZZQGQYTDH-HOCLYGCPSA-N 0 0 370.497 3.037 10 0 FGAERN Cc1cnn([C@@H]2CCCN(CC(=O)Nc3ccc(OC(F)F)cc3)C2)c1 ZINC000106224017 495437771 /nfs/dbraw/zinc/43/77/71/495437771.db2.gz PORSDVPRCFGEJT-OAHLLOKOSA-N 0 0 364.396 3.069 10 0 FGAERN CCCCCOc1ccc(C(=O)N[C@@H]2CCc3nc(CC)nn3C2)cc1 ZINC000114869260 495437920 /nfs/dbraw/zinc/43/79/20/495437920.db2.gz RBVIYCPJOXAZKD-MRXNPFEDSA-N 0 0 356.470 3.154 10 0 FGAERN CCc1nc2n(n1)C[C@H](NC(=O)Nc1cccc(SC(F)F)c1)CC2 ZINC000114906139 495439991 /nfs/dbraw/zinc/43/99/91/495439991.db2.gz QDMVUSJNPMXDFW-LLVKDONJSA-N 0 0 367.425 3.292 10 0 FGAERN CCc1nc2n(n1)C[C@H](NC(=O)N[C@@H](C)c1cccc3ccccc31)CC2 ZINC000114913782 495440724 /nfs/dbraw/zinc/44/07/24/495440724.db2.gz RYTDNOAKWUHKCZ-GOEBONIOSA-N 0 0 363.465 3.369 10 0 FGAERN CCS(=O)(=O)c1ccc2oc(CN3CCCC[C@@H]3c3cn[nH]c3)nc2c1 ZINC000137425764 495440893 /nfs/dbraw/zinc/44/08/93/495440893.db2.gz NPFBZHICILVXEJ-MRXNPFEDSA-N 0 0 374.466 3.072 10 0 FGAERN COC(=O)[C@@H]1[C@H](CI)CCN1[C@@H](C)c1ccccc1 ZINC000114962722 495447967 /nfs/dbraw/zinc/44/79/67/495447967.db2.gz BEFIFBAHIVUKCQ-UBHSHLNASA-N 0 0 373.234 3.046 10 0 FGAERN C[C@H]1COC[C@H](C)N1C(=O)c1ccn(-c2ccc(Cl)c(Cl)c2)n1 ZINC000130804402 495448235 /nfs/dbraw/zinc/44/82/35/495448235.db2.gz FUCRXOCNLIURIZ-QWRGUYRKSA-N 0 0 354.237 3.429 10 0 FGAERN CC(C)c1nc2c(n1C)CCN([C@@H](C)C(=O)NC[C@@H](C)c1ccccc1)C2 ZINC000106373664 495450732 /nfs/dbraw/zinc/45/07/32/495450732.db2.gz WDRHKFLYPTWXMY-SJORKVTESA-N 0 0 368.525 3.210 10 0 FGAERN CC[C@@H](O)CN1CCN(C(=O)c2sccc2-c2ccc(C)cc2)CC1 ZINC000106397252 495451582 /nfs/dbraw/zinc/45/15/82/495451582.db2.gz SGQBBUOYLABTJR-QGZVFWFLSA-N 0 0 358.507 3.252 10 0 FGAERN COc1ccc(C(C)(C)CNC(=O)N2CC[C@@]3(O)CCCC[C@H]3C2)cc1 ZINC000137961339 495454379 /nfs/dbraw/zinc/45/43/79/495454379.db2.gz VSGDPMNYPYKGGV-UWJYYQICSA-N 0 0 360.498 3.309 10 0 FGAERN O=C(Nc1cc2c(cc1F)NC(=O)CC2)N[C@H]1CCOc2ccccc21 ZINC000120770125 495454461 /nfs/dbraw/zinc/45/44/61/495454461.db2.gz ZARGSJKFOICNLR-AWEZNQCLSA-N 0 0 355.369 3.356 10 0 FGAERN COC(=O)C[C@@H](NC(=O)c1cnc(-c2ccccc2)nc1)c1ccccc1 ZINC000138224383 495457392 /nfs/dbraw/zinc/45/73/92/495457392.db2.gz ABCKFXNIBVVWFQ-GOSISDBHSA-N 0 0 361.401 3.178 10 0 FGAERN COC(=O)[C@@H]1C[C@H]1C(=O)Nc1ccc(Cl)c(C(=O)Nc2ccccc2)c1 ZINC000115114263 495463722 /nfs/dbraw/zinc/46/37/22/495463722.db2.gz WPBIBJGGAMHNSX-ZIAGYGMSSA-N 0 0 372.808 3.340 10 0 FGAERN COc1ccccc1OC[C@@H](C)CNC(=O)N1CCC(c2cc[nH]n2)CC1 ZINC000125604527 495469639 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FGAERN Cc1nc(C[C@H]2CCCN(CC(=O)Nc3ccc(F)cc3Cl)C2)no1 ZINC000171407893 495860968 /nfs/dbraw/zinc/86/09/68/495860968.db2.gz PVBUNCUKKMVEHE-GFCCVEGCSA-N 0 0 366.824 3.064 10 0 FGAERN Cc1nc(C[C@@H]2CCCN(CC(=O)Nc3cccc4ccccc43)C2)no1 ZINC000171408081 495861354 /nfs/dbraw/zinc/86/13/54/495861354.db2.gz ILIWQVVJMVCFGT-INIZCTEOSA-N 0 0 364.449 3.424 10 0 FGAERN CC(C)C(=O)N(C)Cc1ccc(C(=O)N2CC[C@]3(O)CCCC[C@@H]3C2)cc1 ZINC000151509387 495861493 /nfs/dbraw/zinc/86/14/93/495861493.db2.gz DEFVFHQJPLDLJU-DENIHFKCSA-N 0 0 372.509 3.068 10 0 FGAERN O=C(c1ccc(N2CCCCC2)cc1)N1CCO[C@@H](c2nccs2)C1 ZINC000174217430 495868298 /nfs/dbraw/zinc/86/82/98/495868298.db2.gz KGOJNWNSJXQWRA-QGZVFWFLSA-N 0 0 357.479 3.347 10 0 FGAERN O=C(c1cnn(Cc2ccccc2Cl)c1)N1CC[C@@]2(O)CCCC[C@H]2C1 ZINC000151529669 495869008 /nfs/dbraw/zinc/86/90/08/495869008.db2.gz DBYYSGNJZPBLPJ-PXNSSMCTSA-N 0 0 373.884 3.352 10 0 FGAERN O=C(NCc1nnc(-c2ccccc2)s1)N[C@H]1COc2ccccc21 ZINC000151529581 495869463 /nfs/dbraw/zinc/86/94/63/495869463.db2.gz SZIPPASDKSJLRB-AWEZNQCLSA-N 0 0 352.419 3.138 10 0 FGAERN C[C@@H]1CN(C(=O)NCCCC(=O)Nc2ccc(Cl)cc2)CCS1 ZINC000171428913 495869995 /nfs/dbraw/zinc/86/99/95/495869995.db2.gz DQZIGNKZQGHSBT-GFCCVEGCSA-N 0 0 355.891 3.206 10 0 FGAERN CCOCCN1CCN(Cc2nnc(-c3ccccc3)s2)C[C@H]1CC ZINC000155194353 495870078 /nfs/dbraw/zinc/87/00/78/495870078.db2.gz MPGXWLTVGVDCFN-QGZVFWFLSA-N 0 0 360.527 3.138 10 0 FGAERN Cc1nc(C)n(C[C@@H]2CCCN(C(=O)c3cccc(Cl)c3F)C2)n1 ZINC000155199527 495872196 /nfs/dbraw/zinc/87/21/96/495872196.db2.gz HHCWYSQRJTUHSQ-CYBMUJFWSA-N 0 0 350.825 3.240 10 0 FGAERN Cc1ccc([C@H](C)NC(=O)N2CCC[C@@H]([C@H](O)c3nccn3C)C2)cc1F ZINC000151541319 495872722 /nfs/dbraw/zinc/87/27/22/495872722.db2.gz OXAHKOQVTPTPPZ-LESCRADOSA-N 0 0 374.460 3.084 10 0 FGAERN Cc1cc(Br)c2c(c1)CN(C(=O)N[C@@H](C)[C@H]1CCCO1)CC2 ZINC000186153491 495875476 /nfs/dbraw/zinc/87/54/76/495875476.db2.gz BRDGPXVOLRNTHG-BLLLJJGKSA-N 0 0 367.287 3.393 10 0 FGAERN Cn1cc([C@@H]2CCCN2C(=O)NCc2ccccc2OC(F)(F)F)cn1 ZINC000171450259 495878835 /nfs/dbraw/zinc/87/88/35/495878835.db2.gz PNUSXVWQGOEKOW-AWEZNQCLSA-N 0 0 368.359 3.365 10 0 FGAERN Cn1cc([C@H]2CCCN2C(=O)NCc2ccc(OC(F)(F)F)cc2)cn1 ZINC000171448828 495879008 /nfs/dbraw/zinc/87/90/08/495879008.db2.gz GGQLSZYGGIVKTA-OAHLLOKOSA-N 0 0 368.359 3.365 10 0 FGAERN COC[C@@H](C)C(=O)NC[C@H](c1ccccc1)N1CCc2sccc2C1 ZINC000171450727 495879163 /nfs/dbraw/zinc/87/91/63/495879163.db2.gz SGNAWILMZCATRR-CRAIPNDOSA-N 0 0 358.507 3.246 10 0 FGAERN Cc1ccc(OCCCC(=O)N[C@@H]2CCCN(c3cccnn3)C2)cc1C ZINC000174246162 495879793 /nfs/dbraw/zinc/87/97/93/495879793.db2.gz OVFRKQKULPOMCH-GOSISDBHSA-N 0 0 368.481 3.038 10 0 FGAERN COC(=O)C[C@H](NC(=O)Nc1cccc(N(C)C)c1C)c1ccccc1 ZINC000180150308 495880991 /nfs/dbraw/zinc/88/09/91/495880991.db2.gz SBUPWSAIBRYMHM-KRWDZBQOSA-N 0 0 355.438 3.487 10 0 FGAERN CC1CCN(c2ccc(C(=O)N3CC[C@]4(O)CCCC[C@H]4C3)cn2)CC1 ZINC000151575332 495883577 /nfs/dbraw/zinc/88/35/77/495883577.db2.gz QDZBSTVPPUACDJ-GHTZIAJQSA-N 0 0 357.498 3.085 10 0 FGAERN Cn1cc([C@@H]2CCCN2C(=O)NCc2cccnc2OC2CCCC2)cn1 ZINC000171461230 495884779 /nfs/dbraw/zinc/88/47/79/495884779.db2.gz KSWHBYGDLJYOEZ-SFHVURJKSA-N 0 0 369.469 3.183 10 0 FGAERN COc1ccc(CC[C@@H](C)NC(=O)N2CCC[C@@H]2c2cnn(C)c2)cc1 ZINC000171467279 495887519 /nfs/dbraw/zinc/88/75/19/495887519.db2.gz BAFFWVFGXGHSKB-DNVCBOLYSA-N 0 0 356.470 3.297 10 0 FGAERN COC(=O)C1CCC(C(=O)Nc2ccc(-n3ccnc3)c(Cl)c2)CC1 ZINC000180181796 495895068 /nfs/dbraw/zinc/89/50/68/495895068.db2.gz OSSXHCZSTXSYSJ-UHFFFAOYSA-N 0 0 361.829 3.444 10 0 FGAERN O=C([C@H]1C[C@@H]1c1ccc(F)c(F)c1)N1CCN(c2cc(C3CC3)[nH]n2)CC1 ZINC000186210278 495896891 /nfs/dbraw/zinc/89/68/91/495896891.db2.gz VEVNMNQHEFCVAC-CABCVRRESA-N 0 0 372.419 3.018 10 0 FGAERN C[C@@H](O)C[N@@H+]1CCN(C(=O)CC(c2ccccc2)c2ccccc2)C[C@H]1C ZINC000174293364 495897170 /nfs/dbraw/zinc/89/71/70/495897170.db2.gz YJPZPOXHFVNVNX-RTBURBONSA-N 0 0 366.505 3.122 10 0 FGAERN COC(=O)C1CCC(C(=O)Nc2ccc(-n3cccn3)c(Cl)c2)CC1 ZINC000180192144 495899762 /nfs/dbraw/zinc/89/97/62/495899762.db2.gz SROHIQZISVQHOS-UHFFFAOYSA-N 0 0 361.829 3.444 10 0 FGAERN Cc1cc(C(=O)N2CCN(C[C@@H](C)O)[C@@H](C)C2)c(C)n1C1CCCCC1 ZINC000174299260 495900131 /nfs/dbraw/zinc/90/01/31/495900131.db2.gz NLBSMTIZFWNOPC-DLBZAZTESA-N 0 0 361.530 3.137 10 0 FGAERN Cc1cc(NC(=O)[C@@H]2CC[C@H](C)O2)n(-c2cccc(Br)c2)n1 ZINC000151646064 495904586 /nfs/dbraw/zinc/90/45/86/495904586.db2.gz YTLXGGBUNMCVHF-FZMZJTMJSA-N 0 0 364.243 3.449 10 0 FGAERN Cn1cc([C@H]2CCCN2C(=O)Nc2cccc(N3CCCCC3=O)c2)cn1 ZINC000171510673 495905342 /nfs/dbraw/zinc/90/53/42/495905342.db2.gz NRCFHECYRJHENB-GOSISDBHSA-N 0 0 367.453 3.306 10 0 FGAERN COc1cc(NC(=O)N[C@@H](C)c2nnc3n2CCCC3)ccc1OC(C)C ZINC000186249361 495913915 /nfs/dbraw/zinc/91/39/15/495913915.db2.gz CFAZEJMLEKMSED-ZDUSSCGKSA-N 0 0 373.457 3.293 10 0 FGAERN COc1ccc2nc(Cl)c(C(=O)N[C@@H]3CCCn4nc(C)nc43)cc2c1 ZINC000180238841 495921161 /nfs/dbraw/zinc/92/11/61/495921161.db2.gz VILYMOPIJLYXIS-OAHLLOKOSA-N 0 0 371.828 3.062 10 0 FGAERN C[C@H](NC(=O)N1CCN(c2ccc(C(F)(F)F)cc2)CC1)[C@H]1CCCO1 ZINC000151703435 495923830 /nfs/dbraw/zinc/92/38/30/495923830.db2.gz BZPQNMOVFRSGCQ-XJKSGUPXSA-N 0 0 371.403 3.105 10 0 FGAERN C[C@@H](O)CN1CCN(C(=O)C2(Sc3ccccc3)CCCC2)C[C@H]1C ZINC000174355941 495925397 /nfs/dbraw/zinc/92/53/97/495925397.db2.gz ZJRLUSITAFAXMI-IAGOWNOFSA-N 0 0 362.539 3.005 10 0 FGAERN CN(C)c1ccccc1NC(=O)C(=O)N[C@H]1CCCc2cc(F)ccc21 ZINC000155350740 495929878 /nfs/dbraw/zinc/92/98/78/495929878.db2.gz YNOLOBJFIFBBBQ-INIZCTEOSA-N 0 0 355.413 3.024 10 0 FGAERN C[C@H]1CN(C(=O)c2ccc(=O)n(Cc3ccccc3Cl)c2)CCS1 ZINC000171575478 495932210 /nfs/dbraw/zinc/93/22/10/495932210.db2.gz OISAMPVIKFDWDR-ZDUSSCGKSA-N 0 0 362.882 3.128 10 0 FGAERN CCOc1c(Br)cc(C(=O)N2CCS[C@H](C)C2)cc1OC ZINC000171575338 495932403 /nfs/dbraw/zinc/93/24/03/495932403.db2.gz LSQNPZQDUYVQRJ-SNVBAGLBSA-N 0 0 374.300 3.434 10 0 FGAERN C[C@@H]1CN(C(=O)[C@H](NC(=O)c2ccccc2)c2ccccc2)CCS1 ZINC000171575788 495932681 /nfs/dbraw/zinc/93/26/81/495932681.db2.gz CNBYVFXZFZFHRT-CRAIPNDOSA-N 0 0 354.475 3.122 10 0 FGAERN Cc1ccc(N2CCOC2=O)cc1NC(=O)N1CCCC[C@@H]1c1cn[nH]c1 ZINC000186304185 495937706 /nfs/dbraw/zinc/93/77/06/495937706.db2.gz CMCSBYVGLLZYPW-QGZVFWFLSA-N 0 0 369.425 3.434 10 0 FGAERN Cc1cnn(-c2ccc(C(N)=O)cc2NC(=O)[C@@H]2C[C@@H]2C2CCCCC2)c1 ZINC000183357151 495945072 /nfs/dbraw/zinc/94/50/72/495945072.db2.gz FYSNHANVTIBQPG-IAGOWNOFSA-N 0 0 366.465 3.435 10 0 FGAERN CC(C)(CO)[C@H](CNC(=O)N1CCCC[C@@H]1c1cn[nH]c1)c1ccccc1 ZINC000183357952 495945809 /nfs/dbraw/zinc/94/58/09/495945809.db2.gz DHQNOAYMYHMCJO-RTBURBONSA-N 0 0 370.497 3.449 10 0 FGAERN CC(C)(CO)[C@@H](CNC(=O)N1CCCC[C@@H]1c1cn[nH]c1)c1ccccc1 ZINC000183357931 495946326 /nfs/dbraw/zinc/94/63/26/495946326.db2.gz DHQNOAYMYHMCJO-RBUKOAKNSA-N 0 0 370.497 3.449 10 0 FGAERN CCn1cnnc1C1CCN([C@@H](C)C(=O)Nc2ccc(SC)cc2)CC1 ZINC000155411797 495949596 /nfs/dbraw/zinc/94/95/96/495949596.db2.gz SNCLHYICFNRWCZ-AWEZNQCLSA-N 0 0 373.526 3.227 10 0 FGAERN CC(C)COc1ccc([C@H](C)NC(=O)N[C@H](C)C(=O)NC(C)(C)C)cc1 ZINC000155417470 495951440 /nfs/dbraw/zinc/95/14/40/495951440.db2.gz UHEHTNJWAQUWDG-LSDHHAIUSA-N 0 0 363.502 3.385 10 0 FGAERN CCc1ccc(NC(=O)[C@@H]2CCC(=O)N(C)[C@H]2c2cnn(C)c2)cc1CC ZINC000180323491 495952121 /nfs/dbraw/zinc/95/21/21/495952121.db2.gz NCLDGVLQAGSRSY-QUCCMNQESA-N 0 0 368.481 3.093 10 0 FGAERN Cc1nccn1C[C@@H]1CCCN1C(=O)c1ccc(F)cc1Br ZINC000177161407 495954643 /nfs/dbraw/zinc/95/46/43/495954643.db2.gz SSFYXSBVHVUGJA-ZDUSSCGKSA-N 0 0 366.234 3.398 10 0 FGAERN COC(=O)c1cc(C(C)C)ccc1NC(=O)C(=O)N[C@@H](C)c1cccs1 ZINC000183397914 495964576 /nfs/dbraw/zinc/96/45/76/495964576.db2.gz KKZYZZLFZBZZPW-LBPRGKRZSA-N 0 0 374.462 3.474 10 0 FGAERN COc1ccc(CNC(=O)N[C@H](C)COCc2ccccc2)cc1OC ZINC000174453770 495965218 /nfs/dbraw/zinc/96/52/18/495965218.db2.gz BPHQTNQCVUONAN-OAHLLOKOSA-N 0 0 358.438 3.108 10 0 FGAERN Cc1nc(-c2ccccc2)oc1C(=O)N[C@H]1CCc2nnc(C(C)C)n2C1 ZINC000174454706 495965947 /nfs/dbraw/zinc/96/59/47/495965947.db2.gz CRPLSJVCBSMMMY-HNNXBMFYSA-N 0 0 365.437 3.110 10 0 FGAERN CC[C@@H](C(=O)N1CCC[C@@H](Cc2noc(C)n2)C1)c1ccc(OC)cc1 ZINC000180361741 495966021 /nfs/dbraw/zinc/96/60/21/495966021.db2.gz ULNKUEFPBYUGGT-MAUKXSAKSA-N 0 0 357.454 3.362 10 0 FGAERN Cc1nccn1C[C@@H]1CCCN1C(=O)c1cnn(-c2cccc(Cl)c2)c1 ZINC000177184775 495966400 /nfs/dbraw/zinc/96/64/00/495966400.db2.gz QHKMESZJPRBOPH-SFHVURJKSA-N 0 0 369.856 3.335 10 0 FGAERN CC[C@@H](CNC(=O)N[C@@H]1CCc2nc(C(C)C)nn2C1)c1ccccc1 ZINC000155473365 495967375 /nfs/dbraw/zinc/96/73/75/495967375.db2.gz APLGBIZRLWXLSX-DOTOQJQBSA-N 0 0 355.486 3.209 10 0 FGAERN COc1ccccc1OC[C@H](C)CNC(=O)N1CCCC[C@@H]1c1cn[nH]c1 ZINC000183403909 495968326 /nfs/dbraw/zinc/96/83/26/495968326.db2.gz GNCRWQOAUGANRF-NVXWUHKLSA-N 0 0 372.469 3.370 10 0 FGAERN O=C(NCCSCc1ccccc1F)N1CCC(c2cc[nH]n2)CC1 ZINC000155480087 495970393 /nfs/dbraw/zinc/97/03/93/495970393.db2.gz PHIMNIJOWBLPQJ-UHFFFAOYSA-N 0 0 362.474 3.371 10 0 FGAERN Cc1nccn1C[C@@H]1CCCN1C(=O)c1ccc(NC(=O)[C@H]2C[C@@H]2C)cc1 ZINC000177205127 495977017 /nfs/dbraw/zinc/97/70/17/495977017.db2.gz YXOFBAFGAGGBCH-JVPBZIDWSA-N 0 0 366.465 3.091 10 0 FGAERN COc1cc(-c2ccccc2)sc1C(=O)N1CCC[C@@H](n2cncn2)C1 ZINC000171661807 495977155 /nfs/dbraw/zinc/97/71/55/495977155.db2.gz RUMZYTXEFDGDME-OAHLLOKOSA-N 0 0 368.462 3.493 10 0 FGAERN CCO[C@@H]1C[C@@H](N[C@@H](C)c2noc(-c3ccccc3)n2)C12CCOCC2 ZINC000186388326 495977991 /nfs/dbraw/zinc/97/79/91/495977991.db2.gz WHLZEXDCRALHGR-USXIJHARSA-N 0 0 357.454 3.361 10 0 FGAERN Cc1noc([C@H]2COCCN2C(=O)c2sc3cccc(F)c3c2C)n1 ZINC000155511059 495978470 /nfs/dbraw/zinc/97/84/70/495978470.db2.gz MXOSNIMVNIHIJC-GFCCVEGCSA-N 0 0 361.398 3.254 10 0 FGAERN CN(C(=O)[C@H]1CNC(=O)C1)[C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000177212474 495979435 /nfs/dbraw/zinc/97/94/35/495979435.db2.gz DQYIGWYDHHCYNT-RDTXWAMCSA-N 0 0 360.816 3.163 10 0 FGAERN Cc1cc(Cl)ccc1NC(=O)CN1CCO[C@H](c2nccs2)C1 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C[C@H]1CN(C(=O)Nc2cc(Cl)cc(Cl)c2)C[C@@H]1N1CCOCC1 ZINC000177689005 496160661 /nfs/dbraw/zinc/16/06/61/496160661.db2.gz ARQDHBDXHIJYKJ-NHYWBVRUSA-N 0 0 358.269 3.178 10 0 FGAERN O=C(N[C@H]1CCS(=O)(=O)c2ccccc21)c1cc2cc(F)ccc2o1 ZINC000172104652 496166234 /nfs/dbraw/zinc/16/62/34/496166234.db2.gz AQJKICNLAXHJEU-AWEZNQCLSA-N 0 0 359.378 3.220 10 0 FGAERN C[C@@H]1CN(C(=O)Nc2ccc3c4c(cccc42)CC3)C[C@H]1N1CCOCC1 ZINC000177724625 496173651 /nfs/dbraw/zinc/17/36/51/496173651.db2.gz XCSLSGDMPTWQAR-FOIQADDNSA-N 0 0 365.477 3.123 10 0 FGAERN COc1cc(C)c(NC(=O)N2CCC(Nc3cccnn3)CC2)cc1F ZINC000186851280 496179647 /nfs/dbraw/zinc/17/96/47/496179647.db2.gz QISUEVRKEGBFHU-UHFFFAOYSA-N 0 0 359.405 3.041 10 0 FGAERN CCO[C@H]1C[C@@H](NC(=O)Nc2ccccc2N2CCCC2)C12CCOCC2 ZINC000183970461 496182928 /nfs/dbraw/zinc/18/29/28/496182928.db2.gz JMLRYEJBSRJPHR-MOPGFXCFSA-N 0 0 373.497 3.383 10 0 FGAERN Cc1cnn(CCNC(=O)c2ccc(Sc3ccccc3Cl)nn2)c1 ZINC000174961149 496183619 /nfs/dbraw/zinc/18/36/19/496183619.db2.gz SDLNTBXQJCMMSO-UHFFFAOYSA-N 0 0 373.869 3.216 10 0 FGAERN O=C(CCc1ccccc1OC(F)(F)F)N1CCC[C@@H]1Cn1ccnc1 ZINC000177763226 496186621 /nfs/dbraw/zinc/18/66/21/496186621.db2.gz NCAMFCARSFWKAO-OAHLLOKOSA-N 0 0 367.371 3.406 10 0 FGAERN COc1ccccc1OCCC(=O)NC1(c2noc(C3CC3)n2)CCCC1 ZINC000174974207 496189128 /nfs/dbraw/zinc/18/91/28/496189128.db2.gz MOGVJOWJWODBSN-UHFFFAOYSA-N 0 0 371.437 3.310 10 0 FGAERN CN(C[C@@H](c1cccs1)N1CCOCC1)C(=O)N[C@H]1CCCC1(C)C ZINC000174975998 496190151 /nfs/dbraw/zinc/19/01/51/496190151.db2.gz SOJNFIGLDAVJSJ-RDJZCZTQSA-N 0 0 365.543 3.342 10 0 FGAERN CN(C[C@H](c1cccs1)N1CCOCC1)C(=O)N[C@@H]1CCCC1(C)C ZINC000174976039 496190326 /nfs/dbraw/zinc/19/03/26/496190326.db2.gz SOJNFIGLDAVJSJ-NVXWUHKLSA-N 0 0 365.543 3.342 10 0 FGAERN O=C(NCc1cc(Cl)cc2c1OCC2)N1CCC(Cn2cccn2)CC1 ZINC000183999661 496194579 /nfs/dbraw/zinc/19/45/79/496194579.db2.gz UIMIOTMRQZUHRK-UHFFFAOYSA-N 0 0 374.872 3.093 10 0 FGAERN CCCN(CC1CC1)C(=O)NC[C@H](c1ccc(C)s1)N1CCOCC1 ZINC000174986440 496195360 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CC(C)[C@@H](O)CC(=O)NC[C@H](c1ccccc1)N1CCc2sccc2C1 ZINC000156285655 496207510 /nfs/dbraw/zinc/20/75/10/496207510.db2.gz KXENVMMCMVQJHV-MOPGFXCFSA-N 0 0 372.534 3.371 10 0 FGAERN CC(C)[C@@H](O)CC(=O)N[C@H](Cn1cnc2ccccc21)c1ccc(F)cc1 ZINC000156308532 496211868 /nfs/dbraw/zinc/21/18/68/496211868.db2.gz LDESOEOTTCCYPL-QUCCMNQESA-N 0 0 369.440 3.440 10 0 FGAERN COc1cccc(/C(C)=C/C(=O)N[C@H]2CCS(=O)(=O)c3ccccc32)c1 ZINC000177830038 496214568 /nfs/dbraw/zinc/21/45/68/496214568.db2.gz MXJVFICTHSFCDE-SZEUEKNRSA-N 0 0 371.458 3.133 10 0 FGAERN C[C@H]1CN([C@@H](CNC(=O)N(C)CC2CCCC2)c2cccs2)CCO1 ZINC000175028593 496216028 /nfs/dbraw/zinc/21/60/28/496216028.db2.gz WPIZBXQSAHFBOH-RDJZCZTQSA-N 0 0 365.543 3.342 10 0 FGAERN Cc1nn(C)c(C)c1[C@@H]1CCCN1C(=O)N[C@@H](CCCO)c1ccccc1 ZINC000156359598 496223875 /nfs/dbraw/zinc/22/38/75/496223875.db2.gz CDTUBAVOWFKYGR-OALUTQOASA-N 0 0 370.497 3.397 10 0 FGAERN CC[C@@H]1C[N@@H+]2CCC[C@@H]2CN1C(=O)c1cc(F)cc(Br)c1 ZINC000175049879 496225473 /nfs/dbraw/zinc/22/54/73/496225473.db2.gz AMZQOIZBYVLBOD-HUUCEWRRSA-N 0 0 355.251 3.287 10 0 FGAERN O=C(Nc1ccccc1C(F)(F)F)N1CCC[C@H](Cn2cncn2)C1 ZINC000180985869 496230167 /nfs/dbraw/zinc/23/01/67/496230167.db2.gz DHZNBZULJAFIBP-LBPRGKRZSA-N 0 0 353.348 3.241 10 0 FGAERN O=C(Nc1ccc(OC(F)F)c2cccnc12)N[C@H]1CCCn2ncnc21 ZINC000186964203 496230478 /nfs/dbraw/zinc/23/04/78/496230478.db2.gz BZJBAYZNXRPEQE-LBPRGKRZSA-N 0 0 374.351 3.084 10 0 FGAERN CCc1nc2n(n1)C[C@H](NC(=O)c1sc(C)nc1-c1ccccc1)CC2 ZINC000172257547 496232364 /nfs/dbraw/zinc/23/23/64/496232364.db2.gz OCDCJYPTABBNEA-CQSZACIVSA-N 0 0 367.478 3.017 10 0 FGAERN Cc1cnc([C@@H](C)CNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)s1 ZINC000184102623 496238834 /nfs/dbraw/zinc/23/88/34/496238834.db2.gz XNUYYVGBBRMWQT-JSGCOSHPSA-N 0 0 367.515 3.318 10 0 FGAERN Cc1noc([C@@H]2COCCN2C(=O)CCCc2ccc3ccccc3c2)n1 ZINC000152742891 496242694 /nfs/dbraw/zinc/24/26/94/496242694.db2.gz XOZUJFOWDBFUET-IBGZPJMESA-N 0 0 365.433 3.454 10 0 FGAERN Cc1nc(C)n(C[C@H]2CCCN(C(=O)c3cc4ccccc4nc3C)C2)n1 ZINC000172302815 496246208 /nfs/dbraw/zinc/24/62/08/496246208.db2.gz PAGFJFFICABSMT-KRWDZBQOSA-N 0 0 363.465 3.304 10 0 FGAERN C[C@@H](NC(=O)Cc1ccccc1OC(F)F)c1ccc2c(c1)OCCO2 ZINC000172324160 496253712 /nfs/dbraw/zinc/25/37/12/496253712.db2.gz DQVOAIGALGGTBA-GFCCVEGCSA-N 0 0 363.360 3.479 10 0 FGAERN CCO[C@H]1C[C@@H](NC(=O)c2ccc(-n3cccc3)cc2)C12CCOCC2 ZINC000187026809 496258005 /nfs/dbraw/zinc/25/80/05/496258005.db2.gz LQXOFGXTILEHID-MOPGFXCFSA-N 0 0 354.450 3.181 10 0 FGAERN C[C@H](NC(=O)N1CCC[C@H]1Cc1cccc(F)c1)c1nnc2n1CCCC2 ZINC000177938045 496258642 /nfs/dbraw/zinc/25/86/42/496258642.db2.gz RFTQOAZZTBJJLO-YOEHRIQHSA-N 0 0 371.460 3.231 10 0 FGAERN C[C@@H](NC(=O)N1CCC[C@H]1Cc1cccc(F)c1)c1nnc2n1CCCC2 ZINC000177938059 496258762 /nfs/dbraw/zinc/25/87/62/496258762.db2.gz RFTQOAZZTBJJLO-PBHICJAKSA-N 0 0 371.460 3.231 10 0 FGAERN CCc1nc(C2(NC(=O)[C@H]3C[C@H]3c3cccc(OC)c3)CCCC2)no1 ZINC000175131786 496260024 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CCO[C@@H]1C[C@H](NC(=O)Cc2c(F)cccc2Cl)C12CCOCC2 ZINC000187047986 496268665 /nfs/dbraw/zinc/26/86/65/496268665.db2.gz IKSAUBCOURFWMO-JKSUJKDBSA-N 0 0 355.837 3.112 10 0 FGAERN C[C@@H](CNC(=O)N1CCC(Cn2cccn2)CC1)COCc1ccccc1 ZINC000172361026 496268928 /nfs/dbraw/zinc/26/89/28/496268928.db2.gz UJXBRYKOXVOSMK-SFHVURJKSA-N 0 0 370.497 3.158 10 0 FGAERN O=C(c1cccc(OCC(F)(F)F)n1)N1CCC[C@H](C(F)(F)F)C1 ZINC000172365524 496269531 /nfs/dbraw/zinc/26/95/31/496269531.db2.gz ULJXKCJZAZOIMO-VIFPVBQESA-N 0 0 356.266 3.437 10 0 FGAERN CCc1nc(C2(NC(=O)[C@@H](C)Oc3cccc(C(C)=O)c3)CCCC2)no1 ZINC000175160678 496271901 /nfs/dbraw/zinc/27/19/01/496271901.db2.gz MLIKJJBLPGPUGN-CQSZACIVSA-N 0 0 371.437 3.188 10 0 FGAERN CCc1nccn1[C@H]1CCCN(C(=O)C2=Cc3cccc(OC)c3OC2)C1 ZINC000172377721 496274802 /nfs/dbraw/zinc/27/48/02/496274802.db2.gz FYELAGVUBQFBIG-KRWDZBQOSA-N 0 0 367.449 3.094 10 0 FGAERN Cc1ccc2c(c1)[C@H](NC(=O)c1c[nH]c(=O)c(Br)c1)[C@@H](C)C2 ZINC000181113078 496275354 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ZINC000174197393 495859304 /nfs/dbraw/zinc/85/93/04/495859304.db2.gz BTYQBJGZWWCKCH-INIZCTEOSA-N 0 0 364.490 3.169 10 0 FGAERN Cc1nc(C[C@@H]2CCCN([C@@H](C)C(=O)Nc3ccccc3Cl)C2)no1 ZINC000171406018 495860060 /nfs/dbraw/zinc/86/00/60/495860060.db2.gz WMPGRRFMYGDVNW-JSGCOSHPSA-N 0 0 362.861 3.313 10 0 FGAERN CC(C)C(=O)N(C)Cc1ccc(C(=O)N2CC[C@@]3(O)CCCC[C@H]3C2)cc1 ZINC000151509584 495861914 /nfs/dbraw/zinc/86/19/14/495861914.db2.gz DEFVFHQJPLDLJU-UGKGYDQZSA-N 0 0 372.509 3.068 10 0 FGAERN CC(=O)c1ccc(OCCCC(=O)N2CC[C@@H](Oc3cccnc3)C2)cc1 ZINC000151520365 495865215 /nfs/dbraw/zinc/86/52/15/495865215.db2.gz VSZXCOKWHCISOQ-HXUWFJFHSA-N 0 0 368.433 3.123 10 0 FGAERN COc1ccc(NC(=O)[C@@H](NC(=O)c2ccccc2OC)C(C)C)c(C)c1 ZINC000171421493 495866929 /nfs/dbraw/zinc/86/69/29/495866929.db2.gz QFBOJXFZVSVDLF-IBGZPJMESA-N 0 0 370.449 3.405 10 0 FGAERN CCc1nc2n(n1)CCC[C@H]2NC(=O)N[C@H]1CC(C)(C)c2ccccc21 ZINC000151531318 495869083 /nfs/dbraw/zinc/86/90/83/495869083.db2.gz QDHXFRGAXLJBBP-CVEARBPZSA-N 0 0 353.470 3.397 10 0 FGAERN CCc1ccc(NC(=O)C(=O)N2CCC[C@@H](n3cc(C)cn3)C2)cc1CC ZINC000180125032 495869260 /nfs/dbraw/zinc/86/92/60/495869260.db2.gz IOVJMUOFCOUISB-LJQANCHMSA-N 0 0 368.481 3.119 10 0 FGAERN CCCN(Cc1nnc(-c2ccccc2Cl)o1)C(=O)[C@@H](C)COC ZINC000171430155 495870255 /nfs/dbraw/zinc/87/02/55/495870255.db2.gz MDLNQIBEAMAGNW-LBPRGKRZSA-N 0 0 351.834 3.411 10 0 FGAERN O=C(c1cc(=O)[nH]c2ccccc21)N1C[C@H](O)C[C@@H]1c1cc(F)ccc1F ZINC000180129190 495870409 /nfs/dbraw/zinc/87/04/09/495870409.db2.gz MMRUECQESQXVRJ-KZULUSFZSA-N 0 0 370.355 3.167 10 0 FGAERN CCc1nc(C2(NC[C@H](O)COc3cc(C)cc(C)c3)CCCC2)no1 ZINC000174234930 495875314 /nfs/dbraw/zinc/87/53/14/495875314.db2.gz HEEYTJUBSUDTOB-INIZCTEOSA-N 0 0 359.470 3.048 10 0 FGAERN CCc1nc(C2(NCC(=O)N(CC)Cc3cccc(F)c3)CCCC2)no1 ZINC000174236740 495876109 /nfs/dbraw/zinc/87/61/09/495876109.db2.gz SPBNBISOVAFYMU-UHFFFAOYSA-N 0 0 374.460 3.179 10 0 FGAERN CC(C)c1nc(C2(NC[C@@H](O)COCc3ccccc3)CCCC2)no1 ZINC000174242904 495878438 /nfs/dbraw/zinc/87/84/38/495878438.db2.gz LNHFSAGUPSLIGZ-QGZVFWFLSA-N 0 0 359.470 3.130 10 0 FGAERN COc1ccc(NC(=O)C(=O)N[C@@H]2CC[C@@H](C)c3ccccc32)c(C)n1 ZINC000151563361 495879934 /nfs/dbraw/zinc/87/99/34/495879934.db2.gz ZBWSXRFICFJPNH-SJKOYZFVSA-N 0 0 353.422 3.092 10 0 FGAERN Cn1cc([C@H]2CCCN2C(=O)NCc2ccnc(OC3CCCC3)c2)cn1 ZINC000171457816 495883221 /nfs/dbraw/zinc/88/32/21/495883221.db2.gz ZXTIGABNELJDIE-GOSISDBHSA-N 0 0 369.469 3.183 10 0 FGAERN Cn1cc([C@H]2CCCN2C(=O)NCCCCOCCc2ccccc2)cn1 ZINC000171459634 495883393 /nfs/dbraw/zinc/88/33/93/495883393.db2.gz FDLHSGBQEUALGE-HXUWFJFHSA-N 0 0 370.497 3.306 10 0 FGAERN COC(=O)[C@@H]1CCCN(C(=O)c2cccnc2Sc2ccccc2)C1 ZINC000171462156 495885638 /nfs/dbraw/zinc/88/56/38/495885638.db2.gz NCZDZXTZBPVCGD-CQSZACIVSA-N 0 0 356.447 3.258 10 0 FGAERN O=C(Cc1ccc(Br)s1)N1CC[C@]2(O)CCCC[C@H]2C1 ZINC000151583590 495886013 /nfs/dbraw/zinc/88/60/13/495886013.db2.gz LNYHENHWECNVFO-XHDPSFHLSA-N 0 0 358.301 3.207 10 0 FGAERN COC(=O)[C@@H]1CCCN(C(=O)CCc2ccc(-c3ccccc3F)o2)C1 ZINC000171463833 495886777 /nfs/dbraw/zinc/88/67/77/495886777.db2.gz LFVJMVKUIZQHAZ-CQSZACIVSA-N 0 0 359.397 3.430 10 0 FGAERN Cn1cc([C@@H]2CCCN2C(=O)NCc2ccccc2Br)cn1 ZINC000171468035 495888051 /nfs/dbraw/zinc/88/80/51/495888051.db2.gz GGIXFKFZDGBPJK-HNNXBMFYSA-N 0 0 363.259 3.229 10 0 FGAERN C[C@@H](NC(=O)c1cc2c(cn1)nc[nH]c2=O)c1ccc(Cl)c(Cl)c1 ZINC000186184425 495888456 /nfs/dbraw/zinc/88/84/56/495888456.db2.gz KDNPVTXARKSFIY-MRVPVSSYSA-N 0 0 363.204 3.116 10 0 FGAERN COc1ccc([C@H](C)C(=O)N2CCOC[C@@H]2C[C@H](O)c2ccccc2)cc1 ZINC000155243907 495888976 /nfs/dbraw/zinc/88/89/76/495888976.db2.gz COFQJQWSBNDYLY-LRQRDZAKSA-N 0 0 369.461 3.150 10 0 FGAERN CC(C)(C)OC(=O)N[C@@H]1CC[C@H]2CN(C(=O)c3cc(F)ccc3F)C[C@@H]21 ZINC000183229965 495889673 /nfs/dbraw/zinc/88/96/73/495889673.db2.gz NFZMYXQXBVFVDB-HZUKXOBISA-N 0 0 366.408 3.340 10 0 FGAERN CC(C)(C)OC(=O)N[C@@H]1CC[C@@H]2CN(C(=O)CC[C@@H]3CCCCO3)C[C@H]12 ZINC000183233083 495890113 /nfs/dbraw/zinc/89/01/13/495890113.db2.gz HVCSLELJPFRIKZ-LTIDMASMSA-N 0 0 366.502 3.097 10 0 FGAERN COCc1nc2n(n1)CCC[C@@H]2NC(=O)C(C)(C)c1ccc(Cl)cc1 ZINC000155255822 495893291 /nfs/dbraw/zinc/89/32/91/495893291.db2.gz VMSUNYYYZSUCAM-AWEZNQCLSA-N 0 0 362.861 3.007 10 0 FGAERN O=C(CNC(=O)N[C@@H](Cc1ccccc1)C(F)(F)F)Nc1ccccc1 ZINC000155264462 495897043 /nfs/dbraw/zinc/89/70/43/495897043.db2.gz OWNKZSCTLLBQHG-HNNXBMFYSA-N 0 0 365.355 3.098 10 0 FGAERN C[C@@H](O)C[N@@H+]1CCN(C(=O)CC(c2ccccc2)c2ccccc2)C[C@@H]1C ZINC000174293378 495897232 /nfs/dbraw/zinc/89/72/32/495897232.db2.gz YJPZPOXHFVNVNX-RBUKOAKNSA-N 0 0 366.505 3.122 10 0 FGAERN CCN(CC)c1ccc(C(=O)N2CCC[C@H](Cc3noc(C)n3)C2)cc1 ZINC000171485952 495897208 /nfs/dbraw/zinc/89/72/08/495897208.db2.gz ASXHCWCSJWBRQC-MRXNPFEDSA-N 0 0 356.470 3.319 10 0 FGAERN CCOc1ccc(NC(=O)N2CCC(Cn3cccn3)CC2)cc1OC ZINC000151627885 495898214 /nfs/dbraw/zinc/89/82/14/495898214.db2.gz GBFXXSJASSTMIT-UHFFFAOYSA-N 0 0 358.442 3.235 10 0 FGAERN COCc1ccccc1C(=O)N1C[C@@H]2CC[C@@H](NC(=O)OC(C)(C)C)[C@H]2C1 ZINC000183250490 495899883 /nfs/dbraw/zinc/89/98/83/495899883.db2.gz YGRNWBCBIADCRJ-JCGIZDLHSA-N 0 0 374.481 3.208 10 0 FGAERN CC[C@H](C)[C@H](NC(=O)c1ccccc1)C(=O)NCCOCc1ccccc1 ZINC000177046377 495899974 /nfs/dbraw/zinc/89/99/74/495899974.db2.gz QDRAQNSZTHRGLN-PXNSSMCTSA-N 0 0 368.477 3.164 10 0 FGAERN COC(=O)C1CCC(C(=O)NCc2ccc(Br)cc2C)CC1 ZINC000180198895 495902344 /nfs/dbraw/zinc/90/23/44/495902344.db2.gz TYQVXXZRIYXRSA-UHFFFAOYSA-N 0 0 368.271 3.353 10 0 FGAERN COCCOc1cc(C)ccc1NC(=O)N1CCC[C@@H]1c1cnn(C)c1 ZINC000171512162 495906834 /nfs/dbraw/zinc/90/68/34/495906834.db2.gz YGOIYKCRGPDQSG-QGZVFWFLSA-N 0 0 358.442 3.123 10 0 FGAERN CCOC(=O)N(C)c1ccc(NC(=O)N2CCC[C@@H]2c2cnn(C)c2)cc1 ZINC000171513262 495907917 /nfs/dbraw/zinc/90/79/17/495907917.db2.gz QUEZYNARGPOAMY-QGZVFWFLSA-N 0 0 371.441 3.382 10 0 FGAERN O=C(CNC(=O)c1ccccc1)N[C@@H]1CC2(CCCC2)Oc2ccccc21 ZINC000151696456 495921713 /nfs/dbraw/zinc/92/17/13/495921713.db2.gz XZMKCQUYFLUIKW-GOSISDBHSA-N 0 0 364.445 3.369 10 0 FGAERN CCCCc1nnc(NC(=O)N2CCC[C@@H](Cc3noc(C)n3)C2)s1 ZINC000171577056 495933645 /nfs/dbraw/zinc/93/36/45/495933645.db2.gz ZJWQTGPXFHCLLR-LBPRGKRZSA-N 0 0 364.475 3.059 10 0 FGAERN Cc1nc(C[C@@H]2CCCN(C(=O)Nc3cccc(OC(F)F)c3)C2)no1 ZINC000171581621 495934374 /nfs/dbraw/zinc/93/43/74/495934374.db2.gz HSFYVBRYEIMXSH-LBPRGKRZSA-N 0 0 366.368 3.466 10 0 FGAERN CC(=O)Nc1ccc(C)c(NC(=O)N2CCC[C@@H](Cc3noc(C)n3)C2)c1 ZINC000171582252 495935396 /nfs/dbraw/zinc/93/53/96/495935396.db2.gz BKQRMHKUXKCHPP-HNNXBMFYSA-N 0 0 371.441 3.131 10 0 FGAERN CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)C[C@H](C)c1nccs1 ZINC000183336686 495936076 /nfs/dbraw/zinc/93/60/76/495936076.db2.gz SEYJFNRNPZMQJN-STQMWFEESA-N 0 0 355.504 3.398 10 0 FGAERN CCc1nccn1[C@@H]1CCCN(C(=O)c2ccnc(O[C@H](C)CC)c2)C1 ZINC000180284090 495936626 /nfs/dbraw/zinc/93/66/26/495936626.db2.gz XRRQHWBRIHJWIJ-NVXWUHKLSA-N 0 0 356.470 3.495 10 0 FGAERN CC(=O)c1ccc(OCCCC(=O)N2CCC[C@@H]2Cn2ccnc2C)cc1 ZINC000177138120 495942692 /nfs/dbraw/zinc/94/26/92/495942692.db2.gz FRRVUEWQQGKSMZ-LJQANCHMSA-N 0 0 369.465 3.244 10 0 FGAERN Cc1nccn1C[C@H]1CCCN1C(=O)CCC(=O)c1ccc(Cl)cc1 ZINC000177151668 495951193 /nfs/dbraw/zinc/95/11/93/495951193.db2.gz OZWZIZMIMYYNCR-QGZVFWFLSA-N 0 0 359.857 3.499 10 0 FGAERN CCn1cnnc1C1CCN(CC(=O)Nc2c(C)cc(C)cc2C)CC1 ZINC000155428294 495954105 /nfs/dbraw/zinc/95/41/05/495954105.db2.gz ISQYHXLYSHXWJP-UHFFFAOYSA-N 0 0 355.486 3.041 10 0 FGAERN Cc1noc([C@@H]2COCCN2C(=O)c2sc3ccc(F)cc3c2C)n1 ZINC000155438650 495956477 /nfs/dbraw/zinc/95/64/77/495956477.db2.gz LIIMORWKEHWQSO-ZDUSSCGKSA-N 0 0 361.398 3.254 10 0 FGAERN C[C@@H]1CC[C@H](C(=O)Nc2ccnn2Cc2ccccc2Br)O1 ZINC000151822687 495959176 /nfs/dbraw/zinc/95/91/76/495959176.db2.gz OKFIGNNRKWMREP-BXUZGUMPSA-N 0 0 364.243 3.200 10 0 FGAERN Cc1cccc(Oc2ccccc2NC(=O)C(=O)N[C@H]2CCCC[C@H]2O)c1 ZINC000177172730 495959868 /nfs/dbraw/zinc/95/98/68/495959868.db2.gz MUUXGWCUAXWIPI-FUHWJXTLSA-N 0 0 368.433 3.146 10 0 FGAERN Cc1cc(NC(=O)N[C@@H]2CCCn3ncnc32)nn1-c1cccc(Cl)c1 ZINC000180348852 495961028 /nfs/dbraw/zinc/96/10/28/495961028.db2.gz NCHICANWAGFFKN-CQSZACIVSA-N 0 0 371.832 3.082 10 0 FGAERN COCc1nc2n(n1)CCC[C@@H]2NC(=O)C(C)(C)c1cccc(Cl)c1 ZINC000155456020 495962096 /nfs/dbraw/zinc/96/20/96/495962096.db2.gz KGYUFVXJAJIAFK-AWEZNQCLSA-N 0 0 362.861 3.007 10 0 FGAERN Cc1nccn1C[C@@H]1CCCN1C(=O)c1cc2ccc(F)cc2nc1C ZINC000177181603 495963318 /nfs/dbraw/zinc/96/33/18/495963318.db2.gz MLQYBLQDDCLWIG-KRWDZBQOSA-N 0 0 352.413 3.492 10 0 FGAERN CC1(C)CCc2ccccc2[C@H]1NC(=O)NCc1nnc2n1CCCC2 ZINC000155462510 495964158 /nfs/dbraw/zinc/96/41/58/495964158.db2.gz OJLAXUKHMQTOOK-GOSISDBHSA-N 0 0 353.470 3.127 10 0 FGAERN Cc1nn(-c2ccccc2)cc1NC(=O)C(=O)N[C@@H](C)c1cccs1 ZINC000183397957 495964567 /nfs/dbraw/zinc/96/45/67/495964567.db2.gz BSSIGRCUPLKGBL-ZDUSSCGKSA-N 0 0 354.435 3.058 10 0 FGAERN CC[C@H](C(=O)N1CCC[C@H](Cc2noc(C)n2)C1)c1ccc(OC)cc1 ZINC000180361691 495965961 /nfs/dbraw/zinc/96/59/61/495965961.db2.gz ULNKUEFPBYUGGT-QAPCUYQASA-N 0 0 357.454 3.362 10 0 FGAERN COc1ccccc1OC[C@@H](C)CNC(=O)N1CCCC[C@H]1c1cn[nH]c1 ZINC000183403931 495967794 /nfs/dbraw/zinc/96/77/94/495967794.db2.gz GNCRWQOAUGANRF-RDJZCZTQSA-N 0 0 372.469 3.370 10 0 FGAERN Cc1nccn1C[C@H]1CCCN1C(=O)c1cnn(-c2ccc(F)cc2)c1C ZINC000177192333 495968861 /nfs/dbraw/zinc/96/88/61/495968861.db2.gz XPMXIGWENBRJMG-GOSISDBHSA-N 0 0 367.428 3.130 10 0 FGAERN O=C(NCCc1nc2c(s1)CCCC2)N1CCCC[C@H]1c1cn[nH]c1 ZINC000183416937 495973710 /nfs/dbraw/zinc/97/37/10/495973710.db2.gz KDFJOLSOCNLTIL-HNNXBMFYSA-N 0 0 359.499 3.224 10 0 FGAERN CCOc1ccc(-c2noc(CN3CCO[C@@H](c4nccs4)C3)n2)cc1 ZINC000171663837 495978683 /nfs/dbraw/zinc/97/86/83/495978683.db2.gz DGHLFBXJZPYGJK-OAHLLOKOSA-N 0 0 372.450 3.165 10 0 FGAERN Cc1nc(-c2ccccc2)sc1C(=O)N1CCC[C@@H](n2cncn2)C1 ZINC000171664051 495979633 /nfs/dbraw/zinc/97/96/33/495979633.db2.gz CLKTWEYKAHHYQJ-OAHLLOKOSA-N 0 0 353.451 3.187 10 0 FGAERN CCc1cc2c(CN3CCO[C@H](c4nccs4)C3)cc(=O)oc2cc1O ZINC000171666972 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CC[C@@](C)(NC(=O)[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1nc(C)cs1 ZINC000151161984 495759224 /nfs/dbraw/zinc/75/92/24/495759224.db2.gz UHZVTLONBLTZHL-SCLBCKFNSA-N 0 0 367.515 3.450 10 0 FGAERN C[C@@H](NC(=O)NCCN1C(=O)Cc2ccccc21)c1ccc(Cl)s1 ZINC000171184265 495759664 /nfs/dbraw/zinc/75/96/64/495759664.db2.gz ARBVLTLDOKRPAM-LLVKDONJSA-N 0 0 363.870 3.351 10 0 FGAERN Cc1c(C(=O)N2CCCC[C@@H]2c2nccs2)cnn1C1CCOCC1 ZINC000179854367 495760240 /nfs/dbraw/zinc/76/02/40/495760240.db2.gz JBIGKOOMGASSJF-MRXNPFEDSA-N 0 0 360.483 3.367 10 0 FGAERN C[C@H](CCNC(=O)N(C)Cc1cc(Cl)cn1C)NC(=O)OC(C)(C)C ZINC000176725145 495763743 /nfs/dbraw/zinc/76/37/43/495763743.db2.gz AHDAGNUOHWEYTB-GFCCVEGCSA-N 0 0 372.897 3.123 10 0 FGAERN CCCC[C@@H](NC(N)=O)C(=O)N1CCC[C@H](c2nc(C(C)C)cs2)C1 ZINC000173957007 495763899 /nfs/dbraw/zinc/76/38/99/495763899.db2.gz OVFHHILUBJIDGY-UONOGXRCSA-N 0 0 366.531 3.200 10 0 FGAERN CC(C)c1csc([C@H]2CCCN(C(=O)c3ccc4[nH]c(=O)[nH]c4c3)C2)n1 ZINC000173964609 495766333 /nfs/dbraw/zinc/76/63/33/495766333.db2.gz BLYAKGZKARZTAG-ZDUSSCGKSA-N 0 0 370.478 3.456 10 0 FGAERN C[C@@H](NC(=O)C(=O)Nc1ccc(OC2CCCC2)nc1)c1cccs1 ZINC000171219838 495774636 /nfs/dbraw/zinc/77/46/36/495774636.db2.gz CDIJPWONQPLPNO-GFCCVEGCSA-N 0 0 359.451 3.280 10 0 FGAERN Cc1c(C(=O)N2CC[C@]3(O)CCCC[C@H]3C2)cnn1-c1ccccc1C ZINC000151234666 495780492 /nfs/dbraw/zinc/78/04/92/495780492.db2.gz ARZMJDXJCOYUPF-LAUBAEHRSA-N 0 0 353.466 3.256 10 0 FGAERN Cc1nc(C[C@@H]2CCCN(C(=O)Cc3ccc(C(F)(F)F)cc3)C2)no1 ZINC000171240408 495784868 /nfs/dbraw/zinc/78/48/68/495784868.db2.gz RAAYDSANUFLBHZ-AWEZNQCLSA-N 0 0 367.371 3.421 10 0 FGAERN COc1ccc2c(CC(=O)N3CCC[C@@H](Cc4noc(C)n4)C3)coc2c1 ZINC000171246990 495787274 /nfs/dbraw/zinc/78/72/74/495787274.db2.gz OBMMPKTZHZUGFV-AWEZNQCLSA-N 0 0 369.421 3.157 10 0 FGAERN CCO[C@H]1C[C@@H](NC(=O)Nc2nc(C(C)C)cs2)C12CCOCC2 ZINC000185935188 495787337 /nfs/dbraw/zinc/78/73/37/495787337.db2.gz PHGUBTBACRLWCT-KGLIPLIRSA-N 0 0 353.488 3.362 10 0 FGAERN Cc1nc(C[C@H]2CCCN(C(=O)CSCc3cccc(C)c3)C2)no1 ZINC000171246105 495787488 /nfs/dbraw/zinc/78/74/88/495787488.db2.gz QXYQXBFBHCNUOE-MRXNPFEDSA-N 0 0 359.495 3.401 10 0 FGAERN C[C@H](NC(=O)N[C@@H]1c2ccccc2CCC1(C)C)C(=O)NCc1ccco1 ZINC000154967730 495787701 /nfs/dbraw/zinc/78/77/01/495787701.db2.gz HICGQWWRTSNBKL-KBXCAEBGSA-N 0 0 369.465 3.297 10 0 FGAERN CC(C)c1nc([C@@H]2CCCN2C(=O)NCc2ccc(C(C)(C)O)cc2)no1 ZINC000185937942 495788991 /nfs/dbraw/zinc/78/89/91/495788991.db2.gz JSLYNQUQAQIWHP-INIZCTEOSA-N 0 0 372.469 3.467 10 0 FGAERN COc1ccc(F)cc1NC(=O)[C@@H]1CCC(=O)N(C)[C@H]1c1ccccc1 ZINC000179937882 495791437 /nfs/dbraw/zinc/79/14/37/495791437.db2.gz JAZAZEDGJLPKPN-BEFAXECRSA-N 0 0 356.397 3.383 10 0 FGAERN C[C@H](NC(=O)C(=O)Nc1ccc2c(c1)CCCO2)c1cccc(Cl)c1 ZINC000171260708 495793549 /nfs/dbraw/zinc/79/35/49/495793549.db2.gz HTSPZKIVRMUUGH-LBPRGKRZSA-N 0 0 358.825 3.481 10 0 FGAERN Cc1c(NC(=O)[C@@H]2CC(=O)N(C)[C@H]2c2ccc(F)cc2)cccc1N(C)C ZINC000183002821 495794038 /nfs/dbraw/zinc/79/40/38/495794038.db2.gz IKTRCQRJFRCWJE-UZLBHIALSA-N 0 0 369.440 3.358 10 0 FGAERN C[C@@H](C(=O)N1CCN(Cc2cnn(-c3ccccc3)c2)CC1)c1ccccc1 ZINC000183001923 495794210 /nfs/dbraw/zinc/79/42/10/495794210.db2.gz GURBVCOXYJJFPS-LJQANCHMSA-N 0 0 374.488 3.320 10 0 FGAERN O=C(Nc1ccc2scnc2c1)C(=O)N[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000171265631 495795659 /nfs/dbraw/zinc/79/56/59/495795659.db2.gz YGQILLMZEMLVDC-UWVGGRQHSA-N 0 0 371.384 3.472 10 0 FGAERN O=C(CCc1ccccn1)N1C[C@@H](O)C[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000179952143 495797440 /nfs/dbraw/zinc/79/74/40/495797440.db2.gz APJGALYDMRAEDW-DLBZAZTESA-N 0 0 364.367 3.368 10 0 FGAERN CCO[C@@H]1C[C@H](NC(=O)N2CCC[C@@H]2c2cccc(C)n2)C12CCOCC2 ZINC000185958921 495798824 /nfs/dbraw/zinc/79/88/24/495798824.db2.gz NSHUOFUXBKPEEK-CEXWTWQISA-N 0 0 373.497 3.211 10 0 FGAERN COc1cccc(OCCCNC(=O)N2CCCC[C@H]2c2cn[nH]c2)c1 ZINC000183025849 495803250 /nfs/dbraw/zinc/80/32/50/495803250.db2.gz YMPWEVXROFBOQV-SFHVURJKSA-N 0 0 358.442 3.124 10 0 FGAERN CCN1CC[C@H](NC(=O)NC[C@@](C)(O)CC)[C@H]1c1ccc(Cl)c(F)c1 ZINC000179966650 495803873 /nfs/dbraw/zinc/80/38/73/495803873.db2.gz KLYGSYCTQDADAO-JZXOWHBKSA-N 0 0 371.884 3.075 10 0 FGAERN CCN(Cc1nnnn1C(C)C)Cc1cc(Br)ccc1F ZINC000155015373 495805107 /nfs/dbraw/zinc/80/51/07/495805107.db2.gz YVWZTYQBWABQTM-UHFFFAOYSA-N 0 0 356.243 3.178 10 0 FGAERN C[C@H]1CC[C@H](C(=O)Nc2cc(F)c(I)c(F)c2)O1 ZINC000151329832 495806576 /nfs/dbraw/zinc/80/65/76/495806576.db2.gz GKSSXGGFRGTTIK-QUBYGPBYSA-N 0 0 367.133 3.075 10 0 FGAERN C[C@@H]1CC[C@H](C(=O)Nc2cc(F)c(I)c(F)c2)O1 ZINC000151329783 495806768 /nfs/dbraw/zinc/80/67/68/495806768.db2.gz GKSSXGGFRGTTIK-LHLIQPBNSA-N 0 0 367.133 3.075 10 0 FGAERN CCCCCOc1ccc(C(=O)N[C@H]2CCCn3nc(COC)nc32)cc1 ZINC000155026317 495808496 /nfs/dbraw/zinc/80/84/96/495808496.db2.gz MMDCYCUWXXPMBL-KRWDZBQOSA-N 0 0 372.469 3.258 10 0 FGAERN COc1ccc(/C=C(\C)C(=O)N2CCC[C@H]2Cn2ccnc2C)cc1F ZINC000183043706 495811061 /nfs/dbraw/zinc/81/10/61/495811061.db2.gz TUJSOXIQBOPRPH-WKOYGUFESA-N 0 0 357.429 3.434 10 0 FGAERN CC(C)NC(=O)c1ccc(C(=O)N[C@H](C)c2ccc3c(c2)OCCO3)cc1 ZINC000179985115 495811239 /nfs/dbraw/zinc/81/12/39/495811239.db2.gz BCYFJFVDHBUVAJ-CQSZACIVSA-N 0 0 368.433 3.087 10 0 FGAERN O=C(c1cnn(-c2ccc(Cl)cc2)c1)N1CC[C@@]2(O)CCCC[C@H]2C1 ZINC000151355529 495814186 /nfs/dbraw/zinc/81/41/86/495814186.db2.gz RKUJPQIFXSIKJO-KXBFYZLASA-N 0 0 359.857 3.293 10 0 FGAERN C[C@@H]1CN(C(=O)c2cccc(-n3ccc(C(F)(F)F)n3)c2)CCS1 ZINC000155047875 495816044 /nfs/dbraw/zinc/81/60/44/495816044.db2.gz QWFBHFPIDFVEEI-LLVKDONJSA-N 0 0 355.385 3.469 10 0 FGAERN O=C(NC[C@@H]1CC(=O)N(Cc2ccccc2)C1)[C@H]1C[C@@H]1C1CCCCC1 ZINC000180010778 495821122 /nfs/dbraw/zinc/82/11/22/495821122.db2.gz VYNUZQMOCWEIJQ-SXLOBPIMSA-N 0 0 354.494 3.368 10 0 FGAERN Cn1cc([C@@H]2CCN(C(=O)C[C@@H](O)c3cc(Cl)cc(Cl)c3)C2)cn1 ZINC000180010850 495821451 /nfs/dbraw/zinc/82/14/51/495821451.db2.gz LXHJLIDZYVJJQZ-BDJLRTHQSA-N 0 0 368.264 3.167 10 0 FGAERN Cc1ccccc1CN(C)C(=O)[C@H](C)[S@](=O)Cc1nccn1C(C)C ZINC000176880773 495824402 /nfs/dbraw/zinc/82/44/02/495824402.db2.gz GTWHSNOMNGEOGQ-IVCQMTBJSA-N 0 0 361.511 3.068 10 0 FGAERN Cc1cc(S(N)(=O)=O)cc(C(=O)N[C@@H](C)c2ccc(Cl)cc2)c1C ZINC000151398757 495827055 /nfs/dbraw/zinc/82/70/55/495827055.db2.gz RNRWRFKBLVXSNS-LBPRGKRZSA-N 0 0 366.870 3.095 10 0 FGAERN CC(C)n1ccnc1C[S@](=O)[C@H](C)c1nc(Cc2ccccc2)no1 ZINC000176888725 495828006 /nfs/dbraw/zinc/82/80/06/495828006.db2.gz STTGBZGMURJBGQ-PWECECGKSA-N 0 0 358.467 3.448 10 0 FGAERN CCOc1ccc(NC(=O)[C@@H](C)[S@@](=O)Cc2nccn2C(C)C)cc1 ZINC000176894013 495830429 /nfs/dbraw/zinc/83/04/29/495830429.db2.gz FCUVOVBIGNIFIT-PWECECGKSA-N 0 0 363.483 3.139 10 0 FGAERN CC(C)n1ccnc1C[S@](=O)[C@@H](C)C(=O)Nc1c(F)cccc1F ZINC000176892351 495830553 /nfs/dbraw/zinc/83/05/53/495830553.db2.gz GQIWVAHRCPRRCE-BUBHHJDNSA-N 0 0 355.410 3.018 10 0 FGAERN Cc1nccn1C[C@H]1CCCN1C(=O)Nc1ccc(C(=O)NC(C)C)cc1 ZINC000176896303 495832076 /nfs/dbraw/zinc/83/20/76/495832076.db2.gz HLMPKVXHVBYGGN-GOSISDBHSA-N 0 0 369.469 3.026 10 0 FGAERN COc1cccc(O[C@@H](C)CNC(=O)N2CCCC[C@H]2c2cn[nH]c2)c1 ZINC000183108363 495838140 /nfs/dbraw/zinc/83/81/40/495838140.db2.gz FLWKKXAHXKEZGG-KSSFIOAISA-N 0 0 358.442 3.122 10 0 FGAERN COCCCOc1ccccc1NC(=O)N1CCC[C@H]1Cn1ccnc1C ZINC000176912944 495839313 /nfs/dbraw/zinc/83/93/13/495839313.db2.gz URJDPOMOIGKOKX-KRWDZBQOSA-N 0 0 372.469 3.303 10 0 FGAERN Cc1nc2n(n1)CCC[C@@H]2NC(=O)N[C@@H](C)CSc1ccc(C)cc1 ZINC000186058948 495840093 /nfs/dbraw/zinc/84/00/93/495840093.db2.gz DPPCZANULPRVIQ-BBRMVZONSA-N 0 0 359.499 3.210 10 0 FGAERN CC(C)(C)OC(=O)NC[C@@H]1CCCN1c1nnc(C(F)(F)F)s1 ZINC000155112333 495840418 /nfs/dbraw/zinc/84/04/18/495840418.db2.gz AHDLXNDGQRHKJT-QMMMGPOBSA-N 0 0 352.382 3.050 10 0 FGAERN Cc1csc([C@@H](C)CNC(=O)[C@H](NC(=O)c2ccccc2C)C(C)C)n1 ZINC000186058967 495840515 /nfs/dbraw/zinc/84/05/15/495840515.db2.gz PZJUQGOAOUFPPM-WMLDXEAASA-N 0 0 373.522 3.434 10 0 FGAERN COC(=O)N(C)c1ccc(NC(=O)N2CCC[C@H]2Cn2ccnc2C)cc1 ZINC000176921137 495842785 /nfs/dbraw/zinc/84/27/85/495842785.db2.gz GNVKPXFWUNIWQM-KRWDZBQOSA-N 0 0 371.441 3.091 10 0 FGAERN CC(C)Oc1cc(Br)cc(NC(=O)C(=O)N[C@@H](C)C(C)C)c1 ZINC000176926927 495844625 /nfs/dbraw/zinc/84/46/25/495844625.db2.gz HELKXBCCQTWTBP-NSHDSACASA-N 0 0 371.275 3.336 10 0 FGAERN CC(C)COc1ccc([C@@H](C)NC(=O)NCCNC(=O)C(C)(C)C)cc1 ZINC000176937920 495849285 /nfs/dbraw/zinc/84/92/85/495849285.db2.gz SOZOOZKCZAECAH-OAHLLOKOSA-N 0 0 363.502 3.244 10 0 FGAERN C[C@@H](Cc1ccccc1Cl)C(=O)N[C@@H]1CCCN(c2cccnn2)C1 ZINC000155136634 495849510 /nfs/dbraw/zinc/84/95/10/495849510.db2.gz SOGDVOGYGLXROZ-GOEBONIOSA-N 0 0 358.873 3.094 10 0 FGAERN Brc1ccc([C@H](NCC[NH+]2CCCC2)c2cncnc2)cc1 ZINC000186085481 495849712 /nfs/dbraw/zinc/84/97/12/495849712.db2.gz DVDLWKRUWRIDDI-KRWDZBQOSA-N 0 0 361.287 3.014 10 0 FGAERN CSCc1cc(C(=O)N2CCC[C@@H](Cc3noc(C)n3)C2)ccc1F ZINC000174185815 495854127 /nfs/dbraw/zinc/85/41/27/495854127.db2.gz USEHGGDFCFALEW-ZDUSSCGKSA-N 0 0 363.458 3.475 10 0 FGAERN C[C@@H]1CC[C@@H](C(=O)Nc2cccc(CS(=O)(=O)Cc3ccccc3)c2)O1 ZINC000155154810 495855023 /nfs/dbraw/zinc/85/50/23/495855023.db2.gz FJTUSJXYHQQHGH-BEFAXECRSA-N 0 0 373.474 3.308 10 0 FGAERN CCC1CCC(NC(=O)C(=O)Nc2cccc(-c3nccn3C)c2)CC1 ZINC000176968346 495862278 /nfs/dbraw/zinc/86/22/78/495862278.db2.gz FOWKLXDGVBKKRD-UHFFFAOYSA-N 0 0 354.454 3.111 10 0 FGAERN Cc1ccc(N2CCCC2)c(C(=O)N2CC[C@@H](Oc3cccnc3)C2)c1 ZINC000151521229 495865724 /nfs/dbraw/zinc/86/57/24/495865724.db2.gz NDUJRKDJFAQMGY-GOSISDBHSA-N 0 0 351.450 3.284 10 0 FGAERN CN(C)c1ccc(NC(=O)N2CCC(Nc3cccnn3)CC2)cc1Cl ZINC000151534934 495870303 /nfs/dbraw/zinc/87/03/03/495870303.db2.gz YWVJLOCXEXGALA-UHFFFAOYSA-N 0 0 374.876 3.304 10 0 FGAERN Cc1c(C(=O)N[C@@H]2CCOc3ccccc32)nnn1-c1ccccc1Cl ZINC000171431096 495871413 /nfs/dbraw/zinc/87/14/13/495871413.db2.gz TXGONXWRTDGMHH-OAHLLOKOSA-N 0 0 368.824 3.483 10 0 FGAERN CCc1nc(C2(NC[C@H](O)COc3c(C)ccc(C)c3C)CCCC2)no1 ZINC000174238783 495877446 /nfs/dbraw/zinc/87/74/46/495877446.db2.gz NHNGCCUYEWFIKC-KRWDZBQOSA-N 0 0 373.497 3.356 10 0 FGAERN 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/nfs/dbraw/zinc/13/12/48/496131248.db2.gz HWIRSOYPJKNXQM-IFXJQAMLSA-N 0 0 363.461 3.372 10 0 FGAERN C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N[C@@H]1CCCn2ncnc21 ZINC000177618913 496134712 /nfs/dbraw/zinc/13/47/12/496134712.db2.gz UKOLSQAWPHVMFX-SMDDNHRTSA-N 0 0 352.360 3.127 10 0 FGAERN COCCOc1ccc(C(=O)N2CCC[C@@H]2C[C@@H](O)c2ccccc2)cc1 ZINC000174856613 496135189 /nfs/dbraw/zinc/13/51/89/496135189.db2.gz IHUTZNQNWJHEEB-TZIWHRDSSA-N 0 0 369.461 3.440 10 0 FGAERN CC(C)c1noc(CCC(=O)N2CCC[C@H]2C[C@@H](O)c2ccccc2)n1 ZINC000174864392 496138998 /nfs/dbraw/zinc/13/89/98/496138998.db2.gz XLQWVIJJKCRAPT-DLBZAZTESA-N 0 0 357.454 3.240 10 0 FGAERN Cc1csc(-c2cccc(C(=O)N3CC[C@@H](c4cnn(C)c4)C3)c2)n1 ZINC000152398480 496138972 /nfs/dbraw/zinc/13/89/72/496138972.db2.gz RORYQUMSGKPVSF-MRXNPFEDSA-N 0 0 352.463 3.482 10 0 FGAERN CCc1nccn1[C@@H]1CCCN(C(=O)NCCCc2ccc(OC)cc2)C1 ZINC000152418237 496144717 /nfs/dbraw/zinc/14/47/17/496144717.db2.gz APWGIORRPPMCEL-GOSISDBHSA-N 0 0 370.497 3.433 10 0 FGAERN O=C(N[C@H]1CCS(=O)(=O)c2ccccc21)N1CCC[C@@]2(CC=CCC2)C1 ZINC000172067017 496149657 /nfs/dbraw/zinc/14/96/57/496149657.db2.gz QVJNFKCJOZEVLR-PXNSSMCTSA-N 0 0 374.506 3.437 10 0 FGAERN CCc1nccn1[C@@H]1CCCN(C(=O)C(=O)Nc2cc(Cl)ccc2C)C1 ZINC000177662203 496150736 /nfs/dbraw/zinc/15/07/36/496150736.db2.gz WCSPGKAZHOOKLK-OAHLLOKOSA-N 0 0 374.872 3.210 10 0 FGAERN NC(=O)c1csc(CN2C[C@H](O)C[C@@H]2c2cccc(C(F)(F)F)c2)c1 ZINC000180805396 496153960 /nfs/dbraw/zinc/15/39/60/496153960.db2.gz AEYZJFODMOFPDD-UKRRQHHQSA-N 0 0 370.396 3.174 10 0 FGAERN CCOc1cccc(CNC(=O)N2CCC(c3cnn(CC)c3)CC2)c1 ZINC000156104254 496159874 /nfs/dbraw/zinc/15/98/74/496159874.db2.gz TVJRYFDYHDRYCE-UHFFFAOYSA-N 0 0 356.470 3.391 10 0 FGAERN COc1ccc(C[C@@H](C)C(=O)N2CCC(Cn3cccn3)CC2)cc1OC ZINC000180828582 496161311 /nfs/dbraw/zinc/16/13/11/496161311.db2.gz KXNWHRXSKRZDQG-MRXNPFEDSA-N 0 0 371.481 3.018 10 0 FGAERN CC(C)N1CCC[C@@H](N2CCO[C@H](c3nc(C(C)(C)C)cs3)C2)C1=O ZINC000177697902 496163592 /nfs/dbraw/zinc/16/35/92/496163592.db2.gz GMSQSLZQWBVPMI-CABCVRRESA-N 0 0 365.543 3.213 10 0 FGAERN Cn1cc([C@H]2CCN(C(=O)NCc3ccc(OC(F)(F)F)cc3)C2)cn1 ZINC000172106412 496167376 /nfs/dbraw/zinc/16/73/76/496167376.db2.gz YBQXSCMPKGKOTL-ZDUSSCGKSA-N 0 0 368.359 3.018 10 0 FGAERN Cc1cnn([C@H]2CCCN(C(=O)c3cn(C)nc3-c3cccs3)C2)c1 ZINC000156135447 496167739 /nfs/dbraw/zinc/16/77/39/496167739.db2.gz NZSFNMKZDGSUBW-AWEZNQCLSA-N 0 0 355.467 3.131 10 0 FGAERN CCC[C@@H](NC(=O)N1CCC[C@@H](n2cncn2)C1)c1ccc(F)cc1F ZINC000156138041 496168773 /nfs/dbraw/zinc/16/87/73/496168773.db2.gz DBVBQJITBAHWAS-RHSMWYFYSA-N 0 0 363.412 3.444 10 0 FGAERN CCc1noc([C@H](C)N2CCN(Cc3ccc(C(F)F)cc3)CC2)n1 ZINC000183939999 496169092 /nfs/dbraw/zinc/16/90/92/496169092.db2.gz QTLUFHNHHDLVPO-ZDUSSCGKSA-N 0 0 350.413 3.448 10 0 FGAERN Cc1nc2n(n1)CCC[C@H]2NC(=O)[C@@H](C)Cc1ccc(C(F)(F)F)cc1 ZINC000177734553 496177516 /nfs/dbraw/zinc/17/75/16/496177516.db2.gz QEVYIRHELDBMNO-XHDPSFHLSA-N 0 0 366.387 3.435 10 0 FGAERN CCN(C(=O)N[C@@H]1CCS(=O)(=O)c2ccccc21)[C@H](C)c1cccnc1 ZINC000172129093 496177513 /nfs/dbraw/zinc/17/75/13/496177513.db2.gz UNQHITYCVJPZLM-RHSMWYFYSA-N 0 0 373.478 3.093 10 0 FGAERN CCc1nc2n(n1)C[C@@H](NC(=O)N[C@@H](CC)C(C)(C)c1ccccc1)CC2 ZINC000174961173 496183135 /nfs/dbraw/zinc/18/31/35/496183135.db2.gz RHVQHPYKWJCFSU-IRXDYDNUSA-N 0 0 369.513 3.211 10 0 FGAERN CCc1nc2n(n1)C[C@H](NC(=O)N[C@@H](CC)C(C)(C)c1ccccc1)CC2 ZINC000174961154 496183509 /nfs/dbraw/zinc/18/35/09/496183509.db2.gz RHVQHPYKWJCFSU-SJORKVTESA-N 0 0 369.513 3.211 10 0 FGAERN CCOc1ccc(NC(=O)N[C@H]2CCc3nc(C(C)C)nn3C2)c(C)c1 ZINC000152546060 496183634 /nfs/dbraw/zinc/18/36/34/496183634.db2.gz NGRJYTGGQMTLBB-AWEZNQCLSA-N 0 0 357.458 3.245 10 0 FGAERN CCOCCOc1ccc(Br)cc1NC(=O)N[C@@H]1C[C@@H]1C ZINC000180884290 496184718 /nfs/dbraw/zinc/18/47/18/496184718.db2.gz ZKSGECSYEUJILQ-CMPLNLGQSA-N 0 0 357.248 3.394 10 0 FGAERN CCc1nc2n(n1)CCC[C@@H]2NC(=O)Nc1c(C)cc(N(C)C)cc1C ZINC000156210303 496188278 /nfs/dbraw/zinc/18/82/78/496188278.db2.gz GMWKUFDDNQDKKN-HNNXBMFYSA-N 0 0 356.474 3.180 10 0 FGAERN CCO[C@H]1C[C@@H](N(C)C(=O)Cc2cc3ccccc3[nH]c2=O)C12CCCC2 ZINC000156213214 496189753 /nfs/dbraw/zinc/18/97/53/496189753.db2.gz SRFIRKLJCZBROV-MOPGFXCFSA-N 0 0 368.477 3.267 10 0 FGAERN CC(C)CCOc1ccc(NC(=O)N2CC[C@H](N3CCOCC3)C2)cc1 ZINC000174979267 496191330 /nfs/dbraw/zinc/19/13/30/496191330.db2.gz AEWKJRYJDZGNKA-SFHVURJKSA-N 0 0 361.486 3.050 10 0 FGAERN Cc1cccc2c(CCC(=O)N[C@@H]3CCc4nc(C(C)C)nn4C3)c[nH]c21 ZINC000174986511 496194752 /nfs/dbraw/zinc/19/47/52/496194752.db2.gz SGKGNSMJBBJHFW-MRXNPFEDSA-N 0 0 365.481 3.255 10 0 FGAERN CC[C@@H]1CCCCN1C(=O)NC[C@H](c1ccc(C)s1)N1CCOCC1 ZINC000174991756 496196577 /nfs/dbraw/zinc/19/65/77/496196577.db2.gz JGMCGSRUISGYOC-IAGOWNOFSA-N 0 0 365.543 3.404 10 0 FGAERN Cc1nc(CN2CCCN(C(=O)NCC(C)(C)C(C)C)CC2)cs1 ZINC000186889426 496197323 /nfs/dbraw/zinc/19/73/23/496197323.db2.gz NJUKCXAYRGKFKX-UHFFFAOYSA-N 0 0 352.548 3.351 10 0 FGAERN CCc1nc(NC(=O)[C@H]2CC(=O)N(C)[C@H]2c2ccc(F)cc2)sc1C ZINC000156267355 496202799 /nfs/dbraw/zinc/20/27/99/496202799.db2.gz LWWZEKQYLWGJID-BBRMVZONSA-N 0 0 361.442 3.311 10 0 FGAERN C[C@H](NC(=O)C(=O)Nc1ccccc1OCC(F)F)c1cccs1 ZINC000177804304 496202986 /nfs/dbraw/zinc/20/29/86/496202986.db2.gz PAQIRRHWJRZHNF-JTQLQIEISA-N 0 0 354.378 3.208 10 0 FGAERN CSCc1cccc(CNC(=O)N2CCC(Cn3cccn3)CC2)c1 ZINC000186904590 496203052 /nfs/dbraw/zinc/20/30/52/496203052.db2.gz CMKOGRPCOSDJIU-UHFFFAOYSA-N 0 0 358.511 3.368 10 0 FGAERN O=C(c1cc(Br)ccc1F)N1CCC[C@@H]1Cn1ccnc1 ZINC000177810930 496206163 /nfs/dbraw/zinc/20/61/63/496206163.db2.gz XOGLZDNSPMGADZ-GFCCVEGCSA-N 0 0 352.207 3.090 10 0 FGAERN NC(=O)CCOc1ccc(NC(=O)N[C@@H]2CCCc3cc(F)ccc32)cc1 ZINC000161618507 496208867 /nfs/dbraw/zinc/20/88/67/496208867.db2.gz YGKGGTISXHZTLC-GOSISDBHSA-N 0 0 371.412 3.279 10 0 FGAERN COc1ccc(S(=O)(=O)C[C@H](C)C(=O)N[C@@H](C)c2cccs2)cc1 ZINC000172224213 496215935 /nfs/dbraw/zinc/21/59/35/496215935.db2.gz MRMNQUNSABBHPB-STQMWFEESA-N 0 0 367.492 3.044 10 0 FGAERN Cc1onc(-c2ccccn2)c1C(=O)NCC[C@@H](C)NC(=O)OC(C)(C)C ZINC000177835852 496216072 /nfs/dbraw/zinc/21/60/72/496216072.db2.gz VQCFNLZCCLXSEU-GFCCVEGCSA-N 0 0 374.441 3.078 10 0 FGAERN C[C@@H]1CN([C@@H](CNC(=O)N2CCCC[C@@H]2C)c2cccs2)CCO1 ZINC000175035105 496220040 /nfs/dbraw/zinc/22/00/40/496220040.db2.gz AVFGBUWCCUSUJV-XHSDSOJGSA-N 0 0 351.516 3.094 10 0 FGAERN Cc1ccc(N2CCCC2)c(C(=O)N[C@@H]2CCc3nnc(C(C)C)n3C2)c1 ZINC000172234810 496221598 /nfs/dbraw/zinc/22/15/98/496221598.db2.gz SIRJPULUXLEYRM-MRXNPFEDSA-N 0 0 367.497 3.055 10 0 FGAERN COc1cc(NC(=O)C(=O)N2CCC[C@H]2c2ccco2)ccc1OC(C)C ZINC000184064230 496223699 /nfs/dbraw/zinc/22/36/99/496223699.db2.gz SWXKBVOJEAOMHN-HNNXBMFYSA-N 0 0 372.421 3.378 10 0 FGAERN COc1cc(NC(=O)C(=O)N2CCC[C@@H]2c2ccco2)ccc1OC(C)C ZINC000184064214 496223799 /nfs/dbraw/zinc/22/37/99/496223799.db2.gz SWXKBVOJEAOMHN-OAHLLOKOSA-N 0 0 372.421 3.378 10 0 FGAERN COc1cccc(OC)c1C(=O)N[C@@H](C)c1cccc(-n2ccnc2)c1 ZINC000175053206 496228096 /nfs/dbraw/zinc/22/80/96/496228096.db2.gz QACYJWWBIJMDFJ-AWEZNQCLSA-N 0 0 351.406 3.381 10 0 FGAERN Cn1cc(CNC(=O)[C@H]2C[C@@H]2c2ccc(F)c(F)c2)c(C(F)(F)F)n1 ZINC000156405980 496237212 /nfs/dbraw/zinc/23/72/12/496237212.db2.gz GZZRPHPPPPGYIT-MNOVXSKESA-N 0 0 359.298 3.137 10 0 FGAERN CC[C@H](C)NC(=O)c1ccc(NC(=O)N2CCC(c3cc[nH]n3)CC2)cc1 ZINC000152742922 496243246 /nfs/dbraw/zinc/24/32/46/496243246.db2.gz VOOLCLIPKBLECC-AWEZNQCLSA-N 0 0 369.469 3.350 10 0 FGAERN CC[C@@H](C)[C@H](C(=O)N1CCCN(Cc2noc(C)n2)CC1)c1ccccc1 ZINC000172293893 496244086 /nfs/dbraw/zinc/24/40/86/496244086.db2.gz CJTVLLGMJYHQMS-UZLBHIALSA-N 0 0 370.497 3.242 10 0 FGAERN CCOCCN1CCN(C(=O)c2cc3ccccc3nc2C)C[C@@H]1CC ZINC000172298849 496244963 /nfs/dbraw/zinc/24/49/63/496244963.db2.gz MQXXNWWSGABHJP-SFHVURJKSA-N 0 0 355.482 3.116 10 0 FGAERN C[C@@H](NC(=O)N1CCN([C@@H](C)c2nccs2)CC1)c1cccs1 ZINC000184117187 496245657 /nfs/dbraw/zinc/24/56/57/496245657.db2.gz DZJMGNKPEFEWMG-OLZOCXBDSA-N 0 0 350.513 3.354 10 0 FGAERN CCS(=O)(=O)c1c(Cl)cccc1CN1CC[C@@]2(O)CCCC[C@@H]2C1 ZINC000187007808 496249752 /nfs/dbraw/zinc/24/97/52/496249752.db2.gz YHMPPXBWKIADBI-QAPCUYQASA-N 0 0 371.930 3.261 10 0 FGAERN COCc1nc2cc(NC(=O)[C@H](Cc3ccccc3)N(C)C)ccc2o1 ZINC000175112236 496251728 /nfs/dbraw/zinc/25/17/28/496251728.db2.gz NYPJVHHITJNQGD-KRWDZBQOSA-N 0 0 353.422 3.086 10 0 FGAERN COCCn1cc(C(=O)N2CC[C@@]3(O)CCCC[C@@H]3C2)c2ccccc21 ZINC000177918707 496251929 /nfs/dbraw/zinc/25/19/29/496251929.db2.gz WHSNPJMZGAMFLW-IERDGZPVSA-N 0 0 356.466 3.055 10 0 FGAERN CN(C)c1nc2sc(C(=O)N3CC[C@]4(O)CCCC[C@@H]4C3)cc2s1 ZINC000177921722 496252744 /nfs/dbraw/zinc/25/27/44/496252744.db2.gz YKMKVXRGHZRTLU-PIGZYNQJSA-N 0 0 365.524 3.191 10 0 FGAERN CCO[C@@H]1C[C@H](NC(=O)CCOc2ccc(C)cc2C)C12CCOCC2 ZINC000187026985 496257650 /nfs/dbraw/zinc/25/76/50/496257650.db2.gz BWZBZJJTKLFEMO-RBUKOAKNSA-N 0 0 361.482 3.163 10 0 FGAERN COC(=O)C1CCC(C(=O)OCc2nnc(-c3cccc(C)c3)o2)CC1 ZINC000181068032 496258704 /nfs/dbraw/zinc/25/87/04/496258704.db2.gz UYRPMTHBIIYVRP-UHFFFAOYSA-N 0 0 358.394 3.068 10 0 FGAERN CCO[C@@H]1C[C@@H](NC(=O)/C=C(\C)Cc2ccccc2OC)C12CCOCC2 ZINC000187032414 496260457 /nfs/dbraw/zinc/26/04/57/496260457.db2.gz RBLLJXFQTCIFHS-DTOXSZFGSA-N 0 0 373.493 3.274 10 0 FGAERN CCc1nc(C2(NC(=O)c3ccc(NC(=O)C4CC4)cc3)CCCC2)no1 ZINC000175133562 496261749 /nfs/dbraw/zinc/26/17/49/496261749.db2.gz GUAMIXYEJYSBSC-UHFFFAOYSA-N 0 0 368.437 3.180 10 0 FGAERN CN(C[C@@H](c1cccs1)N1CCOCC1)C(=O)c1cc2ccccc2[nH]1 ZINC000177965247 496268285 /nfs/dbraw/zinc/26/82/85/496268285.db2.gz FRSLOWPJUDJMDN-SFHVURJKSA-N 0 0 369.490 3.375 10 0 FGAERN Cc1cc(C)cc(OCCNC(=O)N2CCC(Cn3cccn3)CC2)c1 ZINC000172361239 496268450 /nfs/dbraw/zinc/26/84/50/496268450.db2.gz REAUFEDCHHZZRQ-UHFFFAOYSA-N 0 0 356.470 3.001 10 0 FGAERN CCc1nc(C2(NC(=O)CCc3nc4ccccc4[nH]3)CCCC2)no1 ZINC000175152414 496268435 /nfs/dbraw/zinc/26/84/35/496268435.db2.gz VZGAASZKZMBNFM-UHFFFAOYSA-N 0 0 353.426 3.027 10 0 FGAERN 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495558093 /nfs/dbraw/zinc/55/80/93/495558093.db2.gz BYDOEFXEEPLHEH-SJLPKXTDSA-N 0 0 369.469 3.135 10 0 FGAERN CC(C)c1ccc([C@H]2C[C@H]2C(=O)N2CCCN(C(=O)C3CC3)CC2)cc1 ZINC000158666383 495562526 /nfs/dbraw/zinc/56/25/26/495562526.db2.gz OUJPDKBJGZVNIW-WOJBJXKFSA-N 0 0 354.494 3.384 10 0 FGAERN O=C(CCNC(=O)N1CCCC[C@@H]1c1nccs1)NC1CCCCC1 ZINC000176251225 495564050 /nfs/dbraw/zinc/56/40/50/495564050.db2.gz YDWQDYGGTZAAIM-OAHLLOKOSA-N 0 0 364.515 3.219 10 0 FGAERN C[C@H](NC(=O)N1CCC(C2OCCO2)CC1)c1ccc(F)c(Cl)c1 ZINC000170686730 495565596 /nfs/dbraw/zinc/56/55/96/495565596.db2.gz PICSDCOZBGLLNS-NSHDSACASA-N 0 0 356.825 3.335 10 0 FGAERN Cc1nn(C)c2sc(C(=O)N3CCC[C@@H]3C[C@@H](O)c3ccco3)cc12 ZINC000154292043 495570401 /nfs/dbraw/zinc/57/04/01/495570401.db2.gz YOVDAKMRUMZLBU-TZMCWYRMSA-N 0 0 359.451 3.265 10 0 FGAERN COc1ccc(CCC(=O)N2CCC[C@@H]2C[C@H](O)c2ccco2)cc1F ZINC000154290134 495570840 /nfs/dbraw/zinc/57/08/40/495570840.db2.gz KVTZGDQGBHVBBX-WBVHZDCISA-N 0 0 361.413 3.475 10 0 FGAERN 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495620285 /nfs/dbraw/zinc/62/02/85/495620285.db2.gz UKPOBLKDOJHDGP-RJYAGPCLSA-N 0 0 358.482 3.396 10 0 FGAERN Cc1ccc([C@H](C)NC(=O)c2cncc(I)c2)o1 ZINC000158943297 495621799 /nfs/dbraw/zinc/62/17/99/495621799.db2.gz YNYNSOFHSFXPBZ-VIFPVBQESA-N 0 0 356.163 3.079 10 0 FGAERN CC(C)n1nnnc1CN1CCCC[C@@H]1c1nc(-c2ccccc2)no1 ZINC000170838190 495621843 /nfs/dbraw/zinc/62/18/43/495621843.db2.gz LGEXCRAJUPKBPC-OAHLLOKOSA-N 0 0 353.430 3.031 10 0 FGAERN O=C(c1cc2ccccc2oc1=O)N1CCC[C@@H]1C[C@H](O)c1ccco1 ZINC000154483762 495630719 /nfs/dbraw/zinc/63/07/19/495630719.db2.gz PVUSFXFRMUFAJB-ZBFHGGJFSA-N 0 0 353.374 3.114 10 0 FGAERN CCO[C@@H]1C[C@H](N(C)C(=O)CCCNC(=O)C(C)(C)C)C12CCCC2 ZINC000150787824 495634409 /nfs/dbraw/zinc/63/44/09/495634409.db2.gz ARTIAMHXKNATGZ-JKSUJKDBSA-N 0 0 352.519 3.125 10 0 FGAERN CC(C)[C@@H](Sc1nnc(CO)n1C1CC1)C(=O)N[C@H](C)c1ccccc1 ZINC000159010425 495636718 /nfs/dbraw/zinc/63/67/18/495636718.db2.gz RADKFBRJXAYILX-CXAGYDPISA-N 0 0 374.510 3.099 10 0 FGAERN 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3.225 10 0 FGAERN O=C(NC1(c2noc(C3CC3)n2)CCCC1)c1c(Cl)nc2ccccn21 ZINC000175708228 496509130 /nfs/dbraw/zinc/50/91/30/496509130.db2.gz KVOYNORXXMIXAX-UHFFFAOYSA-N 0 0 371.828 3.447 10 0 FGAERN C[C@H]1C[C@H]1NC(=O)c1nn(-c2cccc(Br)c2)c2c1CCC2 ZINC000163439636 496516350 /nfs/dbraw/zinc/51/63/50/496516350.db2.gz MXCWIRHADADZHT-IINYFYTJSA-N 0 0 360.255 3.262 10 0 FGAERN COC[C@@H]1CN(C(=O)N[C@@H](C)c2ccc(OCC(C)C)cc2)C[C@H](C)O1 ZINC000187643568 496519283 /nfs/dbraw/zinc/51/92/83/496519283.db2.gz WQIZNVWXDMBSFN-BXWFABGCSA-N 0 0 364.486 3.228 10 0 FGAERN CN1C(=O)COc2ccc(NC(=O)[C@@H]3C[C@H]3c3ccc(F)c(F)c3)cc21 ZINC000175737924 496522743 /nfs/dbraw/zinc/52/27/43/496522743.db2.gz XDWDOWDWJPWPNP-QWHCGFSZSA-N 0 0 358.344 3.062 10 0 FGAERN O=C(N[C@@H]1CCCc2cc(F)ccc21)c1ccccc1Cn1cncn1 ZINC000157705676 496533991 /nfs/dbraw/zinc/53/39/91/496533991.db2.gz KQPNTHSUPKXUEJ-LJQANCHMSA-N 0 0 350.397 3.273 10 0 FGAERN COC(=O)[C@H](c1cc(OC)cc(OC)c1)N1CCC[C@H](C(F)(F)F)C1 ZINC000178673923 496536728 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C[C@@H](COCc1ccccc1)NC(=O)N(C)[C@@H]1CCCc2c1cnn2C ZINC000178756128 496561553 /nfs/dbraw/zinc/56/15/53/496561553.db2.gz MNSKSBXBWXNRMJ-MAUKXSAKSA-N 0 0 356.470 3.044 10 0 FGAERN C[C@H](CN1CCCC1=O)NC(=O)N[C@@H]1CC2(CCCC2)Oc2ccccc21 ZINC000178769519 496564240 /nfs/dbraw/zinc/56/42/40/496564240.db2.gz ICUBQUGYGQBJJC-NVXWUHKLSA-N 0 0 371.481 3.133 10 0 FGAERN Cc1cc(C)c2ncc(C(=O)N3CCC(c4ccnn4C)CC3)c(O)c2c1 ZINC000163880992 496566998 /nfs/dbraw/zinc/56/69/98/496566998.db2.gz JFPWXEYNHBIEOV-UHFFFAOYSA-N 0 0 364.449 3.311 10 0 FGAERN Cn1cc(Br)c(=O)c(NC(=O)[C@H]2C[C@@H]2C2CCCCC2)c1 ZINC000181850757 496571315 /nfs/dbraw/zinc/57/13/15/496571315.db2.gz AXCRFNDWUZTCLC-NEPJUHHUSA-N 0 0 353.260 3.303 10 0 FGAERN C[C@@H]1C[C@@H]1NC(=O)N1CCO[C@H](c2ccc(F)c(Br)c2)C1 ZINC000187785081 496571451 /nfs/dbraw/zinc/57/14/51/496571451.db2.gz QAAODAMQOHDVQW-IIMNLJJBSA-N 0 0 357.223 3.080 10 0 FGAERN Cn1c(Cn2nc(-c3cccs3)c3ccccc3c2=O)nnc1C1CC1 ZINC000181875096 496582226 /nfs/dbraw/zinc/58/22/26/496582226.db2.gz 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371.506 3.144 10 0 FGAERN Cc1cc(NC(=O)N2C[C@@H](O)C[C@@H]2c2cccc(C(F)(F)F)c2)n(C)n1 ZINC000178913761 496614210 /nfs/dbraw/zinc/61/42/10/496614210.db2.gz IXVULNBIVZPDRC-UONOGXRCSA-N 0 0 368.359 3.087 10 0 FGAERN COc1ccc(CCCNC(=O)N2CCC[C@H]2Cn2ccnc2C)cc1 ZINC000175950415 496615326 /nfs/dbraw/zinc/61/53/26/496615326.db2.gz JXSTUQGTTNIHES-SFHVURJKSA-N 0 0 356.470 3.007 10 0 FGAERN Cc1nsc(N2CCN(C(=O)[C@@H]3C[C@H]3c3ccc(C(C)C)cc3)CC2)n1 ZINC000173275650 496622993 /nfs/dbraw/zinc/62/29/93/496622993.db2.gz QHYLSUZCDMWRCH-ZWKOTPCHSA-N 0 0 370.522 3.422 10 0 FGAERN Cc1ccc([C@H](C)NC(=O)CCC(=O)Nc2nnc(CC(C)C)s2)o1 ZINC000153917028 496623710 /nfs/dbraw/zinc/62/37/10/496623710.db2.gz AGOYLSYVHLYHER-LBPRGKRZSA-N 0 0 364.471 3.234 10 0 FGAERN Cc1ccc(C(=O)N[C@H](C)COCc2ccccc2)c(Br)n1 ZINC000178967787 496632182 /nfs/dbraw/zinc/63/21/82/496632182.db2.gz WSOWYDNQGDSVIM-CYBMUJFWSA-N 0 0 363.255 3.488 10 0 FGAERN Cc1nc(Cl)ccc1C(=O)N1CCC[C@H]1CNC(=O)OC(C)(C)C ZINC000158155554 496638761 /nfs/dbraw/zinc/63/87/61/496638761.db2.gz RKGZXJITEXVHDF-LBPRGKRZSA-N 0 0 353.850 3.173 10 0 FGAERN Cn1cc([C@@H]2CCCN2CC(=O)Nc2nc(-c3cccs3)cs2)cn1 ZINC000173314473 496639540 /nfs/dbraw/zinc/63/95/40/496639540.db2.gz KWYUMQKXDIQOFK-AWEZNQCLSA-N 0 0 373.507 3.381 10 0 FGAERN CN(C)c1nc2cc(NC(=O)N[C@H](C[NH+](C)C)c3ccccc3)ccc2o1 ZINC000164925450 496639648 /nfs/dbraw/zinc/63/96/48/496639648.db2.gz NTZGYZPNGPTAKA-QGZVFWFLSA-N 0 0 367.453 3.318 10 0 FGAERN Cc1cnn(-c2ccc(C)cc2NC(=O)C(=O)N[C@@H](C)c2cccs2)c1 ZINC000179013062 496645588 /nfs/dbraw/zinc/64/55/88/496645588.db2.gz BHIFQEGPXPNLPK-AWEZNQCLSA-N 0 0 368.462 3.367 10 0 FGAERN CN1C(=O)C[C@@H](C(=O)Nc2nc3c(s2)CCCC3)[C@@H]1c1ccc(F)cc1 ZINC000179040395 496654241 /nfs/dbraw/zinc/65/42/41/496654241.db2.gz XNUGADYLAPCTGC-DYVFJYSZSA-N 0 0 373.453 3.319 10 0 FGAERN Cc1cnc(CCN(C)C(=O)N[C@@H](C)c2ccc3c(c2)OCCO3)s1 ZINC000179045985 496656565 /nfs/dbraw/zinc/65/65/65/496656565.db2.gz NAPBBTQHEZQSMM-ZDUSSCGKSA-N 0 0 361.467 3.168 10 0 FGAERN COc1cc(C(=O)N2CCC[C@H]2c2ccco2)cc(NC(C)=O)c1OC ZINC000173377984 496665261 /nfs/dbraw/zinc/66/52/61/496665261.db2.gz QMTAYACOVLQEIF-HNNXBMFYSA-N 0 0 358.394 3.233 10 0 FGAERN Cc1csc([C@H]2CCCN(C(=O)C(=O)Nc3cc(F)cc(F)c3)C2)n1 ZINC000173384420 496668796 /nfs/dbraw/zinc/66/87/96/496668796.db2.gz UHXJIAUQWQEXMU-NSHDSACASA-N 0 0 365.405 3.074 10 0 FGAERN CC(C)(C)NC(=O)c1ccccc1NC(=O)N1CCC(c2cc[nH]n2)CC1 ZINC000154054926 496669388 /nfs/dbraw/zinc/66/93/88/496669388.db2.gz QGUICIPCSAZXHT-UHFFFAOYSA-N 0 0 369.469 3.350 10 0 FGAERN COc1ccc(CN(CCO)C(=O)[C@H]2C[C@H]2C2CCCCC2)c(OC)c1 ZINC000173390348 496671490 /nfs/dbraw/zinc/67/14/90/496671490.db2.gz NWVRSWLYKXMTJW-OALUTQOASA-N 0 0 361.482 3.241 10 0 FGAERN O=C(NOC[C@H]1CCOC1)N[C@H](c1cccc(C(F)(F)F)c1)C1CC1 ZINC000188075046 496673589 /nfs/dbraw/zinc/67/35/89/496673589.db2.gz UJGSPXKXCLVIGW-NHYWBVRUSA-N 0 0 358.360 3.424 10 0 FGAERN CCC(CC)(CO)CNC(=O)[C@H](NC(=O)c1ccc(Cl)cc1)C(C)C ZINC000154072938 496674842 /nfs/dbraw/zinc/67/48/42/496674842.db2.gz DNWFOFMJCPAWHK-MRXNPFEDSA-N 0 0 368.905 3.009 10 0 FGAERN Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)N1CC[C@H](c2cnn(C)c2)C1 ZINC000173403855 496677542 /nfs/dbraw/zinc/67/75/42/496677542.db2.gz XVHBGMBUKUEKGY-AWEZNQCLSA-N 0 0 369.856 3.197 10 0 FGAERN COc1ccc2c(c1)OC[C@@H](C(=O)N1CCC[C@@H](c3nc(C)cs3)C1)C2 ZINC000173408114 496679608 /nfs/dbraw/zinc/67/96/08/496679608.db2.gz PJFVZTOJPBOORN-CVEARBPZSA-N 0 0 372.490 3.417 10 0 FGAERN CO[C@@H](CNC(=O)N1CCC(c2cc[nH]n2)CC1)c1cccc(Cl)c1 ZINC000173432310 496691753 /nfs/dbraw/zinc/69/17/53/496691753.db2.gz RWXWENSYOOSLSB-KRWDZBQOSA-N 0 0 362.861 3.340 10 0 FGAERN CNC(=O)CCN(C)C(=O)[C@@H]1CCCO[C@H]1c1ccc(Cl)cc1Cl ZINC000185177317 496693889 /nfs/dbraw/zinc/69/38/89/496693889.db2.gz VKXJGTTUDZDRFL-CJNGLKHVSA-N 0 0 373.280 3.056 10 0 FGAERN COc1cc(NC(=O)N2CCC[C@H](c3nc(C(C)C)cs3)C2)ncn1 ZINC000182169022 496695745 /nfs/dbraw/zinc/69/57/45/496695745.db2.gz AETLEFDYICFZDS-LBPRGKRZSA-N 0 0 361.471 3.477 10 0 FGAERN CC1(C)CCc2ccccc2[C@@H]1NC(=O)NCCc1cccc(C(N)=O)c1 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O=C(COc1ccc(Cl)cc1)N1C[C@H](O)C[C@H]1c1cc(F)ccc1F ZINC000180128809 495870519 /nfs/dbraw/zinc/87/05/19/495870519.db2.gz SUWSBSNXPIMNNO-DYVFJYSZSA-N 0 0 367.779 3.332 10 0 FGAERN Cc1nc(C[C@@H]2CCCN(C(=O)Nc3cccc4cccnc43)C2)no1 ZINC000171445135 495876485 /nfs/dbraw/zinc/87/64/85/495876485.db2.gz XFXJXRCCHCAQFW-AWEZNQCLSA-N 0 0 351.410 3.413 10 0 FGAERN CC(C)c1nc(C2(NC[C@@H](O)COCc3cccs3)CCCC2)no1 ZINC000174243641 495878670 /nfs/dbraw/zinc/87/86/70/495878670.db2.gz BYJZWQFMSGDLTC-CQSZACIVSA-N 0 0 365.499 3.191 10 0 FGAERN COC[C@H](C)C(=O)NC[C@@H](c1ccccc1)N1CCc2sccc2C1 ZINC000171450712 495879116 /nfs/dbraw/zinc/87/91/16/495879116.db2.gz SGNAWILMZCATRR-YJBOKZPZSA-N 0 0 358.507 3.246 10 0 FGAERN CN(CC1CCCCC1)C(=O)CNC1(c2noc(C3CC3)n2)CCCC1 ZINC000174245314 495880194 /nfs/dbraw/zinc/88/01/94/495880194.db2.gz KFKJOTPLZGEAQD-UHFFFAOYSA-N 0 0 360.502 3.345 10 0 FGAERN CCN(CCNC(=O)N1CCC[C@H]1c1cnn(C)c1)c1cccc(C)c1 ZINC000171452121 495880427 /nfs/dbraw/zinc/88/04/27/495880427.db2.gz 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ZINC000180167816 495889867 /nfs/dbraw/zinc/88/98/67/495889867.db2.gz CKESWGVCOUQYHK-AWEZNQCLSA-N 0 0 358.490 3.012 10 0 FGAERN O=C(Nc1ccc(Br)nc1)N1CCCC[C@H]1c1cn[nH]c1 ZINC000183236154 495891539 /nfs/dbraw/zinc/89/15/39/495891539.db2.gz FMOUIRLGSKWYKO-LBPRGKRZSA-N 0 0 350.220 3.326 10 0 FGAERN C[C@@H](NC(=O)NC[C@H](C)CN1CCOCC1)c1ccc(Cl)c(Cl)c1 ZINC000155270761 495899320 /nfs/dbraw/zinc/89/93/20/495899320.db2.gz HCNYZJURRNLKKL-QWHCGFSZSA-N 0 0 374.312 3.322 10 0 FGAERN COC(=O)C1CCC(C(=O)Nc2nc(Cc3ccccc3)ns2)CC1 ZINC000180200686 495903714 /nfs/dbraw/zinc/90/37/14/495903714.db2.gz OHSHDWZWLGHXRL-UHFFFAOYSA-N 0 0 359.451 3.047 10 0 FGAERN CCOc1ccc(C(C)=O)cc1CN1CCC[C@H](Cn2nc(C)nc2C)C1 ZINC000171509174 495904108 /nfs/dbraw/zinc/90/41/08/495904108.db2.gz XKMRSNUWSIOASX-SFHVURJKSA-N 0 0 370.497 3.408 10 0 FGAERN Cc1nccn1C[C@@H]1CCCN1C(=O)Nc1ccc(O[C@H]2CCOC2)cc1 ZINC000177055285 495904182 /nfs/dbraw/zinc/90/41/82/495904182.db2.gz WTUORVFUUZNLIH-HKUYNNGSSA-N 0 0 370.453 3.056 10 0 FGAERN COc1cc(NC(=O)C(=O)N[C@@H](C)c2cccs2)ccc1OC(C)C ZINC000186231002 495905894 /nfs/dbraw/zinc/90/58/94/495905894.db2.gz QLUPUWAEEVIAAP-LBPRGKRZSA-N 0 0 362.451 3.360 10 0 FGAERN Cc1nccn1C[C@H]1CCCN1C(=O)Nc1cnn(Cc2ccccc2)c1 ZINC000177057782 495906382 /nfs/dbraw/zinc/90/63/82/495906382.db2.gz QEZZNUSGIZEIIK-LJQANCHMSA-N 0 0 364.453 3.133 10 0 FGAERN Cc1ccc(NC(=O)C2CC2)cc1NC(=O)N1CCC[C@@H]1c1cnn(C)c1 ZINC000171511445 495906536 /nfs/dbraw/zinc/90/65/36/495906536.db2.gz DBQJSGZDBINPQB-GOSISDBHSA-N 0 0 367.453 3.446 10 0 FGAERN COCCOc1cc(C)ccc1NC(=O)N1CCC[C@H]1c1cnn(C)c1 ZINC000171512165 495906679 /nfs/dbraw/zinc/90/66/79/495906679.db2.gz YGOIYKCRGPDQSG-KRWDZBQOSA-N 0 0 358.442 3.123 10 0 FGAERN CC(C)(C)OCc1cc(C(=O)NC2(c3noc(C4CC4)n3)CCCC2)no1 ZINC000186239400 495909402 /nfs/dbraw/zinc/90/94/02/495909402.db2.gz NFZIMVSXXDWGHP-UHFFFAOYSA-N 0 0 374.441 3.449 10 0 FGAERN Brc1cc2cccnc2c(CN2CCC[C@H](n3cncn3)C2)c1 ZINC000177067001 495910307 /nfs/dbraw/zinc/91/03/07/495910307.db2.gz HISJQIWYHZBIFI-INIZCTEOSA-N 0 0 372.270 3.426 10 0 FGAERN Cc1ccc(C[C@@H](C)C(=O)N[C@H]2CCS(=O)(=O)c3ccccc32)cc1 ZINC000180214466 495910568 /nfs/dbraw/zinc/91/05/68/495910568.db2.gz JLLZDEQANAGCAU-QAPCUYQASA-N 0 0 357.475 3.209 10 0 FGAERN COC(=O)C1CCC(C(=O)NCCOc2cccc(C(C)(C)C)c2)CC1 ZINC000180219538 495912855 /nfs/dbraw/zinc/91/28/55/495912855.db2.gz YOPCOBSXSUNWLR-UHFFFAOYSA-N 0 0 361.482 3.459 10 0 FGAERN COC(=O)c1sc2ccccc2c1CN1CCC[C@@H](n2cncn2)C1 ZINC000171525367 495913631 /nfs/dbraw/zinc/91/36/31/495913631.db2.gz JNMYQVUBNQMFLD-CYBMUJFWSA-N 0 0 356.451 3.117 10 0 FGAERN CCCOc1ccc(CNC(=O)N[C@@H](C)[C@H]2CCCO2)c(OC(F)F)c1 ZINC000155313691 495915717 /nfs/dbraw/zinc/91/57/17/495915717.db2.gz JMTBDFQXERFYQP-SWLSCSKDSA-N 0 0 372.412 3.444 10 0 FGAERN COCc1csc(NC(=O)N2CCC[C@@H]2c2noc(C(C)C)n2)n1 ZINC000177083845 495917427 /nfs/dbraw/zinc/91/74/27/495917427.db2.gz BMAUVWRSKUPWRE-LLVKDONJSA-N 0 0 351.432 3.165 10 0 FGAERN COCc1csc(NC(=O)N2CCC[C@H]2C[C@H](O)c2ccccc2)n1 ZINC000177083485 495917671 /nfs/dbraw/zinc/91/76/71/495917671.db2.gz DAXYSJWMMXEJDG-HOTGVXAUSA-N 0 0 361.467 3.410 10 0 FGAERN COc1ccc(/C=C(\C)C(=O)N[C@H](C)c2nnc3n2CCCC3)cc1F ZINC000183291654 495917957 /nfs/dbraw/zinc/91/79/57/495917957.db2.gz RJNXHFXIOXWTPB-RSKUSDAESA-N 0 0 358.417 3.043 10 0 FGAERN Cc1ccc(-c2ncc(C[N@H+]3C[C@@H](C)[C@H](N4CCOCC4)C3)s2)cc1 ZINC000180236858 495919122 /nfs/dbraw/zinc/91/91/22/495919122.db2.gz IKFNQLFDWFMGHT-VQIMIIECSA-N 0 0 357.523 3.271 10 0 FGAERN C[C@@H](O)CN1CCN(C(=O)C2(Sc3ccccc3)CCCC2)C[C@@H]1C ZINC000174355955 495925373 /nfs/dbraw/zinc/92/53/73/495925373.db2.gz ZJRLUSITAFAXMI-DLBZAZTESA-N 0 0 362.539 3.005 10 0 FGAERN O=C(N[C@H]1COc2ccccc21)c1ccc(OCC(F)(F)C(F)F)nc1 ZINC000171555413 495926518 /nfs/dbraw/zinc/92/65/18/495926518.db2.gz XGQDYDMEXWKMRQ-LBPRGKRZSA-N 0 0 370.302 3.224 10 0 FGAERN CC[C@H](C)[C@H](NC(=O)c1ccccc1)C(=O)NCC1(CCOC)CCC1 ZINC000151714157 495926579 /nfs/dbraw/zinc/92/65/79/495926579.db2.gz OUBUPHAOCDLPER-WMZOPIPTSA-N 0 0 360.498 3.154 10 0 FGAERN COC(=O)C1CCC(C(=O)N[C@@H](c2ccco2)c2ccccc2OC)CC1 ZINC000180254863 495926519 /nfs/dbraw/zinc/92/65/19/495926519.db2.gz FANMADBDAQGIOC-JFIBYHEFSA-N 0 0 371.433 3.473 10 0 FGAERN O=C(NCCCCN1C(=O)c2ccccc2C1=O)[C@@H]1C[C@H]1C1CCCCC1 ZINC000155340796 495926856 /nfs/dbraw/zinc/92/68/56/495926856.db2.gz GXCCELKAKPKDMZ-RBUKOAKNSA-N 0 0 368.477 3.395 10 0 FGAERN C[C@@H]1CN(C(=O)c2[nH]nc(-c3ccccc3)c2Br)CCS1 ZINC000171564829 495929579 /nfs/dbraw/zinc/92/95/79/495929579.db2.gz ZEZNXIWXCUFSKN-SNVBAGLBSA-N 0 0 366.284 3.417 10 0 FGAERN C[C@@H]1CN(C(=O)c2nn(-c3ccc(F)c(F)c3)c3c2CCC3)CCS1 ZINC000171569852 495931714 /nfs/dbraw/zinc/93/17/14/495931714.db2.gz YYNUPMHMIYWSTF-LLVKDONJSA-N 0 0 363.433 3.217 10 0 FGAERN CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N(C)C[C@@H](C)c1nccs1 ZINC000183336645 495936694 /nfs/dbraw/zinc/93/66/94/495936694.db2.gz SEYJFNRNPZMQJN-OLZOCXBDSA-N 0 0 355.504 3.398 10 0 FGAERN COCCCOc1cccc(NC(=O)N2CCC[C@@H](n3cc(C)cn3)C2)c1 ZINC000177142387 495945112 /nfs/dbraw/zinc/94/51/12/495945112.db2.gz IZPKGCVGBXSNBF-GOSISDBHSA-N 0 0 372.469 3.476 10 0 FGAERN CC[C@@H](C(=O)N[C@H](C)c1ccc(OC(F)(F)F)cc1)N1CCCC1=O ZINC000155414561 495950419 /nfs/dbraw/zinc/95/04/19/495950419.db2.gz NLVJHPMUEJOUJG-RISCZKNCSA-N 0 0 358.360 3.163 10 0 FGAERN Cc1nccn1C[C@@H]1CCCN1C(=O)Cc1ccc(Br)cc1 ZINC000177158759 495953360 /nfs/dbraw/zinc/95/33/60/495953360.db2.gz UEKFVGXDXXINFG-INIZCTEOSA-N 0 0 362.271 3.188 10 0 FGAERN COc1nc(C(=O)N2CCC[C@@H]2Cn2ccnc2C)cc2ccccc21 ZINC000177166626 495956160 /nfs/dbraw/zinc/95/61/60/495956160.db2.gz SEWCZDSWHQXNTF-MRXNPFEDSA-N 0 0 350.422 3.053 10 0 FGAERN Cc1nccn1C[C@@H]1CCCN1C(=O)c1ccc(OC[C@H]2CCCO2)cc1 ZINC000177170293 495957632 /nfs/dbraw/zinc/95/76/32/495957632.db2.gz KEAJJDAPOBUTRL-AZUAARDMSA-N 0 0 369.465 3.054 10 0 FGAERN Cc1ccc(NC(=O)CN2CC[C@@H](CNc3ccccn3)C2)cc1Cl ZINC000171648200 495965934 /nfs/dbraw/zinc/96/59/34/495965934.db2.gz NDDUQDYPOCOKNK-HNNXBMFYSA-N 0 0 358.873 3.416 10 0 FGAERN CC[C@H](C(=O)N1CCC[C@@H](Cc2noc(C)n2)C1)c1ccc(OC)cc1 ZINC000180361725 495966251 /nfs/dbraw/zinc/96/62/51/495966251.db2.gz ULNKUEFPBYUGGT-YJBOKZPZSA-N 0 0 357.454 3.362 10 0 FGAERN CC(=O)c1ccc(NC(=O)[C@H](C)N2CC[C@H](CNc3ccccn3)C2)cc1 ZINC000171647584 495966365 /nfs/dbraw/zinc/96/63/65/495966365.db2.gz ZXPYOJZYDFHUQO-DOTOQJQBSA-N 0 0 366.465 3.045 10 0 FGAERN COc1ccccc1CNC(=O)N[C@@H](C)c1cccc(-n2ccnc2)c1 ZINC000174455554 495966621 /nfs/dbraw/zinc/96/66/21/495966621.db2.gz YGOYAZQXHXZZTA-HNNXBMFYSA-N 0 0 350.422 3.441 10 0 FGAERN O=C(N1CCO[C@H](c2nccs2)C1)C1(c2ccc(F)cc2F)CCC1 ZINC000180369886 495968646 /nfs/dbraw/zinc/96/86/46/495968646.db2.gz DNQKXPONNSNKGT-HNNXBMFYSA-N 0 0 364.417 3.443 10 0 FGAERN COC(=O)c1ccccc1NC(=O)C(=O)N[C@@H]1CC[C@H](C)c2ccccc21 ZINC000180367747 495969227 /nfs/dbraw/zinc/96/92/27/495969227.db2.gz LYKCIWDWNNPGER-SCLBCKFNSA-N 0 0 366.417 3.167 10 0 FGAERN CC(C)C(=O)Nc1ccc(CNC(=O)N2CC[C@]3(O)CCCC[C@@H]3C2)cc1 ZINC000151863312 495973339 /nfs/dbraw/zinc/97/33/39/495973339.db2.gz FZXSMMIEFYESAF-DYESRHJHSA-N 0 0 373.497 3.118 10 0 FGAERN COc1cccc(F)c1[C@H](C)NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C ZINC000174470384 495973615 /nfs/dbraw/zinc/97/36/15/495973615.db2.gz YKAPZZZJJINLCF-UGSOOPFHSA-N 0 0 352.450 3.198 10 0 FGAERN COc1cccc(F)c1[C@H](C)NC(=O)[C@H](NC(=O)CC(C)C)C(C)C ZINC000174470398 495973825 /nfs/dbraw/zinc/97/38/25/495973825.db2.gz YKAPZZZJJINLCF-SCLBCKFNSA-N 0 0 352.450 3.198 10 0 FGAERN C[C@H]1CN(C(=O)c2cc(OC(F)F)cc(OC(F)F)c2)CCS1 ZINC000180387509 495976238 /nfs/dbraw/zinc/97/62/38/495976238.db2.gz GWYRPVCPGHVNDW-QMMMGPOBSA-N 0 0 353.337 3.467 10 0 FGAERN Cc1nccn1C[C@@H]1CCCN1C(=O)c1cc(C)nc2onc(C(C)C)c21 ZINC000177207325 495977005 /nfs/dbraw/zinc/97/70/05/495977005.db2.gz SBPOYXLBKVQJEJ-HNNXBMFYSA-N 0 0 367.453 3.464 10 0 FGAERN Cc1nc(Cc2ccccc2)sc1C(=O)N1CCC[C@H](n2cncn2)C1 ZINC000171662215 495978342 /nfs/dbraw/zinc/97/83/42/495978342.db2.gz KLIRTPUHSMYDPR-INIZCTEOSA-N 0 0 367.478 3.111 10 0 FGAERN c1csc([C@H]2CN(CCCc3nc(-c4ccccc4)no3)CCO2)n1 ZINC000171666340 495979564 /nfs/dbraw/zinc/97/95/64/495979564.db2.gz ISXDBDXZJSPXLZ-OAHLLOKOSA-N 0 0 356.451 3.199 10 0 FGAERN O=C(CN1CCO[C@@H](c2nccs2)C1)Nc1cccc(Cl)c1Cl ZINC000171667792 495981557 /nfs/dbraw/zinc/98/15/57/495981557.db2.gz IBSIMCKCGAKSAM-GFCCVEGCSA-N 0 0 372.277 3.462 10 0 FGAERN Cc1nc(-c2c[nH]c(C(=O)N3CCC[C@@H]3Cn3ccnc3C)c2)cs1 ZINC000177217085 495981667 /nfs/dbraw/zinc/98/16/67/495981667.db2.gz YMBVAWFJXDMSIZ-OAHLLOKOSA-N 0 0 355.467 3.256 10 0 FGAERN Cc1c(C(=O)N2CCC[C@@H]2C[C@H](O)c2ccco2)oc2c1C(=O)CCC2 ZINC000177216652 495982562 /nfs/dbraw/zinc/98/25/62/495982562.db2.gz CZXGCEZUTWKHCL-HIFRSBDPSA-N 0 0 357.406 3.428 10 0 FGAERN CCO[C@@H]1C[C@H]([NH2+][C@@H](CCC(=O)OC)c2ccccc2)C12CCOCC2 ZINC000186400349 495982551 /nfs/dbraw/zinc/98/25/51/495982551.db2.gz LZPPUSZAFSVUGB-GBESFXJTSA-N 0 0 361.482 3.245 10 0 FGAERN Cc1ccc(Cn2cccc(NC(=O)N3CCS[C@@H](C)C3)c2=O)cc1 ZINC000151895931 495984421 /nfs/dbraw/zinc/98/44/21/495984421.db2.gz DENSTUXSCHHMLX-HNNXBMFYSA-N 0 0 357.479 3.174 10 0 FGAERN C[C@@H](NC(=O)N1CCC(Cn2cncn2)CC1)c1ccc(F)c(Cl)c1 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COC(=O)c1cccc(C(=O)N2CCC[C@H]2C[C@@H](O)c2ccccc2)c1 ZINC000174854860 496135373 /nfs/dbraw/zinc/13/53/73/496135373.db2.gz LMQUZFVVQMVSJR-RBUKOAKNSA-N 0 0 353.418 3.202 10 0 FGAERN O=C(CCCc1nc(C2CC2)no1)N1CCC[C@H]1C[C@@H](O)c1ccccc1 ZINC000174857095 496136735 /nfs/dbraw/zinc/13/67/35/496136735.db2.gz AOMKTQPMEHMHIS-ZWKOTPCHSA-N 0 0 369.465 3.384 10 0 FGAERN CCO[C@@H]1C[C@H](NC(=O)N2CC[C@H](c3cnn(C)c3)C2)C12CCCCC2 ZINC000177625091 496137223 /nfs/dbraw/zinc/13/72/23/496137223.db2.gz NWWVDJKFZJHAER-RYQLBKOJSA-N 0 0 360.502 3.047 10 0 FGAERN CN(C)C(=O)c1ccc(C(=O)N2CCC[C@H]2C[C@@H](O)c2ccccc2)cc1 ZINC000174861316 496137863 /nfs/dbraw/zinc/13/78/63/496137863.db2.gz LNIBUYVATZHAIP-VQTJNVASSA-N 0 0 366.461 3.117 10 0 FGAERN CCNC(=O)N1CCc2ccc(NC(=O)N[C@@H]3COc4ccccc43)cc21 ZINC000174865142 496138777 /nfs/dbraw/zinc/13/87/77/496138777.db2.gz VWMZCQNWDMXCAF-MRXNPFEDSA-N 0 0 366.421 3.034 10 0 FGAERN CC(C)c1noc(CCC(=O)N2CCC[C@@H]2C[C@H](O)c2ccccc2)n1 ZINC000174864368 496139096 /nfs/dbraw/zinc/13/90/96/496139096.db2.gz XLQWVIJJKCRAPT-SJORKVTESA-N 0 0 357.454 3.240 10 0 FGAERN C[C@@H]1CCN(C(=O)CN2CC[C@H](c3cnn(C)c3)C2)c2ccccc2S1 ZINC000172051574 496141966 /nfs/dbraw/zinc/14/19/66/496141966.db2.gz XPTCLPUMVBHBPP-CVEARBPZSA-N 0 0 370.522 3.127 10 0 FGAERN O=C(Nc1ccc(OC2CCCC2)cc1)N1CCC[C@@H](n2cncn2)C1 ZINC000174885117 496148423 /nfs/dbraw/zinc/14/84/23/496148423.db2.gz KRPKJAPEWQBFOL-MRXNPFEDSA-N 0 0 355.442 3.469 10 0 FGAERN CCc1nccn1[C@@H]1CCCN(C(=O)C(=O)Nc2cccc(Cl)c2C)C1 ZINC000177663690 496151089 /nfs/dbraw/zinc/15/10/89/496151089.db2.gz XWFXRGANUHEFDS-CQSZACIVSA-N 0 0 374.872 3.210 10 0 FGAERN Cc1nc(-c2ccncc2)nc(N[C@H]2CCc3nnc(C(C)C)n3C2)c1C ZINC000172068642 496151231 /nfs/dbraw/zinc/15/12/31/496151231.db2.gz OJIYTVCPFQMWQP-INIZCTEOSA-N 0 0 363.469 3.297 10 0 FGAERN Brc1ccc([C@@H](N[C@H]2CCc3ncnn3C2)c2ccco2)cc1 ZINC000183898180 496153270 /nfs/dbraw/zinc/15/32/70/496153270.db2.gz DNAVOSIKXDQODL-WMLDXEAASA-N 0 0 373.254 3.328 10 0 FGAERN CC(C)(C)OC(=O)Cc1ccccc1NC(=O)NC[C@H]1CCCC[C@H]1O ZINC000174908476 496160013 /nfs/dbraw/zinc/16/00/13/496160013.db2.gz FDFVZNHQXVKKDT-NVXWUHKLSA-N 0 0 362.470 3.243 10 0 FGAERN Cc1ccccc1[C@@H](C)NC(=O)[C@@H](c1cccc(F)c1)N1CCOCC1 ZINC000152472417 496160960 /nfs/dbraw/zinc/16/09/60/496160960.db2.gz RAGQLOPNBYAPBM-OXQOHEQNSA-N 0 0 356.441 3.385 10 0 FGAERN COC(=O)C[C@H](NC(=O)CCc1ncc(C(C)(C)C)o1)c1ccccc1 ZINC000186810312 496163112 /nfs/dbraw/zinc/16/31/12/496163112.db2.gz ZCLBZIDPJVBTIV-HNNXBMFYSA-N 0 0 358.438 3.325 10 0 FGAERN Cc1nc2n(n1)CCC[C@H]2NC(=O)[C@@H](C)Oc1cc(C(C)C)ccc1C ZINC000177700903 496164544 /nfs/dbraw/zinc/16/45/44/496164544.db2.gz LHXXWZPYDIBLKU-RHSMWYFYSA-N 0 0 356.470 3.437 10 0 FGAERN CCC[C@@H](NC(=O)N1CCN(CCOC)[C@H](C)C1)c1ccc(F)cc1F ZINC000156127775 496165639 /nfs/dbraw/zinc/16/56/39/496165639.db2.gz VCDIFTHRFJXDPO-RDTXWAMCSA-N 0 0 369.456 3.168 10 0 FGAERN CC(C)CCOc1ccc([C@@H](C)NC(=O)NCc2ccc(C(N)=O)o2)cc1 ZINC000174931781 496169368 /nfs/dbraw/zinc/16/93/68/496169368.db2.gz QJJDMEGBQGQCST-CQSZACIVSA-N 0 0 373.453 3.364 10 0 FGAERN O=C(Nc1cccc(-c2ncco2)c1)N1CCO[C@H](c2nccs2)C1 ZINC000152508769 496171696 /nfs/dbraw/zinc/17/16/96/496171696.db2.gz WIWSKIPNJMKOOX-AWEZNQCLSA-N 0 0 356.407 3.404 10 0 FGAERN Cc1nc2n(n1)CCC[C@H]2NC(=O)Nc1ccc(OCC(F)(F)F)cc1 ZINC000177725615 496173082 /nfs/dbraw/zinc/17/30/82/496173082.db2.gz LJGOLJLDIDJMFL-CYBMUJFWSA-N 0 0 369.347 3.184 10 0 FGAERN Cc1nc2n(n1)CCC[C@@H]2NC(=O)Nc1ccccc1OCC(F)(F)F ZINC000177727476 496173864 /nfs/dbraw/zinc/17/38/64/496173864.db2.gz UZXOGRJPKRMABR-LBPRGKRZSA-N 0 0 369.347 3.184 10 0 FGAERN Cc1ccc(NC(=O)N2CCC[C@H]2c2cnn(C)c2)cc1N1CCOC1=O ZINC000174943518 496175583 /nfs/dbraw/zinc/17/55/83/496175583.db2.gz MAFYDVZYSJTPEL-INIZCTEOSA-N 0 0 369.425 3.054 10 0 FGAERN CNc1nnc(CC(=O)N[C@@H]2CC3(CCCC3)Oc3ccccc32)s1 ZINC000183957091 496177205 /nfs/dbraw/zinc/17/72/05/496177205.db2.gz NCJNBCQROWTARV-CYBMUJFWSA-N 0 0 358.467 3.075 10 0 FGAERN C[C@H](C[N@H+](C)C[C@H](O)COCc1ccc(Cl)cc1)c1nccs1 ZINC000183975296 496183918 /nfs/dbraw/zinc/18/39/18/496183918.db2.gz LGWYOVUYXMBYGK-CJNGLKHVSA-N 0 0 354.903 3.410 10 0 FGAERN CCc1ccc([C@@H]2CCCCN2C(=O)N[C@H]2CCc3nc(CC)nn3C2)o1 ZINC000174962857 496184281 /nfs/dbraw/zinc/18/42/81/496184281.db2.gz SHLAGNYQDQRCHS-HOCLYGCPSA-N 0 0 371.485 3.248 10 0 FGAERN CC(=O)N(C)c1cccc(NC(=O)N[C@@H](C[NH+](C)C)c2ccccc2)c1 ZINC000174974762 496189240 /nfs/dbraw/zinc/18/92/40/496189240.db2.gz BZXZYXOFDCDUTD-IBGZPJMESA-N 0 0 354.454 3.094 10 0 FGAERN CNC(=O)c1cccc(NC(=O)N[C@H](Cc2ccccc2)C(F)(F)F)c1 ZINC000156263909 496201557 /nfs/dbraw/zinc/20/15/57/496201557.db2.gz ZTMQXJCLPNBZCJ-OAHLLOKOSA-N 0 0 365.355 3.341 10 0 FGAERN CCS[C@@H]1CCCC[C@@H]1NC(=O)N1CCC(Nc2cccnn2)CC1 ZINC000175013592 496207752 /nfs/dbraw/zinc/20/77/52/496207752.db2.gz CTENJJLSPNWZQC-JKSUJKDBSA-N 0 0 363.531 3.127 10 0 FGAERN CCC1CCC(NC(=O)Nc2ccc(S(=O)(=O)CCOC)cc2)CC1 ZINC000172232792 496220922 /nfs/dbraw/zinc/22/09/22/496220922.db2.gz XYCAVDNMFOSOOY-UHFFFAOYSA-N 0 0 368.499 3.197 10 0 FGAERN Cc1cnn(CCNC(=O)N(Cc2ccc3c(c2)CCO3)C2CCCC2)c1 ZINC000175040867 496222303 /nfs/dbraw/zinc/22/23/03/496222303.db2.gz LLFHGZVTZZLGJL-UHFFFAOYSA-N 0 0 368.481 3.281 10 0 FGAERN Cc1nn(C)c(C)c1[C@@H]1CCCN1C(=O)N[C@H](CCCO)c1ccccc1 ZINC000156359839 496224098 /nfs/dbraw/zinc/22/40/98/496224098.db2.gz CDTUBAVOWFKYGR-MOPGFXCFSA-N 0 0 370.497 3.397 10 0 FGAERN COc1ccc(-n2nnc(C(=O)N3CCC[C@@H]3c3ccco3)c2C)cc1 ZINC000172245552 496226763 /nfs/dbraw/zinc/22/67/63/496226763.db2.gz CQHHZCSPAGXWJR-MRXNPFEDSA-N 0 0 352.394 3.155 10 0 FGAERN CCOc1ccccc1C(=O)NCC(=O)N[C@@H]1c2cc(C)ccc2C[C@@H]1C ZINC000161765620 496235034 /nfs/dbraw/zinc/23/50/34/496235034.db2.gz IWYXEDVFVGCAFQ-BTYIYWSLSA-N 0 0 366.461 3.173 10 0 FGAERN CCO[C@@H]1C[C@@H](NC(=O)Nc2cccc(OC(F)F)c2)C12CCOCC2 ZINC000184099205 496237756 /nfs/dbraw/zinc/23/77/56/496237756.db2.gz BMXFWLXXONFHRK-HUUCEWRRSA-N 0 0 370.396 3.384 10 0 FGAERN CCCCOc1ccc([C@@H](C)NC(=O)NCCn2cc(C)cn2)cc1OC ZINC000172277075 496237708 /nfs/dbraw/zinc/23/77/08/496237708.db2.gz LDTZHXPMCIMWPY-MRXNPFEDSA-N 0 0 374.485 3.439 10 0 FGAERN Cc1ccc2c(c1)[C@H](NC(=O)NCc1ccc(C(=O)N(C)C)cc1)[C@H](C)C2 ZINC000181005578 496237882 /nfs/dbraw/zinc/23/78/82/496237882.db2.gz OVMOTZZWTGSGTO-FOIQADDNSA-N 0 0 365.477 3.430 10 0 FGAERN COC(=O)[C@@]1(C)CCN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2Cl)C1 ZINC000177885606 496239107 /nfs/dbraw/zinc/23/91/07/496239107.db2.gz ZTSLAMCCDSSVJO-HWPZZCPQSA-N 0 0 360.237 3.172 10 0 FGAERN COc1cccc(-c2nsc(NC(=O)N3CCS[C@H](C)C3)n2)c1 ZINC000184109017 496240975 /nfs/dbraw/zinc/24/09/75/496240975.db2.gz UPRBKQYVJFWXCP-SNVBAGLBSA-N 0 0 350.469 3.183 10 0 FGAERN CC1(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)c2cccs2)CCC1 ZINC000175101641 496248351 /nfs/dbraw/zinc/24/83/51/496248351.db2.gz NQXLAGGPCAMRCP-MRXNPFEDSA-N 0 0 356.491 3.396 10 0 FGAERN C[C@H](NC(=O)Cc1ccccc1OC(F)F)c1ccc2c(c1)OCCO2 ZINC000172324158 496254131 /nfs/dbraw/zinc/25/41/31/496254131.db2.gz DQVOAIGALGGTBA-LBPRGKRZSA-N 0 0 363.360 3.479 10 0 FGAERN Cc1cnc([C@H](C)NC(=O)[C@H]2CC[C@H](NC(=O)OC(C)(C)C)C2)s1 ZINC000177927672 496255127 /nfs/dbraw/zinc/25/51/27/496255127.db2.gz INTPYYWCYXMXTE-AVGNSLFASA-N 0 0 353.488 3.322 10 0 FGAERN Cc1ccnn1-c1ccccc1NC(=O)C(=O)N[C@@H]1CCCc2ccccc21 ZINC000184139824 496255632 /nfs/dbraw/zinc/25/56/32/496255632.db2.gz RZYYPXZLQWCXSJ-GOSISDBHSA-N 0 0 374.444 3.313 10 0 FGAERN O=C(N[C@@H](Cc1ccccc1)C(F)(F)F)c1cccc(-c2nc[nH]n2)c1 ZINC000156478816 496257385 /nfs/dbraw/zinc/25/73/85/496257385.db2.gz YDSSJSGYJHFJHS-HNNXBMFYSA-N 0 0 360.339 3.375 10 0 FGAERN COc1cc(NC(=O)N[C@H](C)c2ccc(S(C)(=O)=O)cc2)ccc1F ZINC000187033838 496262044 /nfs/dbraw/zinc/26/20/44/496262044.db2.gz KPKPOTQOHFJKDJ-LLVKDONJSA-N 0 0 366.414 3.121 10 0 FGAERN CCO[C@@H]1C[C@@H](NC(=O)C[C@@H](C)c2cccc(OC)c2)C12CCOCC2 ZINC000187034572 496262189 /nfs/dbraw/zinc/26/21/89/496262189.db2.gz OIDBWCXWBXLXFN-ATZDWAIDSA-N 0 0 361.482 3.279 10 0 FGAERN C[C@H](NC(=O)N1CCN(c2nc3ccccc3o2)CC1)c1cccs1 ZINC000172345778 496262569 /nfs/dbraw/zinc/26/25/69/496262569.db2.gz ZMURFSOEUGNHGG-ZDUSSCGKSA-N 0 0 356.451 3.482 10 0 FGAERN CCO[C@@H]1C[C@H](NC(=O)c2cnc(C(C)(C)C)s2)C12CCOCC2 ZINC000187037631 496262560 /nfs/dbraw/zinc/26/25/60/496262560.db2.gz VHRVXYISUTXVBT-UONOGXRCSA-N 0 0 352.500 3.145 10 0 FGAERN O=C(c1csc([C@@H]2CCCO2)n1)N1CCC[C@H]1C[C@H](O)c1ccco1 ZINC000156507860 496263707 /nfs/dbraw/zinc/26/37/07/496263707.db2.gz FBMWEEIDZQFJIO-NOLJZWGESA-N 0 0 362.451 3.316 10 0 FGAERN CCO[C@H]1C[C@@H](NC(=O)CCSc2ccc(F)cc2)C12CCOCC2 ZINC000187040140 496264559 /nfs/dbraw/zinc/26/45/59/496264559.db2.gz LJGXMPZITZZRQW-SJORKVTESA-N 0 0 367.486 3.398 10 0 FGAERN Cc1cc([C@H](NC(=O)[C@@H](C)NC(N)=O)c2ccccc2Cl)ccc1F ZINC000152814882 496265364 /nfs/dbraw/zinc/26/53/64/496265364.db2.gz WDYIAXVUNPGPBW-BZNIZROVSA-N 0 0 363.820 3.050 10 0 FGAERN CCOc1cc(C)ccc1NC(=O)N[C@H]1C[C@@H](OCC)C12CCOCC2 ZINC000184162646 496266252 /nfs/dbraw/zinc/26/62/52/496266252.db2.gz HHGUQQHLTAZQGM-ZWKOTPCHSA-N 0 0 362.470 3.489 10 0 FGAERN Cc1n[nH]c(=O)c(C(=O)O[C@H](C)c2ccc(Br)cc2F)c1C ZINC000177968920 496270838 /nfs/dbraw/zinc/27/08/38/496270838.db2.gz TYGSZOGPAWHTFY-SECBINFHSA-N 0 0 369.190 3.206 10 0 FGAERN CCCC(=O)N[C@@H]1CCCN(C(=O)NCc2ccc(Cl)c(C)c2)C1 ZINC000187056286 496272174 /nfs/dbraw/zinc/27/21/74/496272174.db2.gz MYXODFDRKZOFNZ-OAHLLOKOSA-N 0 0 351.878 3.239 10 0 FGAERN Cn1cc(Br)cc(NC(=O)N2CCC[C@H]2c2ccco2)c1=O ZINC000177977713 496273494 /nfs/dbraw/zinc/27/34/94/496273494.db2.gz PAYOMMRPTOADNB-LBPRGKRZSA-N 0 0 366.215 3.110 10 0 FGAERN CCO[C@H]1C[C@H](NC(=O)c2cccc(OCC(C)C)c2)C12CCOCC2 ZINC000187061952 496275851 /nfs/dbraw/zinc/27/58/51/496275851.db2.gz RQHRJJGMSALMPH-OALUTQOASA-N 0 0 361.482 3.425 10 0 FGAERN Cn1cc([C@@H]2CCCN2[C@@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)cn1 ZINC000156564785 496280079 /nfs/dbraw/zinc/28/00/79/496280079.db2.gz IFSGELHMZSVCID-DLBZAZTESA-N 0 0 362.836 3.155 10 0 FGAERN COc1cc(C)c(NC(=O)C(=O)N[C@H]2CCCc3ccccc32)cc1F ZINC000187073226 496280415 /nfs/dbraw/zinc/28/04/15/496280415.db2.gz 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ZINC000248536209 497033248 /nfs/dbraw/zinc/03/32/48/497033248.db2.gz GUGIBEDLONBCIV-OCCSQVGLSA-N 0 0 371.268 3.078 10 0 FGAERN CCOC(=O)[C@H](N[C@@H](C)[C@H]1CCCO1)c1ccc(Br)cc1F ZINC000248555013 497038034 /nfs/dbraw/zinc/03/80/34/497038034.db2.gz BASFOQXFJFEOOH-COLVAYQJSA-N 0 0 374.250 3.350 10 0 FGAERN C[C@@H]1CCCC[C@@H]1NC(=O)N1CCC(N(C)CC(=O)OC(C)(C)C)CC1 ZINC000192224144 497040133 /nfs/dbraw/zinc/04/01/33/497040133.db2.gz QJTPFNZJDUMXLD-WBVHZDCISA-N 0 0 367.534 3.013 10 0 FGAERN O[C@@H]1C[C@H](c2cccc(C(F)(F)F)c2)N(CCO[C@H]2CCCCO2)C1 ZINC000248567170 497042873 /nfs/dbraw/zinc/04/28/73/497042873.db2.gz LDBINHAKWGYLFB-ZACQAIPSSA-N 0 0 359.388 3.356 10 0 FGAERN CC(C)(C)c1csc([C@H]2CN(CCO[C@H]3CCCCO3)CCO2)n1 ZINC000248572322 497044457 /nfs/dbraw/zinc/04/44/57/497044457.db2.gz MJRJPLYUTHRKJB-ZBFHGGJFSA-N 0 0 354.516 3.357 10 0 FGAERN CC(C)(C)OC(=O)N[C@@H]1CC[C@H]2CN(c3nccc(C(F)(F)F)n3)C[C@H]21 ZINC000248578686 497046018 /nfs/dbraw/zinc/04/60/18/497046018.db2.gz OBJZAJNUCXUTFD-QJPTWQEYSA-N 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495941836 /nfs/dbraw/zinc/94/18/36/495941836.db2.gz SVJAXPZXBLHGIY-GFCCVEGCSA-N 0 0 363.845 3.352 10 0 FGAERN O=C(Nc1ccc(NC(=O)N2CCC(c3cc[nH]n3)CC2)cc1)C1CC1 ZINC000151795121 495950766 /nfs/dbraw/zinc/95/07/66/495950766.db2.gz VHNMNZJRGQTVSR-UHFFFAOYSA-N 0 0 353.426 3.170 10 0 FGAERN C[C@H](NC(=O)N[C@H]1CCCCC1(C)C)c1ccc(S(C)(=O)=O)cc1 ZINC000177160946 495954526 /nfs/dbraw/zinc/95/45/26/495954526.db2.gz KBIUDGBQJXBESM-BBRMVZONSA-N 0 0 352.500 3.419 10 0 FGAERN CC[C@@H](NC(=O)N1CCC(c2ccnn2C)CC1)c1ccc(OC)cc1 ZINC000155433271 495955324 /nfs/dbraw/zinc/95/53/24/495955324.db2.gz ZTMUFSFPOMPDST-GOSISDBHSA-N 0 0 356.470 3.469 10 0 FGAERN COC(=O)c1cc(F)ccc1CN1CCCC[C@H]1c1nnc2n1CCCC2 ZINC000171640178 495960839 /nfs/dbraw/zinc/96/08/39/495960839.db2.gz AIXQCNASBKPVHF-KRWDZBQOSA-N 0 0 372.444 3.267 10 0 FGAERN COCCC1(CNC(=O)N2CC[C@@]3(O)CCCC[C@H]3C2)CCCCC1 ZINC000186354292 495962126 /nfs/dbraw/zinc/96/21/26/495962126.db2.gz POTQCTGVCNCIIZ-PXNSSMCTSA-N 0 0 352.519 3.310 10 0 FGAERN CCOc1ccccc1NC(=O)[C@@H](C)N1CC[C@H](CNc2ccccn2)C1 ZINC000171644258 495962530 /nfs/dbraw/zinc/96/25/30/495962530.db2.gz UDDBLSIEXPYEOD-IAGOWNOFSA-N 0 0 368.481 3.241 10 0 FGAERN Cc1ccc(F)cc1NC(=O)[C@H](C)N1CC[C@H](CNc2ccccn2)C1 ZINC000171642925 495962628 /nfs/dbraw/zinc/96/26/28/495962628.db2.gz WHALTMHDJUQRBA-JKSUJKDBSA-N 0 0 356.445 3.290 10 0 FGAERN C[C@@H](C(=O)Nc1c(F)cccc1F)N1CC[C@H](CNc2ccccn2)C1 ZINC000171644231 495962757 /nfs/dbraw/zinc/96/27/57/495962757.db2.gz BKBLHAGOOLICNO-UONOGXRCSA-N 0 0 360.408 3.121 10 0 FGAERN Cc1nccn1C[C@H]1CCCN1C(=O)c1cc(Br)ccc1F ZINC000177181171 495963615 /nfs/dbraw/zinc/96/36/15/495963615.db2.gz WTSCERKCGMQXFC-CYBMUJFWSA-N 0 0 366.234 3.398 10 0 FGAERN Cc1nccn1C[C@@H]1CCCN1C(=O)c1cc2cnn(C(C)C)c2nc1C ZINC000177181825 495963816 /nfs/dbraw/zinc/96/38/16/495963816.db2.gz RNULUBQKGWLPRC-KRWDZBQOSA-N 0 0 366.469 3.130 10 0 FGAERN CC[C@@H](C(=O)N1CCC[C@H](Cc2noc(C)n2)C1)c1ccc(OC)cc1 ZINC000180361706 495966056 /nfs/dbraw/zinc/96/60/56/495966056.db2.gz ULNKUEFPBYUGGT-CRAIPNDOSA-N 0 0 357.454 3.362 10 0 FGAERN O=C(CN1CC[C@H](CNc2ccccn2)C1)Nc1cccc2c1N=S=N2 ZINC000171646083 495966657 /nfs/dbraw/zinc/96/66/57/495966657.db2.gz DWWZIECXEWYQPC-CYBMUJFWSA-N 0 0 368.466 3.181 10 0 FGAERN CC(=O)c1ccc(NC(=O)[C@@H](C)N2CC[C@H](CNc3ccccn3)C2)cc1 ZINC000171647587 495967173 /nfs/dbraw/zinc/96/71/73/495967173.db2.gz ZXPYOJZYDFHUQO-NVXWUHKLSA-N 0 0 366.465 3.045 10 0 FGAERN O=C(Nc1ccc(OCC2CCCCC2)cc1)C(=O)N[C@@H]1CCCC[C@@H]1O ZINC000177187719 495968061 /nfs/dbraw/zinc/96/80/61/495968061.db2.gz IUUBIFXDGRHULW-MOPGFXCFSA-N 0 0 374.481 3.004 10 0 FGAERN CC[C@H](C)Oc1cc(C(=O)N2CCC[C@H](Cc3noc(C)n3)C2)ccn1 ZINC000180373320 495970198 /nfs/dbraw/zinc/97/01/98/495970198.db2.gz YXQJMWKDXUTIJG-DZGCQCFKSA-N 0 0 358.442 3.045 10 0 FGAERN Cc1nn(C)c(C)c1[C@@H]1CCCN1C(=O)c1c(C)c2ccccc2oc1=O ZINC000177200229 495973308 /nfs/dbraw/zinc/97/33/08/495973308.db2.gz GXVKIRLSLNYXEZ-INIZCTEOSA-N 0 0 365.433 3.429 10 0 FGAERN Cc1nccn1C[C@H]1CCCN1C(=O)c1cccc(OC[C@H]2CCCO2)c1 ZINC000177203993 495976022 /nfs/dbraw/zinc/97/60/22/495976022.db2.gz QVXODRGBSGOSNT-UYAOXDASSA-N 0 0 369.465 3.054 10 0 FGAERN Cc1nccn1C[C@H]1CCCN1C(=O)c1ccc(N2CCC(C)=N2)cc1 ZINC000177207087 495977071 /nfs/dbraw/zinc/97/70/71/495977071.db2.gz SYVMQIIVKURRDF-LJQANCHMSA-N 0 0 351.454 3.082 10 0 FGAERN CC(C)CC(=O)N[C@@H](C(=O)NCCc1csc(C(C)(C)C)n1)C(C)C ZINC000155506111 495977794 /nfs/dbraw/zinc/97/77/94/495977794.db2.gz RHNWDVZTGPDMIB-MRXNPFEDSA-N 0 0 367.559 3.286 10 0 FGAERN Cn1ccnc1COc1ccc(CN2CCO[C@@H](c3nccs3)C2)cc1 ZINC000171662406 495978748 /nfs/dbraw/zinc/97/87/48/495978748.db2.gz LWTIYBHVGYVAEE-QGZVFWFLSA-N 0 0 370.478 3.029 10 0 FGAERN Cc1ccc(-c2cnc(CCC(=O)N3CCC[C@@H](n4cncn4)C3)o2)cc1 ZINC000171662714 495978766 /nfs/dbraw/zinc/97/87/66/495978766.db2.gz FQZQIPPSWXPKSP-QGZVFWFLSA-N 0 0 365.437 3.038 10 0 FGAERN Cc1nccn1C[C@H]1CCCN1C(=O)Cc1ccc(OCC(C)C)cc1 ZINC000177222074 495983371 /nfs/dbraw/zinc/98/33/71/495983371.db2.gz KVDIZMMTJLJRGL-LJQANCHMSA-N 0 0 355.482 3.460 10 0 FGAERN CCc1nc2n(n1)CCC[C@H]2NC(=O)C1(Cc2cccc(F)c2)CCC1 ZINC000186401675 495983486 /nfs/dbraw/zinc/98/34/86/495983486.db2.gz FKZDHDFNYQITNC-MRXNPFEDSA-N 0 0 356.445 3.344 10 0 FGAERN C[C@@H]1CN(CCS(=O)(=O)c2cc(Cl)ccc2Cl)CCS1 ZINC000171699634 495993950 /nfs/dbraw/zinc/99/39/50/495993950.db2.gz HIFFYDGFPQUMSP-SNVBAGLBSA-N 0 0 354.324 3.204 10 0 FGAERN CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(C1)OCc1ccccc12 ZINC000186432250 495996730 /nfs/dbraw/zinc/99/67/30/495996730.db2.gz QADDKMJQSSGIMX-UWJYYQICSA-N 0 0 374.481 3.338 10 0 FGAERN CC(C)OC(=O)[C@@H](C)CNC(=O)N[C@@H](C)c1ccccc1Br ZINC000174555205 496007536 /nfs/dbraw/zinc/00/75/36/496007536.db2.gz YLGQLADALBIBCU-RYUDHWBXSA-N 0 0 371.275 3.397 10 0 FGAERN CN(c1nc(C(F)F)nc2ccccc21)[C@H]1CCCN(c2cccnn2)C1 ZINC000171727503 496009694 /nfs/dbraw/zinc/00/96/94/496009694.db2.gz ZMQKFAZHGVTZKI-ZDUSSCGKSA-N 0 0 370.407 3.463 10 0 FGAERN O=C(NCCNC(=O)[C@H]1C[C@H]1C1CCCCC1)c1c(F)cccc1F ZINC000155610208 496012315 /nfs/dbraw/zinc/01/23/15/496012315.db2.gz DVKMDSYXUWFIEC-KBPBESRZSA-N 0 0 350.409 3.027 10 0 FGAERN CCO[C@H]1C[C@@H](Nc2ccc(N3CCOCC3)c(F)c2)C12CCOCC2 ZINC000186485905 496016666 /nfs/dbraw/zinc/01/66/66/496016666.db2.gz KNVJKWYWCVPKGO-MOPGFXCFSA-N 0 0 364.461 3.048 10 0 FGAERN O=C([C@@H]1C[C@@H]1c1ccc(F)c(F)c1)N1CCCN(c2nccs2)CC1 ZINC000171744577 496018303 /nfs/dbraw/zinc/01/83/03/496018303.db2.gz KLBMHUGDYBRGQG-ZIAGYGMSSA-N 0 0 363.433 3.264 10 0 FGAERN CCc1nnc(-c2cccc(NC(=O)C(=O)N[C@H](C)c3cccs3)c2)o1 ZINC000174581971 496021215 /nfs/dbraw/zinc/02/12/15/496021215.db2.gz XJVBGQUSHAELQO-LLVKDONJSA-N 0 0 370.434 3.176 10 0 FGAERN C[C@H](N[C@@H](C)c1ccccc1-n1cccn1)c1nnnn1-c1ccccc1 ZINC000177343301 496025511 /nfs/dbraw/zinc/02/55/11/496025511.db2.gz ALUJJUQOFMLDRM-HOTGVXAUSA-N 0 0 359.437 3.260 10 0 FGAERN Cc1nc(C[C@H]2CCCN(C(=O)C[C@@H](C)C(=O)c3cccc(F)c3)C2)no1 ZINC000174607884 496031406 /nfs/dbraw/zinc/03/14/06/496031406.db2.gz IZHFSHHYCYCRPI-UKRRQHHQSA-N 0 0 373.428 3.207 10 0 FGAERN O=C(NCCc1cccc(O)c1)N1CCC[C@H]1C[C@@H](O)c1ccccc1 ZINC000174615506 496033448 /nfs/dbraw/zinc/03/34/48/496033448.db2.gz YXJOTPUEUFRPQX-AZUAARDMSA-N 0 0 354.450 3.232 10 0 FGAERN C[C@H](OCCCNC(=O)N1CCC[C@@H]1Cn1ccnc1)c1ccccc1 ZINC000177368803 496034146 /nfs/dbraw/zinc/03/41/46/496034146.db2.gz JKELONUTUQQTRX-PKOBYXMFSA-N 0 0 356.470 3.225 10 0 FGAERN COc1ccc([C@@H](C)C(=O)N[C@H](C)c2cn(-c3ccccc3)nn2)cc1 ZINC000155689673 496036908 /nfs/dbraw/zinc/03/69/08/496036908.db2.gz GINUXQSGBIPCDR-HUUCEWRRSA-N 0 0 350.422 3.257 10 0 FGAERN C[C@H](NC(=O)C1(c2ccc(F)cc2F)CCC1)c1nnc2n1CCCC2 ZINC000180541795 496038173 /nfs/dbraw/zinc/03/81/73/496038173.db2.gz PFNYEAYGUXYOAW-LBPRGKRZSA-N 0 0 360.408 3.192 10 0 FGAERN Cc1ccc(N2CCCN(C(=O)c3ccc(-c4ccccc4)[nH]3)CC2)nn1 ZINC000171810101 496045371 /nfs/dbraw/zinc/04/53/71/496045371.db2.gz VCWSYKVPKKKLOX-UHFFFAOYSA-N 0 0 361.449 3.133 10 0 FGAERN Cc1cncc(/C=C/C(=O)NC2C[C@H]3CC[C@@H](C2)N3C(=O)OC(C)(C)C)c1 ZINC000152094691 496046249 /nfs/dbraw/zinc/04/62/49/496046249.db2.gz KMRSUSRRDMJZQN-CZGIROQOSA-N 0 0 371.481 3.450 10 0 FGAERN CCCn1cc(CN2CCCN(C(=O)CCc3cccs3)CC2)cn1 ZINC000171818296 496048785 /nfs/dbraw/zinc/04/87/85/496048785.db2.gz CKNAKRJIHKEGJO-UHFFFAOYSA-N 0 0 360.527 3.022 10 0 FGAERN CCc1nccn1[C@H]1CCCN(C(=O)c2ccc(F)c(NC(C)=O)c2)C1 ZINC000171821085 496049842 /nfs/dbraw/zinc/04/98/42/496049842.db2.gz YPIOQPKUTOSYPK-HNNXBMFYSA-N 0 0 358.417 3.020 10 0 FGAERN CCc1nc2n(n1)CCC[C@H]2NC(=O)c1c[nH]nc1-c1ccccc1Cl ZINC000180585639 496055762 /nfs/dbraw/zinc/05/57/62/496055762.db2.gz YJAYNBBZZXKBKE-CQSZACIVSA-N 0 0 370.844 3.149 10 0 FGAERN Cc1cc(C(=O)N2CCO[C@H](c3nccs3)C2)c2c(n1)onc2C(C)C ZINC000171853620 496063858 /nfs/dbraw/zinc/06/38/58/496063858.db2.gz VJLKFSOVULPZDQ-ZDUSSCGKSA-N 0 0 372.450 3.325 10 0 FGAERN CC(C)(C)C(=O)NC[C@H]1CCCN(C(=O)N[C@H]2CCOc3ccccc32)C1 ZINC000171865707 496067998 /nfs/dbraw/zinc/06/79/98/496067998.db2.gz QMRQUDWHAYBFBB-WBVHZDCISA-N 0 0 373.497 3.094 10 0 FGAERN CCCCCC[C@H](C)CC(=O)N1CCCN(Cc2noc(C)n2)CC1 ZINC000171864210 496068667 /nfs/dbraw/zinc/06/86/67/496068667.db2.gz XBNDVPGABGOSDM-INIZCTEOSA-N 0 0 350.507 3.409 10 0 FGAERN CCCc1csc(NC(=O)N[C@H]2CCS(=O)(=O)c3ccccc32)n1 ZINC000180619364 496071634 /nfs/dbraw/zinc/07/16/34/496071634.db2.gz MYVDVOPIWZAQHZ-ZDUSSCGKSA-N 0 0 365.480 3.136 10 0 FGAERN CCCC1(CNC(=O)N[C@@H]2CCS(=O)(=O)c3ccccc32)CCC1 ZINC000177471653 496075314 /nfs/dbraw/zinc/07/53/14/496075314.db2.gz NUNHTUSKLOZWMO-OAHLLOKOSA-N 0 0 350.484 3.175 10 0 FGAERN Cc1noc([C@H](C)N2CCN(C(=O)[C@@H](C)CCCc3ccccc3)CC2)n1 ZINC000180626443 496075370 /nfs/dbraw/zinc/07/53/70/496075370.db2.gz FEHRPYYCWLDUST-IRXDYDNUSA-N 0 0 370.497 3.242 10 0 FGAERN CCCc1ccccc1NC(=O)N1CCCN(Cc2cnn(C)c2)CC1 ZINC000155828401 496080063 /nfs/dbraw/zinc/08/00/63/496080063.db2.gz FWKKGJSDOHNCRA-UHFFFAOYSA-N 0 0 355.486 3.112 10 0 FGAERN Cc1c(N[C@H](C)C(C)C)cccc1C(=O)N1C[C@@H](C)[C@H](N2CCOCC2)C1 ZINC000174733782 496080766 /nfs/dbraw/zinc/08/07/66/496080766.db2.gz ABJRRDZHMKLBOI-HGHGUNKESA-N 0 0 373.541 3.244 10 0 FGAERN CC[N@H+](CC(=O)[O-])C1CCN(C(=O)c2cc3cc(Cl)ccc3o2)CC1 ZINC000186636224 496083351 /nfs/dbraw/zinc/08/33/51/496083351.db2.gz ATKWDHBGZURIIL-UHFFFAOYSA-N 0 0 364.829 3.097 10 0 FGAERN Cc1cnn(C[C@@H]2CN(C(=O)N[C@@H](CC(C)C)c3ccccc3)CCO2)c1 ZINC000171915876 496090558 /nfs/dbraw/zinc/09/05/58/496090558.db2.gz MIPPNMXWGPALBJ-PMACEKPBSA-N 0 0 370.497 3.389 10 0 FGAERN CCc1csc([C@H]2CCCN(C(=O)C(=O)Nc3cccc(OC)c3)C2)n1 ZINC000177514947 496093362 /nfs/dbraw/zinc/09/33/62/496093362.db2.gz TZJNKVKRGIOVMD-ZDUSSCGKSA-N 0 0 373.478 3.059 10 0 FGAERN CCc1ccc([C@@H]2CCCCN2C(=O)N[C@H](C)[C@@H](C)N2CCOCC2)o1 ZINC000174760566 496095232 /nfs/dbraw/zinc/09/52/32/496095232.db2.gz LNILENHKFJCNLR-NUJGCVRESA-N 0 0 363.502 3.188 10 0 FGAERN C[C@@H]1C[C@@H](CC(=O)N2CCC[C@H]([N@H+](C)CC(=O)[O-])CC2)CC(C)(C)C1 ZINC000186664951 496098216 /nfs/dbraw/zinc/09/82/16/496098216.db2.gz YWNKXEOROCXYSY-IKGGRYGDSA-N 0 0 352.519 3.236 10 0 FGAERN 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372.490 3.397 10 0 FGAERN Cc1ccccc1-n1nccc1NC(=O)N1CC[C@@]2(O)CCCC[C@H]2C1 ZINC000182369583 495536256 /nfs/dbraw/zinc/53/62/56/495536256.db2.gz IMOSILZZIHIGNE-JXFKEZNVSA-N 0 0 354.454 3.340 10 0 FGAERN Cc1csc([C@H]2CCCN(C(=O)Nc3nc4c(s3)COCC4)C2)n1 ZINC000173467786 495543663 /nfs/dbraw/zinc/54/36/63/495543663.db2.gz YJGWURCIGFXHGY-NSHDSACASA-N 0 0 364.496 3.392 10 0 FGAERN COc1cc(C(=O)N2CCC[C@H]2C[C@H](O)c2ccco2)cc(OC)c1C ZINC000154207108 495544017 /nfs/dbraw/zinc/54/40/17/495544017.db2.gz AJMVYIPNNNXQCR-HOTGVXAUSA-N 0 0 359.422 3.334 10 0 FGAERN CCCOc1ccc([C@@H](C)NC(=O)c2cc[nH]c(=O)c2)cc1OCCC ZINC000158590612 495545581 /nfs/dbraw/zinc/54/55/81/495545581.db2.gz NWIJPMQZMDSATB-CQSZACIVSA-N 0 0 358.438 3.444 10 0 FGAERN Cc1nn(CC(C)C)c(C)c1CC(=O)N1CCC[C@@H]1C[C@H](O)c1ccco1 ZINC000154216418 495546983 /nfs/dbraw/zinc/54/69/83/495546983.db2.gz GKGGNXGAMZSKQP-MJGOQNOKSA-N 0 0 373.497 3.406 10 0 FGAERN Cc1csc([C@@H]2CCCN(C(=O)NCCCNc3ccccn3)C2)n1 ZINC000173484707 495553096 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ZINC000182475231 495578184 /nfs/dbraw/zinc/57/81/84/495578184.db2.gz GRHZCAKOMOHQTB-KRWDZBQOSA-N 0 0 357.458 3.420 10 0 FGAERN CCC1CCC(NC(=O)Nc2cc(S(=O)(=O)N(C)C)ccc2F)CC1 ZINC000173545936 495582040 /nfs/dbraw/zinc/58/20/40/495582040.db2.gz STRCNNGIGCXTFP-UHFFFAOYSA-N 0 0 371.478 3.166 10 0 FGAERN O=C(N[C@@H](c1ccco1)c1ccccc1)N1CCC[C@@H](n2cncn2)C1 ZINC000173549398 495584315 /nfs/dbraw/zinc/58/43/15/495584315.db2.gz UFMHWDVANHSRSS-SJLPKXTDSA-N 0 0 351.410 3.007 10 0 FGAERN CCn1cnnc1C1CCN(C(=O)[C@H](C)c2cn(C)c3ccccc23)CC1 ZINC000185462371 495585695 /nfs/dbraw/zinc/58/56/95/495585695.db2.gz QDXZGKIPOURSLB-OAHLLOKOSA-N 0 0 365.481 3.299 10 0 FGAERN O=C(N[C@H]1CCS(=O)(=O)c2ccccc21)c1cnc2ccc(F)cc2c1 ZINC000179431711 495588778 /nfs/dbraw/zinc/58/87/78/495588778.db2.gz OULIGFYQSCWSGZ-KRWDZBQOSA-N 0 0 370.405 3.022 10 0 FGAERN CC(C)(C)OC(=O)N1C[C@@H](NC(=O)C(F)(F)F)[C@@H](c2ccccc2)C1 ZINC000149007809 495589293 /nfs/dbraw/zinc/58/92/93/495589293.db2.gz WCOFBNUOSFGOPQ-CHWSQXEVSA-N 0 0 358.360 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/nfs/dbraw/zinc/59/53/68/495595368.db2.gz XZJZUQXLNYKPJT-GOSISDBHSA-N 0 0 370.449 3.343 10 0 FGAERN CC(C)c1nc([C@H]2CCCN2C(=O)c2ccn(-c3cccc(F)c3)n2)no1 ZINC000173593751 495603228 /nfs/dbraw/zinc/60/32/28/495603228.db2.gz POJFODBQXFCNTR-MRXNPFEDSA-N 0 0 369.400 3.495 10 0 FGAERN CC(=O)Nc1cc(C(=O)N2CCC[C@@H]2c2noc(C(C)C)n2)ccc1F ZINC000173598914 495606348 /nfs/dbraw/zinc/60/63/48/495606348.db2.gz CPKTXIFJRYACTR-OAHLLOKOSA-N 0 0 360.389 3.268 10 0 FGAERN COc1cccc(F)c1[C@H](C)NC(=O)N1CCC[C@H]1Cn1ccnc1C ZINC000176350388 495614247 /nfs/dbraw/zinc/61/42/47/495614247.db2.gz GEOMZQCORRKIJO-ZFWWWQNUSA-N 0 0 360.433 3.274 10 0 FGAERN COc1cccc(F)c1[C@@H](C)NC(=O)N1CCC[C@@H]1Cn1ccnc1C ZINC000176350434 495614397 /nfs/dbraw/zinc/61/43/97/495614397.db2.gz GEOMZQCORRKIJO-UKRRQHHQSA-N 0 0 360.433 3.274 10 0 FGAERN COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)C(=O)N[C@H]1C[C@@H]1C ZINC000170821583 495614724 /nfs/dbraw/zinc/61/47/24/495614724.db2.gz HCYMGINVGAGSMQ-JSGCOSHPSA-N 0 0 372.396 3.398 10 0 FGAERN CC[C@@H](O)CN1CCN(C(=O)Nc2cccc(-c3cccs3)c2)CC1 ZINC000176350393 495615276 /nfs/dbraw/zinc/61/52/76/495615276.db2.gz WGFCUSYQKIMQHK-QGZVFWFLSA-N 0 0 359.495 3.336 10 0 FGAERN CCN(c1ccccc1)S(=O)(=O)c1ccc(NC(=O)N[C@@H]2C[C@@H]2C)cc1 ZINC000170823494 495615954 /nfs/dbraw/zinc/61/59/54/495615954.db2.gz FMVYWTILJPLMBO-KBXCAEBGSA-N 0 0 373.478 3.432 10 0 FGAERN O=C(Nc1ccn(CCc2ccncc2)n1)NC1C2CC3CC(C2)CC1C3 ZINC000173620996 495618412 /nfs/dbraw/zinc/61/84/12/495618412.db2.gz RANRVKURXFTEPM-UHFFFAOYSA-N 0 0 365.481 3.467 10 0 FGAERN COC[C@@H](C)C(=O)N[C@H](c1cccc(OC)c1)c1cc(F)ccc1OC ZINC000173619065 495618769 /nfs/dbraw/zinc/61/87/69/495618769.db2.gz GBRFEJHOAINOMI-BFUOFWGJSA-N 0 0 361.413 3.331 10 0 FGAERN CCN(Cc1ccc(C(=O)N(C)C)cc1)C(=O)N[C@@H]1COc2ccccc21 ZINC000170833741 495619898 /nfs/dbraw/zinc/61/98/98/495619898.db2.gz LAXJPTUYDNCJCB-GOSISDBHSA-N 0 0 367.449 3.054 10 0 FGAERN Cc1cnn(C[C@H]2CN(C(=O)c3ccc(Oc4ccccc4)o3)CCO2)c1 ZINC000176367589 495622842 /nfs/dbraw/zinc/62/28/42/495622842.db2.gz UDXBTKUIIRJXFC-QGZVFWFLSA-N 0 0 367.405 3.118 10 0 FGAERN COC(=O)Nc1ccc(NC(=O)N2CCC[C@H]2c2cnn(C)c2)cc1F ZINC000182578696 495623447 /nfs/dbraw/zinc/62/34/47/495623447.db2.gz NVLDZLUQERXBDB-HNNXBMFYSA-N 0 0 361.377 3.107 10 0 FGAERN C[C@@H](NCc1nnc2n1CCCC2)c1nc(Cc2ccc(Cl)cc2)no1 ZINC000173633494 495624769 /nfs/dbraw/zinc/62/47/69/495624769.db2.gz WSVHSBJXRBZURS-GFCCVEGCSA-N 0 0 372.860 3.092 10 0 FGAERN C[C@H](NC(=O)NCCc1ccc(Cl)nc1)c1ccc2c(c1)OCCO2 ZINC000154484777 495631359 /nfs/dbraw/zinc/63/13/59/495631359.db2.gz SSEDIZTXQLMREL-LBPRGKRZSA-N 0 0 361.829 3.109 10 0 FGAERN CCOc1ccc(OCC(=O)N2CCC[C@H]2C[C@H](O)c2ccco2)cc1 ZINC000154486468 495631556 /nfs/dbraw/zinc/63/15/56/495631556.db2.gz HQDLOEYEWYQGJT-YJBOKZPZSA-N 0 0 359.422 3.172 10 0 FGAERN Cc1cnn(C[C@H]2CN(Cc3ccc(-c4ccc(F)cc4)o3)CCO2)c1 ZINC000179537027 495632601 /nfs/dbraw/zinc/63/26/01/495632601.db2.gz FKFDAIPTTIDENJ-LJQANCHMSA-N 0 0 355.413 3.492 10 0 FGAERN CCc1ccc(NC(=O)C(=O)N[C@H](C)c2cccc(-n3ccnc3)c2)cc1 ZINC000173655422 495635402 /nfs/dbraw/zinc/63/54/02/495635402.db2.gz NQPYNMULIZPDGA-OAHLLOKOSA-N 0 0 362.433 3.251 10 0 FGAERN CCOCc1cccc(NC(=O)N2CCC[C@H](Cc3noc(C)n3)C2)c1 ZINC000170877554 495638421 /nfs/dbraw/zinc/63/84/21/495638421.db2.gz QONKQWGXTQSJBT-OAHLLOKOSA-N 0 0 358.442 3.401 10 0 FGAERN COC(=O)[C@H]1CCCN1Cc1ncc(-c2cccc(Br)c2)o1 ZINC000173665838 495639528 /nfs/dbraw/zinc/63/95/28/495639528.db2.gz DMDKBXIJLQBFLY-CYBMUJFWSA-N 0 0 365.227 3.242 10 0 FGAERN CC(C)[C@@H]1CCc2ccccc2[C@H]1NC(=O)N1CC[C@H](N2CCOCC2)C1 ZINC000185605011 495640333 /nfs/dbraw/zinc/64/03/33/495640333.db2.gz JZOGMEQYOKIJQE-ZJOUEHCJSA-N 0 0 371.525 3.062 10 0 FGAERN CCO[C@@H]1C[C@H](NC(=O)N[C@@H](C)Cc2ccccc2F)C12CCOCC2 ZINC000185606674 495641409 /nfs/dbraw/zinc/64/14/09/495641409.db2.gz HSEAGBXRGBPJIP-JCGIZDLHSA-N 0 0 364.461 3.030 10 0 FGAERN CCN(CC)C(=O)[C@H]1CCCN1C(=O)NCc1c(C)oc2ccccc21 ZINC000185607706 495641727 /nfs/dbraw/zinc/64/17/27/495641727.db2.gz AKPNJPPBPANVCC-QGZVFWFLSA-N 0 0 357.454 3.284 10 0 FGAERN COc1cc(C(=O)N2CCC[C@H](n3cncn3)C2)ccc1OCCC(C)C ZINC000170896834 495646218 /nfs/dbraw/zinc/64/62/18/495646218.db2.gz GQVPDUCIUJBBJF-KRWDZBQOSA-N 0 0 372.469 3.189 10 0 FGAERN Cc1nc(C[C@@H]2CCCN(C(=O)NCc3cc4ccccc4o3)C2)no1 ZINC000170898520 495646780 /nfs/dbraw/zinc/64/67/80/495646780.db2.gz UMNPXBJKODPNIL-AWEZNQCLSA-N 0 0 354.410 3.289 10 0 FGAERN O=C(CCc1ccc(Cl)cc1Cl)N1CCC[C@H](n2cncn2)C1 ZINC000170898148 495647392 /nfs/dbraw/zinc/64/73/92/495647392.db2.gz SJAKSZMLGVTCLK-AWEZNQCLSA-N 0 0 353.253 3.381 10 0 FGAERN C[C@H]1CN(C(=O)CCn2c(=S)[nH]nc2-c2cccs2)CCS1 ZINC000170901635 495648273 /nfs/dbraw/zinc/64/82/73/495648273.db2.gz OMQPFQNKCMNDMU-JTQLQIEISA-N 0 0 354.526 3.023 10 0 FGAERN CC(C)c1nc2n(n1)C[C@H](NC(=O)N[C@@H]1c3ccccc3CC[C@@H]1C)CC2 ZINC000179578138 495648482 /nfs/dbraw/zinc/64/84/82/495648482.db2.gz CXQGSJPOURHJDR-GMBSWORKSA-N 0 0 367.497 3.339 10 0 FGAERN CCc1nc(C2(NCC(=O)Nc3ccc(F)cc3Cl)CCCC2)no1 ZINC000173689862 495649595 /nfs/dbraw/zinc/64/95/95/495649595.db2.gz GRXCTWHWDGTBEF-UHFFFAOYSA-N 0 0 366.824 3.422 10 0 FGAERN O=C(NCC1(c2ccc(F)cc2)CCCCC1)N[C@H]1CCCn2ncnc21 ZINC000176445759 495652843 /nfs/dbraw/zinc/65/28/43/495652843.db2.gz DIAAVDQILCRBHM-KRWDZBQOSA-N 0 0 371.460 3.453 10 0 FGAERN O=C(CNC1(c2noc(C3CC3)n2)CCCC1)NCCC1=CCCCC1 ZINC000173707745 495656990 /nfs/dbraw/zinc/65/69/90/495656990.db2.gz SFFDBTSXNGEDDS-UHFFFAOYSA-N 0 0 358.486 3.313 10 0 FGAERN Cc1nc2n(n1)CCC[C@@H]2NC(=O)c1cnc(Cc2ccccc2F)s1 ZINC000185649544 495662246 /nfs/dbraw/zinc/66/22/46/495662246.db2.gz AYMQTONWAISIOU-AWEZNQCLSA-N 0 0 371.441 3.038 10 0 FGAERN CC(C)c1nc2n(n1)C[C@@H](NC(=O)NCc1ccc3ccccc3c1)CC2 ZINC000159125488 495664052 /nfs/dbraw/zinc/66/40/52/495664052.db2.gz PTQUKYZKYFJTDZ-SFHVURJKSA-N 0 0 363.465 3.369 10 0 FGAERN CC(C)c1nc([C@H]2CCCN2S(=O)(=O)c2cccc3cccnc32)no1 ZINC000173723978 495664955 /nfs/dbraw/zinc/66/49/55/495664955.db2.gz VMWVVMRHSQGQSR-CQSZACIVSA-N 0 0 372.450 3.267 10 0 FGAERN 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CCCC(=O)N[C@H]1CCCN(C(=O)NCC2(CCOC)CCCCC2)C1 ZINC000186299100 495935276 /nfs/dbraw/zinc/93/52/76/495935276.db2.gz TURLCOOWQBZHCZ-KRWDZBQOSA-N 0 0 367.534 3.064 10 0 FGAERN CCSCc1cc(C(=O)N2C[C@@H](O)C[C@@H]2c2cc(F)ccc2F)no1 ZINC000186301706 495936012 /nfs/dbraw/zinc/93/60/12/495936012.db2.gz SFPXVIVQEWTJOU-MEDUHNTESA-N 0 0 368.405 3.154 10 0 FGAERN Cc1cnn(CCNC(=O)Nc2ccc3nc(-c4ccccn4)oc3c2)c1 ZINC000180294734 495940090 /nfs/dbraw/zinc/94/00/90/495940090.db2.gz NKUFNGKXERYDJB-UHFFFAOYSA-N 0 0 362.393 3.216 10 0 FGAERN COCCNc1ccccc1CNC(=O)[C@H]1C[C@H]1c1ccc(F)c(F)c1 ZINC000155404541 495948518 /nfs/dbraw/zinc/94/85/18/495948518.db2.gz PKWRRRCGGROIKC-HOTGVXAUSA-N 0 0 360.404 3.443 10 0 FGAERN COCc1nc2n(n1)CCC[C@H]2NC(=O)CCCc1cc(C)sc1C ZINC000155409148 495949362 /nfs/dbraw/zinc/94/93/62/495949362.db2.gz PYLHFFNZAJHUQI-OAHLLOKOSA-N 0 0 362.499 3.077 10 0 FGAERN Cc1nccn1C[C@@H]1CCCN1C(=O)c1ccc(N2CCCCCC2)nc1 ZINC000177167622 495956762 /nfs/dbraw/zinc/95/67/62/495956762.db2.gz 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